NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
636582 | 6fw4 | 25689 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 ALA 22 H ALA 22 13.346 2.045 -19.680 2 HA ALA 22 HA ALA 22 11.083 3.593 -18.736 3 HB1 ALA 22 1HB ALA 22 9.875 2.058 -20.265 4 HB2 ALA 22 2HB ALA 22 10.633 0.676 -19.480 5 HB3 ALA 22 3HB ALA 22 9.491 1.669 -18.577 6 H ALA 23 H ALA 23 13.260 0.870 -18.242 7 HA ALA 23 HA ALA 23 14.676 0.438 -16.556 8 HB1 ALA 23 1HB ALA 23 14.639 2.922 -16.204 9 HB2 ALA 23 2HB ALA 23 13.362 2.689 -14.981 10 HB3 ALA 23 3HB ALA 23 14.974 1.983 -14.731 11 H ARG 24 H ARG 24 11.414 1.037 -15.299 12 HA ARG 24 HA ARG 24 9.875 -0.328 -14.476 13 HB2 ARG 24 2HB ARG 24 11.804 -2.616 -14.996 14 HB3 ARG 24 3HB ARG 24 10.106 -2.797 -14.606 15 HG2 ARG 24 2HG ARG 24 11.145 -1.283 -17.036 16 HG3 ARG 24 3HG ARG 24 10.694 -2.973 -17.046 17 HD2 ARG 24 2HD ARG 24 8.777 -0.714 -16.312 18 HD3 ARG 24 3HD ARG 24 8.917 -1.396 -17.918 19 HE ARG 24 HE ARG 24 7.625 -2.624 -15.602 20 HH11 ARG 24 1HH1 ARG 24 8.956 -3.302 -18.826 21 HH12 ARG 24 2HH1 ARG 24 8.148 -4.852 -18.906 22 HH21 ARG 24 1HH2 ARG 24 6.622 -4.675 -15.851 23 HH22 ARG 24 2HH2 ARG 24 6.939 -5.593 -17.310 24 H GLN 25 H GLN 25 12.422 0.502 -12.750 25 HA GLN 25 HA GLN 25 11.907 -1.219 -10.391 26 HB2 GLN 25 2HB GLN 25 13.876 1.056 -10.542 27 HB3 GLN 25 3HB GLN 25 13.847 -0.295 -9.416 28 HG2 GLN 25 2HG GLN 25 14.596 -0.363 -12.364 29 HG3 GLN 25 3HG GLN 25 15.656 -0.605 -10.998 30 HE21 GLN 25 1HE2 GLN 25 13.947 -2.243 -13.394 31 HE22 GLN 25 2HE2 GLN 25 13.863 -3.811 -12.585 32 H GLN 26 H GLN 26 11.061 1.895 -11.567 33 HA GLN 26 HA GLN 26 9.805 2.746 -9.019 34 HB2 GLN 26 2HB GLN 26 10.922 4.835 -9.071 35 HB3 GLN 26 3HB GLN 26 12.140 3.565 -9.134 36 HG2 GLN 26 2HG GLN 26 11.151 5.219 -11.494 37 HG3 GLN 26 3HG GLN 26 12.669 5.462 -10.640 38 HE21 GLN 26 1HE2 GLN 26 14.380 3.761 -10.872 39 HE22 GLN 26 2HE2 GLN 26 14.317 2.716 -12.271 40 H PHE 27 H PHE 27 9.814 2.876 -12.519 41 HA PHE 27 HA PHE 27 8.489 5.134 -13.121 42 HB2 PHE 27 2HB PHE 27 8.322 4.295 -15.211 43 HB3 PHE 27 3HB PHE 27 9.527 3.186 -14.551 44 HD1 PHE 27 HD1 PHE 27 8.553 1.003 -13.455 45 HD2 PHE 27 HD2 PHE 27 6.363 3.485 -16.182 46 HE1 PHE 27 HE1 PHE 27 6.980 -0.873 -13.882 47 HE2 PHE 27 HE2 PHE 27 4.787 1.615 -16.639 48 HZ PHE 27 HZ PHE 27 5.100 -0.585 -15.500 49 H VAL 28 H VAL 28 6.900 2.625 -11.447 50 HA VAL 28 HA VAL 28 4.164 3.033 -12.162 51 HB VAL 28 HB VAL 28 3.670 2.482 -9.738 52 HG11 VAL 28 1HG1 VAL 28 5.425 0.524 -11.301 53 HG12 VAL 28 2HG1 VAL 28 4.284 0.104 -10.009 54 HG13 VAL 28 3HG1 VAL 28 3.686 0.785 -11.532 55 HG21 VAL 28 1HG2 VAL 28 5.433 1.555 -8.326 56 HG22 VAL 28 2HG2 VAL 28 6.670 1.951 -9.528 57 HG23 VAL 28 3HG2 VAL 28 5.784 3.248 -8.684 58 H THR 29 H THR 29 6.376 5.024 -10.277 59 HA THR 29 HA THR 29 4.473 6.916 -9.268 60 HB THR 29 HB THR 29 6.824 6.481 -8.564 61 HG1 THR 29 HG1 THR 29 7.064 8.645 -7.916 62 HG21 THR 29 1HG2 THR 29 7.855 6.780 -10.893 63 HG22 THR 29 2HG2 THR 29 8.667 7.653 -9.577 64 HG23 THR 29 3HG2 THR 29 7.584 8.520 -10.702 65 H SER 30 H SER 30 5.877 6.586 -12.476 66 HA SER 30 HA SER 30 4.699 9.158 -13.318 67 HB2 SER 30 2HB SER 30 6.107 6.997 -14.962 68 HB3 SER 30 3HB SER 30 5.654 8.618 -15.527 69 HG SER 30 HG SER 30 7.874 8.495 -14.913 70 H GLU 31 H GLU 31 3.987 5.696 -13.498 71 HA GLU 31 HA GLU 31 1.709 6.063 -15.247 72 HB2 GLU 31 2HB GLU 31 2.455 3.848 -13.322 73 HB3 GLU 31 3HB GLU 31 0.990 3.803 -14.287 74 HG2 GLU 31 2HG GLU 31 3.693 4.207 -15.580 75 HG3 GLU 31 3HG GLU 31 3.083 2.600 -15.174 76 H VAL 32 H VAL 32 2.115 6.344 -11.689 77 HA VAL 32 HA VAL 32 -0.741 6.313 -11.237 78 HB VAL 32 HB VAL 32 1.040 5.843 -9.526 79 HG11 VAL 32 1HG1 VAL 32 1.797 7.652 -8.067 80 HG12 VAL 32 2HG1 VAL 32 2.359 7.922 -9.708 81 HG13 VAL 32 3HG1 VAL 32 0.995 8.864 -9.084 82 HG21 VAL 32 1HG2 VAL 32 -1.241 7.690 -8.732 83 HG22 VAL 32 2HG2 VAL 32 -1.377 5.950 -9.046 84 HG23 VAL 32 3HG2 VAL 32 -0.414 6.525 -7.671 85 H GLY 33 H GLY 33 1.468 8.701 -12.246 86 HA2 GLY 33 HA2 GLY 33 -0.142 11.103 -11.964 87 HA3 GLY 33 HA3 GLY 33 1.299 10.876 -12.992 88 H ARG 34 H ARG 34 -0.265 8.420 -14.246 89 HA ARG 34 HA ARG 34 -2.195 9.952 -15.937 90 HB2 ARG 34 2HB ARG 34 -1.175 7.112 -16.282 91 HB3 ARG 34 3HB ARG 34 -2.198 8.055 -17.372 92 HG2 ARG 34 2HG ARG 34 -0.244 9.766 -17.404 93 HG3 ARG 34 3HG ARG 34 0.743 8.474 -16.710 94 HD2 ARG 34 2HD ARG 34 -0.864 8.193 -19.260 95 HD3 ARG 34 3HD ARG 34 0.798 8.808 -19.226 96 HE ARG 34 HE ARG 34 0.708 6.241 -17.921 97 HH11 ARG 34 1HH1 ARG 34 0.565 7.634 -21.191 98 HH12 ARG 34 2HH1 ARG 34 1.263 6.213 -21.902 99 HH21 ARG 34 1HH2 ARG 34 1.536 4.512 -18.875 100 HH22 ARG 34 2HH2 ARG 34 1.819 4.430 -20.608 101 H TYR 35 H TYR 35 -1.974 6.868 -14.167 102 HA TYR 35 HA TYR 35 -4.485 5.836 -14.562 103 HB2 TYR 35 2HB TYR 35 -2.456 5.575 -12.323 104 HB3 TYR 35 3HB TYR 35 -3.993 4.764 -12.196 105 HD1 TYR 35 HD1 TYR 35 -1.756 5.171 -15.241 106 HD2 TYR 35 HD2 TYR 35 -3.545 2.518 -12.364 107 HE1 TYR 35 HE1 TYR 35 -1.050 3.259 -16.608 108 HE2 TYR 35 HE2 TYR 35 -2.964 0.592 -13.765 109 HH TYR 35 HH TYR 35 -1.702 -0.128 -15.597 110 H GLY 36 H GLY 36 -3.579 7.832 -11.772 111 HA2 GLY 36 HA2 GLY 36 -6.341 8.075 -10.814 112 HA3 GLY 36 HA3 GLY 36 -4.898 8.838 -10.111 113 H ALA 37 H ALA 37 -4.410 9.815 -13.119 114 HA ALA 37 HA ALA 37 -5.631 12.380 -12.655 115 HB1 ALA 37 1HB ALA 37 -3.378 12.270 -13.525 116 HB2 ALA 37 2HB ALA 37 -3.942 11.416 -14.980 117 HB3 ALA 37 3HB ALA 37 -4.448 13.087 -14.674 118 H ILE 38 H ILE 38 -6.284 9.565 -14.727 119 HA ILE 38 HA ILE 38 -8.157 10.817 -16.487 120 HB ILE 38 HB ILE 38 -8.859 8.647 -17.098 121 HG12 ILE 38 2HG1 ILE 38 -7.947 7.778 -14.355 122 HG13 ILE 38 3HG1 ILE 38 -9.554 7.663 -15.063 123 HG21 ILE 38 1HG2 ILE 38 -6.376 9.255 -17.499 124 HG22 ILE 38 2HG2 ILE 38 -6.012 8.048 -16.232 125 HG23 ILE 38 3HG2 ILE 38 -6.851 7.564 -17.694 126 HD11 ILE 38 1HD1 ILE 38 -7.151 5.959 -15.775 127 HD12 ILE 38 2HD1 ILE 38 -8.644 5.470 -14.953 128 HD13 ILE 38 3HD1 ILE 38 -8.722 5.943 -16.645 129 H TYR 39 H TYR 39 -8.498 9.773 -13.207 130 HA TYR 39 HA TYR 39 -11.401 10.060 -13.146 131 HB2 TYR 39 2HB TYR 39 -9.400 9.721 -10.880 132 HB3 TYR 39 3HB TYR 39 -11.148 9.611 -10.743 133 HD1 TYR 39 HD1 TYR 39 -8.108 7.781 -11.750 134 HD2 TYR 39 HD2 TYR 39 -12.403 7.752 -11.752 135 HE1 TYR 39 HE1 TYR 39 -8.060 5.345 -12.468 136 HE2 TYR 39 HE2 TYR 39 -12.361 5.439 -12.636 137 HH TYR 39 HH TYR 39 -11.145 3.674 -13.268 138 H THR 40 H THR 40 -8.631 11.808 -11.666 139 HA THR 40 HA THR 40 -10.179 13.857 -10.476 140 HB THR 40 HB THR 40 -7.762 13.020 -10.051 141 HG1 THR 40 HG1 THR 40 -7.408 15.033 -9.032 142 HG21 THR 40 1HG2 THR 40 -6.972 15.451 -11.659 143 HG22 THR 40 2HG2 THR 40 -6.980 13.819 -12.356 144 HG23 THR 40 3HG2 THR 40 -5.953 14.165 -10.955 145 H GLN 41 H GLN 41 -8.749 13.714 -13.708 146 HA GLN 41 HA GLN 41 -9.277 16.498 -14.371 147 HB2 GLN 41 2HB GLN 41 -8.610 14.020 -16.012 148 HB3 GLN 41 3HB GLN 41 -8.793 15.627 -16.717 149 HG2 GLN 41 2HG GLN 41 -6.706 14.850 -14.633 150 HG3 GLN 41 3HG GLN 41 -6.419 15.063 -16.353 151 HE21 GLN 41 1HE2 GLN 41 -5.157 16.521 -14.062 152 HE22 GLN 41 2HE2 GLN 41 -5.585 18.204 -14.322 153 H LEU 42 H LEU 42 -11.138 13.453 -14.678 154 HA LEU 42 HA LEU 42 -13.211 14.751 -16.274 155 HB2 LEU 42 2HB LEU 42 -12.757 12.258 -16.246 156 HB3 LEU 42 3HB LEU 42 -13.370 12.247 -14.583 157 HG LEU 42 HG LEU 42 -15.581 13.030 -15.383 158 HD11 LEU 42 1HD1 LEU 42 -16.077 12.974 -17.851 159 HD12 LEU 42 2HD1 LEU 42 -14.335 12.830 -18.161 160 HD13 LEU 42 3HD1 LEU 42 -14.996 14.294 -17.397 161 HD21 LEU 42 1HD2 LEU 42 -16.217 10.966 -16.639 162 HD22 LEU 42 2HD2 LEU 42 -15.261 10.662 -15.185 163 HD23 LEU 42 3HD2 LEU 42 -14.488 10.563 -16.784 164 H ILE 43 H ILE 43 -12.622 14.240 -12.820 165 HA ILE 43 HA ILE 43 -15.197 15.154 -11.908 166 HB ILE 43 HB ILE 43 -12.495 14.656 -10.641 167 HG12 ILE 43 2HG1 ILE 43 -13.968 13.321 -9.108 168 HG13 ILE 43 3HG1 ILE 43 -15.384 13.890 -10.025 169 HG21 ILE 43 1HG2 ILE 43 -13.381 15.448 -8.471 170 HG22 ILE 43 2HG2 ILE 43 -13.156 16.786 -9.560 171 HG23 ILE 43 3HG2 ILE 43 -14.807 16.145 -9.309 172 HD11 ILE 43 1HD1 ILE 43 -14.438 12.682 -12.037 173 HD12 ILE 43 2HD1 ILE 43 -13.169 12.035 -10.940 174 HD13 ILE 43 3HD1 ILE 43 -14.879 11.642 -10.665 175 H ARG 44 H ARG 44 -12.066 16.884 -12.040 176 HA ARG 44 HA ARG 44 -13.192 19.366 -11.214 177 HB2 ARG 44 2HB ARG 44 -11.069 20.319 -11.609 178 HB3 ARG 44 3HB ARG 44 -10.815 18.650 -11.112 179 HG2 ARG 44 2HG ARG 44 -9.289 18.751 -12.786 180 HG3 ARG 44 3HG ARG 44 -10.683 18.150 -13.681 181 HD2 ARG 44 2HD ARG 44 -11.148 20.471 -14.476 182 HD3 ARG 44 3HD ARG 44 -9.749 21.056 -13.544 183 HE ARG 44 HE ARG 44 -8.724 19.041 -15.158 184 HH11 ARG 44 1HH1 ARG 44 -10.360 22.113 -15.884 185 HH12 ARG 44 2HH1 ARG 44 -9.577 22.222 -17.433 186 HH21 ARG 44 1HH2 ARG 44 -7.797 19.246 -17.052 187 HH22 ARG 44 2HH2 ARG 44 -8.111 20.618 -18.099 188 H GLN 45 H GLN 45 -13.182 17.872 -14.350 189 HA GLN 45 HA GLN 45 -13.798 20.369 -15.757 190 HB2 GLN 45 2HB GLN 45 -13.580 19.345 -17.651 191 HB3 GLN 45 3HB GLN 45 -12.602 18.320 -16.612 192 HG2 GLN 45 2HG GLN 45 -14.499 16.671 -16.562 193 HG3 GLN 45 3HG GLN 45 -15.399 17.731 -17.669 194 HE21 GLN 45 1HE2 GLN 45 -12.005 16.497 -17.414 195 HE22 GLN 45 2HE2 GLN 45 -11.857 16.222 -19.142 196 H ASN 46 H ASN 46 -15.736 18.356 -13.690 197 HA ASN 46 HA ASN 46 -18.268 19.316 -14.913 198 HB2 ASN 46 2HB ASN 46 -17.656 18.035 -12.232 199 HB3 ASN 46 3HB ASN 46 -19.264 18.445 -12.828 200 HD21 ASN 46 1HD2 ASN 46 -16.955 16.008 -12.644 201 HD22 ASN 46 2HD2 ASN 46 -17.843 14.881 -13.677 202 H LEU 47 H LEU 47 -16.063 20.060 -12.202 203 HA LEU 47 HA LEU 47 -17.447 22.646 -11.741 204 HB2 LEU 47 2HB LEU 47 -16.398 21.808 -9.275 205 HB3 LEU 47 3HB LEU 47 -18.056 22.096 -9.744 206 HG LEU 47 HG LEU 47 -17.956 19.558 -10.511 207 HD11 LEU 47 1HD1 LEU 47 -15.484 19.326 -10.112 208 HD12 LEU 47 2HD1 LEU 47 -16.431 18.199 -9.105 209 HD13 LEU 47 3HD1 LEU 47 -15.748 19.662 -8.391 210 HD21 LEU 47 1HD2 LEU 47 -18.059 20.479 -7.633 211 HD22 LEU 47 2HD2 LEU 47 -18.600 18.883 -8.217 212 HD23 LEU 47 3HD2 LEU 47 -19.419 20.358 -8.775 213 H LEU 48 H LEU 48 -15.956 23.703 -12.997 214 HA LEU 48 HA LEU 48 -13.107 23.421 -12.706 215 HB2 LEU 48 2HB LEU 48 -13.071 25.293 -14.402 216 HB3 LEU 48 3HB LEU 48 -13.861 23.797 -14.838 217 HG LEU 48 HG LEU 48 -16.065 24.745 -14.581 218 HD11 LEU 48 1HD1 LEU 48 -16.457 27.161 -14.232 219 HD12 LEU 48 2HD1 LEU 48 -14.737 27.385 -13.853 220 HD13 LEU 48 3HD1 LEU 48 -15.771 26.409 -12.793 221 HD21 LEU 48 1HD2 LEU 48 -14.880 24.920 -16.723 222 HD22 LEU 48 2HD2 LEU 48 -14.234 26.505 -16.252 223 HD23 LEU 48 3HD2 LEU 48 -15.983 26.288 -16.489 224 H VAL 49 H VAL 49 -13.957 24.004 -10.204 225 HA VAL 49 HA VAL 49 -14.002 26.854 -9.686 226 HB VAL 49 HB VAL 49 -13.809 24.674 -7.590 227 HG11 VAL 49 1HG1 VAL 49 -14.985 26.391 -6.186 228 HG12 VAL 49 2HG1 VAL 49 -13.366 26.915 -6.672 229 HG13 VAL 49 3HG1 VAL 49 -14.798 27.566 -7.492 230 HG21 VAL 49 1HG2 VAL 49 -15.782 24.228 -9.015 231 HG22 VAL 49 2HG2 VAL 49 -16.303 24.848 -7.456 232 HG23 VAL 49 3HG2 VAL 49 -16.293 25.915 -8.877 233 H GLU 50 H GLU 50 -11.758 24.376 -8.441 234 HA GLU 50 HA GLU 50 -9.533 24.240 -8.220 235 HB2 GLU 50 2HB GLU 50 -9.271 26.830 -9.791 236 HB3 GLU 50 3HB GLU 50 -8.016 25.637 -9.466 237 HG2 GLU 50 2HG GLU 50 -9.375 23.923 -10.704 238 HG3 GLU 50 3HG GLU 50 -10.512 25.199 -11.154 239 H ASP 51 H ASP 51 -10.385 27.702 -7.701 240 HA ASP 51 HA ASP 51 -8.181 28.273 -6.033 241 HB2 ASP 51 2HB ASP 51 -9.532 29.909 -7.325 242 HB3 ASP 51 3HB ASP 51 -10.870 29.672 -6.211 243 H SER 52 H SER 52 -11.406 27.086 -5.148 244 HA SER 52 HA SER 52 -10.710 27.080 -2.253 245 HB2 SER 52 2HB SER 52 -13.060 26.538 -1.907 246 HB3 SER 52 3HB SER 52 -12.873 28.020 -2.851 247 HG SER 52 HG SER 52 -14.462 26.723 -3.803 248 H PHE 53 H PHE 53 -9.996 25.098 -4.749 249 HA PHE 53 HA PHE 53 -10.295 22.560 -3.214 250 HB2 PHE 53 2HB PHE 53 -9.559 23.101 -6.106 251 HB3 PHE 53 3HB PHE 53 -9.665 21.520 -5.364 252 HD1 PHE 53 HD1 PHE 53 -11.123 22.201 -7.841 253 HD2 PHE 53 HD2 PHE 53 -12.360 22.646 -3.720 254 HE1 PHE 53 HE1 PHE 53 -13.471 21.770 -8.472 255 HE2 PHE 53 HE2 PHE 53 -14.659 22.285 -4.358 256 HZ PHE 53 HZ PHE 53 -15.268 21.821 -6.751 257 H ARG 54 H ARG 54 -8.021 24.904 -4.455 258 HA ARG 54 HA ARG 54 -5.644 23.440 -3.477 259 HB2 ARG 54 2HB ARG 54 -4.388 24.933 -4.717 260 HB3 ARG 54 3HB ARG 54 -5.805 24.539 -5.700 261 HG2 ARG 54 2HG ARG 54 -6.845 26.725 -4.845 262 HG3 ARG 54 3HG ARG 54 -5.249 27.142 -4.216 263 HD2 ARG 54 2HD ARG 54 -5.977 26.464 -7.098 264 HD3 ARG 54 3HD ARG 54 -5.627 28.081 -6.482 265 HE ARG 54 HE ARG 54 -3.699 25.850 -6.931 266 HH11 ARG 54 1HH1 ARG 54 -4.069 29.232 -5.936 267 HH12 ARG 54 2HH1 ARG 54 -2.366 29.548 -6.085 268 HH21 ARG 54 1HH2 ARG 54 -1.527 26.338 -7.128 269 HH22 ARG 54 2HH2 ARG 54 -0.949 27.924 -6.713 270 H GLY 55 H GLY 55 -3.978 24.916 -2.341 271 HA2 GLY 55 HA2 GLY 55 -3.284 26.358 -0.656 272 HA3 GLY 55 HA3 GLY 55 -4.913 27.056 -0.608 273 H LYS 56 H LYS 56 -6.243 24.574 -0.019 274 HA LYS 56 HA LYS 56 -5.349 23.831 2.743 275 HB2 LYS 56 2HB LYS 56 -7.696 22.974 2.988 276 HB3 LYS 56 3HB LYS 56 -7.544 24.703 2.785 277 HG2 LYS 56 2HG LYS 56 -9.440 23.979 1.590 278 HG3 LYS 56 3HG LYS 56 -8.264 24.530 0.427 279 HD2 LYS 56 2HD LYS 56 -7.689 22.265 -0.216 280 HD3 LYS 56 3HD LYS 56 -8.683 21.568 1.079 281 HE2 LYS 56 2HE LYS 56 -9.617 23.244 -1.261 282 HE3 LYS 56 3HE LYS 56 -9.700 21.479 -1.200 283 HZ1 LYS 56 HZ1 LYS 56 -11.137 23.240 0.736 284 HZ2 LYS 56 HZ2 LYS 56 -11.363 21.634 0.513 285 HZ3 LYS 56 HZ3 LYS 56 -11.787 22.736 -0.655 286 H GLN 57 H GLN 57 -6.510 21.325 2.936 287 HA GLN 57 HA GLN 57 -5.288 19.741 0.728 288 HB2 GLN 57 2HB GLN 57 -3.841 18.670 2.096 289 HB3 GLN 57 3HB GLN 57 -3.995 20.075 3.065 290 HG2 GLN 57 2HG GLN 57 -4.424 18.726 4.739 291 HG3 GLN 57 3HG GLN 57 -6.059 18.611 4.133 292 HE21 GLN 57 1HE2 GLN 57 -4.424 16.884 1.782 293 HE22 GLN 57 2HE2 GLN 57 -4.542 15.323 2.571 294 H CYS 58 H CYS 58 -6.186 17.614 0.447 295 HA CYS 58 HA CYS 58 -8.466 16.757 2.055 296 HB2 CYS 58 2HB CYS 58 -9.474 18.410 0.496 297 HB3 CYS 58 3HB CYS 58 -8.807 17.503 -0.875 298 HG CYS 58 HG CYS 58 -10.165 15.333 -0.560 299 H ARG 59 H ARG 59 -8.946 14.559 1.782 300 HA ARG 59 HA ARG 59 -7.510 12.997 -0.231 301 HB2 ARG 59 2HB ARG 59 -6.787 11.326 1.384 302 HB3 ARG 59 3HB ARG 59 -5.950 12.858 1.539 303 HG2 ARG 59 2HG ARG 59 -8.158 12.954 3.366 304 HG3 ARG 59 3HG ARG 59 -7.423 11.363 3.553 305 HD2 ARG 59 2HD ARG 59 -5.978 13.998 3.568 306 HD3 ARG 59 3HD ARG 59 -6.528 13.140 5.031 307 HE ARG 59 HE ARG 59 -4.988 11.285 3.659 308 HH11 ARG 59 1HH1 ARG 59 -2.849 10.812 4.143 309 HH12 ARG 59 2HH1 ARG 59 -1.849 12.000 4.918 310 HH21 ARG 59 1HH2 ARG 59 -4.301 14.455 5.103 311 HH22 ARG 59 2HH2 ARG 59 -2.662 14.001 5.498 312 H VAL 60 H VAL 60 -8.913 11.810 -1.204 313 HA VAL 60 HA VAL 60 -11.067 10.430 0.298 314 HB VAL 60 HB VAL 60 -12.826 11.044 -1.202 315 HG11 VAL 60 1HG1 VAL 60 -12.352 12.619 0.710 316 HG12 VAL 60 2HG1 VAL 60 -11.409 13.620 -0.395 317 HG13 VAL 60 3HG1 VAL 60 -13.136 13.394 -0.675 318 HG21 VAL 60 1HG2 VAL 60 -12.581 12.660 -3.038 319 HG22 VAL 60 2HG2 VAL 60 -10.840 12.778 -2.728 320 HG23 VAL 60 3HG2 VAL 60 -11.537 11.244 -3.311 321 H ASN 61 H ASN 61 -12.138 8.787 -1.238 322 HA ASN 61 HA ASN 61 -10.102 7.611 -2.984 323 HB2 ASN 61 2HB ASN 61 -9.538 6.717 -0.924 324 HB3 ASN 61 3HB ASN 61 -11.167 6.801 -0.293 325 HD21 ASN 61 1HD2 ASN 61 -10.411 5.166 -3.345 326 HD22 ASN 61 2HD2 ASN 61 -10.796 3.564 -2.752 327 H LEU 62 H LEU 62 -10.830 6.748 -4.762 328 HA LEU 62 HA LEU 62 -13.796 6.352 -5.112 329 HB2 LEU 62 2HB LEU 62 -11.524 7.146 -6.931 330 HB3 LEU 62 3HB LEU 62 -12.937 6.347 -7.592 331 HG LEU 62 HG LEU 62 -14.387 8.151 -6.808 332 HD11 LEU 62 1HD1 LEU 62 -13.202 9.029 -4.833 333 HD12 LEU 62 2HD1 LEU 62 -13.370 10.320 -6.033 334 HD13 LEU 62 3HD1 LEU 62 -11.813 9.489 -5.843 335 HD21 LEU 62 1HD2 LEU 62 -13.536 9.850 -8.414 336 HD22 LEU 62 2HD2 LEU 62 -13.366 8.213 -9.041 337 HD23 LEU 62 3HD2 LEU 62 -11.946 9.068 -8.393 338 H LYS 63 H LYS 63 -14.493 4.366 -5.281 339 HA LYS 63 HA LYS 63 -12.702 2.186 -6.263 340 HB2 LYS 63 2HB LYS 63 -14.851 2.216 -4.143 341 HB3 LYS 63 3HB LYS 63 -14.341 0.710 -4.929 342 HG2 LYS 63 2HG LYS 63 -12.113 0.885 -4.144 343 HG3 LYS 63 3HG LYS 63 -12.272 2.575 -3.690 344 HD2 LYS 63 2HD LYS 63 -13.812 0.346 -2.284 345 HD3 LYS 63 3HD LYS 63 -12.201 0.921 -1.796 346 HE2 LYS 63 2HE LYS 63 -13.141 3.265 -1.659 347 HE3 LYS 63 3HE LYS 63 -14.751 2.585 -1.930 348 HZ1 LYS 63 HZ1 LYS 63 -12.948 1.892 0.330 349 HZ2 LYS 63 HZ2 LYS 63 -14.469 1.309 0.127 350 HZ3 LYS 63 HZ3 LYS 63 -14.217 2.905 0.426 351 H LEU 64 H LEU 64 -13.174 2.003 -8.416 352 HA LEU 64 HA LEU 64 -15.953 2.399 -9.315 353 HB2 LEU 64 2HB LEU 64 -13.397 2.158 -10.935 354 HB3 LEU 64 3HB LEU 64 -14.979 2.624 -11.518 355 HG LEU 64 HG LEU 64 -13.948 4.593 -11.509 356 HD11 LEU 64 1HD1 LEU 64 -15.937 4.948 -10.275 357 HD12 LEU 64 2HD1 LEU 64 -14.698 6.058 -9.692 358 HD13 LEU 64 3HD1 LEU 64 -15.139 4.639 -8.713 359 HD21 LEU 64 1HD2 LEU 64 -12.577 4.117 -8.861 360 HD22 LEU 64 2HD2 LEU 64 -12.376 5.489 -9.941 361 HD23 LEU 64 3HD2 LEU 64 -11.859 3.893 -10.488 362 H ILE 65 H ILE 65 -16.785 1.064 -10.962 363 HA ILE 65 HA ILE 65 -15.949 -1.821 -10.908 364 HB ILE 65 HB ILE 65 -18.238 -2.195 -11.942 365 HG12 ILE 65 2HG1 ILE 65 -18.961 0.549 -10.856 366 HG13 ILE 65 3HG1 ILE 65 -18.523 0.300 -12.548 367 HG21 ILE 65 1HG2 ILE 65 -19.371 -2.190 -9.770 368 HG22 ILE 65 2HG2 ILE 65 -17.692 -2.687 -9.582 369 HG23 ILE 65 3HG2 ILE 65 -18.180 -1.047 -9.114 370 HD11 ILE 65 1HD1 ILE 65 -20.842 -0.984 -11.103 371 HD12 ILE 65 2HD1 ILE 65 -20.893 0.312 -12.319 372 HD13 ILE 65 3HD1 ILE 65 -20.362 -1.313 -12.787 373 HA PRO 66 HA PRO 66 -14.647 -1.224 -15.137 374 HB2 PRO 66 2HB PRO 66 -14.784 -3.736 -16.197 375 HB3 PRO 66 3HB PRO 66 -13.595 -3.281 -14.937 376 HG2 PRO 66 2HG PRO 66 -16.279 -4.664 -14.571 377 HG3 PRO 66 3HG PRO 66 -14.692 -5.140 -13.887 378 HD2 PRO 66 2HD PRO 66 -16.523 -3.690 -12.472 379 HD3 PRO 66 3HD PRO 66 -14.772 -3.416 -12.283 380 H THR 67 H THR 67 -15.438 -0.952 -17.220 381 HA THR 67 HA THR 67 -17.958 -1.828 -18.277 382 HB THR 67 HB THR 67 -17.851 0.816 -16.843 383 HG1 THR 67 HG1 THR 67 -18.967 -1.150 -16.228 384 HG21 THR 67 1HG2 THR 67 -18.329 1.599 -19.136 385 HG22 THR 67 2HG2 THR 67 -19.784 1.658 -18.133 386 HG23 THR 67 3HG2 THR 67 -19.582 0.343 -19.314 387 H GLY 68 H GLY 68 -18.158 -1.215 -20.484 388 HA2 GLY 68 HA2 GLY 68 -15.629 -1.424 -21.711 389 HA3 GLY 68 HA3 GLY 68 -17.180 -1.244 -22.558 390 H THR 69 H THR 69 -17.434 1.512 -21.138 391 HA THR 69 HA THR 69 -15.811 3.104 -23.066 392 HB THR 69 HB THR 69 -17.332 4.947 -22.383 393 HG1 THR 69 HG1 THR 69 -19.214 4.217 -21.155 394 HG21 THR 69 1HG2 THR 69 -18.876 2.448 -23.228 395 HG22 THR 69 2HG2 THR 69 -17.895 3.446 -24.319 396 HG23 THR 69 3HG2 THR 69 -19.312 4.143 -23.526 397 H GLY 70 H GLY 70 -15.514 2.052 -19.898 398 HA2 GLY 70 HA2 GLY 70 -13.359 3.115 -18.837 399 HA3 GLY 70 HA3 GLY 70 -14.377 4.558 -18.793 400 H ALA 71 H ALA 71 -13.421 3.562 -16.373 401 HA ALA 71 HA ALA 71 -15.150 1.606 -15.171 402 HB1 ALA 71 1HB ALA 71 -12.746 2.220 -14.549 403 HB2 ALA 71 2HB ALA 71 -13.422 3.647 -13.720 404 HB3 ALA 71 3HB ALA 71 -13.880 1.994 -13.231 405 H LEU 72 H LEU 72 -16.629 2.025 -13.352 406 HA LEU 72 HA LEU 72 -18.105 4.641 -13.497 407 HB2 LEU 72 2HB LEU 72 -18.974 1.945 -14.234 408 HB3 LEU 72 3HB LEU 72 -19.868 2.463 -12.823 409 HG LEU 72 HG LEU 72 -20.660 4.461 -14.001 410 HD11 LEU 72 1HD1 LEU 72 -18.858 5.042 -15.444 411 HD12 LEU 72 2HD1 LEU 72 -20.211 4.599 -16.500 412 HD13 LEU 72 3HD1 LEU 72 -18.878 3.451 -16.247 413 HD21 LEU 72 1HD2 LEU 72 -21.920 2.334 -14.209 414 HD22 LEU 72 2HD2 LEU 72 -21.001 1.933 -15.677 415 HD23 LEU 72 3HD2 LEU 72 -22.084 3.336 -15.660 416 H LEU 73 H LEU 73 -18.854 5.498 -11.598 417 HA LEU 73 HA LEU 73 -17.620 4.740 -9.196 418 HB2 LEU 73 2HB LEU 73 -18.545 6.980 -9.854 419 HB3 LEU 73 3HB LEU 73 -20.152 6.406 -9.457 420 HG LEU 73 HG LEU 73 -18.958 7.853 -7.751 421 HD11 LEU 73 1HD1 LEU 73 -20.900 6.465 -7.112 422 HD12 LEU 73 2HD1 LEU 73 -19.740 6.707 -5.785 423 HD13 LEU 73 3HD1 LEU 73 -19.805 5.154 -6.630 424 HD21 LEU 73 1HD2 LEU 73 -17.359 5.348 -7.056 425 HD22 LEU 73 2HD2 LEU 73 -17.219 6.967 -6.344 426 HD23 LEU 73 3HD2 LEU 73 -16.709 6.692 -8.010 427 H GLY 74 H GLY 74 -17.715 2.968 -8.187 428 HA2 GLY 74 HA2 GLY 74 -20.255 1.514 -7.662 429 HA3 GLY 74 HA3 GLY 74 -18.600 0.972 -7.318 430 H SER 75 H SER 75 -17.508 3.136 -5.926 431 HA SER 75 HA SER 75 -19.284 3.918 -3.713 432 HB2 SER 75 2HB SER 75 -16.966 1.989 -3.343 433 HB3 SER 75 3HB SER 75 -17.652 2.953 -2.026 434 HG SER 75 HG SER 75 -18.545 0.824 -2.119 435 H LEU 76 H LEU 76 -18.475 5.684 -2.581 436 HA LEU 76 HA LEU 76 -15.689 6.561 -3.173 437 HB2 LEU 76 2HB LEU 76 -17.495 7.881 -4.392 438 HB3 LEU 76 3HB LEU 76 -18.042 8.483 -2.843 439 HG LEU 76 HG LEU 76 -15.096 8.724 -3.531 440 HD11 LEU 76 1HD1 LEU 76 -16.081 9.422 -5.587 441 HD12 LEU 76 2HD1 LEU 76 -15.619 10.897 -4.707 442 HD13 LEU 76 3HD1 LEU 76 -17.327 10.359 -4.738 443 HD21 LEU 76 1HD2 LEU 76 -15.266 10.861 -2.316 444 HD22 LEU 76 2HD2 LEU 76 -15.852 9.539 -1.311 445 HD23 LEU 76 3HD2 LEU 76 -17.008 10.623 -2.104 446 H THR 77 H THR 77 -14.514 6.705 -1.445 447 HA THR 77 HA THR 77 -15.737 6.914 1.301 448 HB THR 77 HB THR 77 -13.101 5.827 0.205 449 HG1 THR 77 HG1 THR 77 -15.273 4.709 1.686 450 HG21 THR 77 1HG2 THR 77 -12.547 6.905 2.352 451 HG22 THR 77 2HG2 THR 77 -12.614 5.149 2.582 452 HG23 THR 77 3HG2 THR 77 -13.969 6.165 3.128 453 H VAL 78 H VAL 78 -15.617 8.909 2.173 454 HA VAL 78 HA VAL 78 -13.415 10.746 1.357 455 HB VAL 78 HB VAL 78 -14.451 12.449 2.773 456 HG11 VAL 78 1HG1 VAL 78 -16.359 11.333 0.676 457 HG12 VAL 78 2HG1 VAL 78 -16.266 13.019 1.253 458 HG13 VAL 78 3HG1 VAL 78 -14.923 12.334 0.343 459 HG21 VAL 78 1HG2 VAL 78 -16.798 12.228 3.495 460 HG22 VAL 78 2HG2 VAL 78 -16.768 10.501 3.072 461 HG23 VAL 78 3HG2 VAL 78 -15.735 11.132 4.381 462 H LEU 79 H LEU 79 -11.562 10.875 2.554 463 HA LEU 79 HA LEU 79 -11.523 9.380 5.143 464 HB2 LEU 79 2HB LEU 79 -10.109 8.518 3.326 465 HB3 LEU 79 3HB LEU 79 -9.312 10.073 3.165 466 HG LEU 79 HG LEU 79 -8.364 9.851 5.432 467 HD11 LEU 79 1HD1 LEU 79 -9.727 7.112 5.459 468 HD12 LEU 79 2HD1 LEU 79 -10.049 8.472 6.564 469 HD13 LEU 79 3HD1 LEU 79 -8.483 7.647 6.613 470 HD21 LEU 79 1HD2 LEU 79 -6.773 8.040 4.917 471 HD22 LEU 79 2HD2 LEU 79 -7.108 9.007 3.478 472 HD23 LEU 79 3HD2 LEU 79 -7.875 7.420 3.658 473 H ASP 80 H ASP 80 -10.552 12.469 3.613 474 HA ASP 80 HA ASP 80 -11.270 13.967 5.905 475 HB2 ASP 80 2HB ASP 80 -8.752 12.928 6.343 476 HB3 ASP 80 3HB ASP 80 -8.347 14.415 5.521 477 H GLY 81 H GLY 81 -10.556 16.315 5.639 478 HA2 GLY 81 HA2 GLY 81 -9.236 17.695 3.864 479 HA3 GLY 81 HA3 GLY 81 -10.546 17.219 2.798 480 H ASP 82 H ASP 82 -10.132 19.776 2.974 481 HA ASP 82 HA ASP 82 -11.959 21.033 4.908 482 HB2 ASP 82 2HB ASP 82 -10.045 22.327 4.239 483 HB3 ASP 82 3HB ASP 82 -10.361 22.013 2.545 484 H SER 83 H SER 83 -14.063 21.112 4.619 485 HA SER 83 HA SER 83 -15.177 19.138 3.126 486 HB2 SER 83 2HB SER 83 -17.372 20.036 3.821 487 HB3 SER 83 3HB SER 83 -16.184 19.937 5.133 488 HG SER 83 HG SER 83 -17.310 21.944 5.171 489 H ARG 84 H ARG 84 -14.857 22.439 2.055 490 HA ARG 84 HA ARG 84 -16.743 22.510 -0.013 491 HB2 ARG 84 2HB ARG 84 -15.470 24.438 0.919 492 HB3 ARG 84 3HB ARG 84 -14.009 23.844 0.130 493 HG2 ARG 84 2HG ARG 84 -15.023 25.700 -1.113 494 HG3 ARG 84 3HG ARG 84 -14.989 24.232 -2.083 495 HD2 ARG 84 2HD ARG 84 -17.450 23.875 -1.440 496 HD3 ARG 84 3HD ARG 84 -17.381 25.434 -0.605 497 HE ARG 84 HE ARG 84 -17.481 26.517 -2.650 498 HH11 ARG 84 1HH1 ARG 84 -16.704 23.117 -3.336 499 HH12 ARG 84 2HH1 ARG 84 -17.135 23.287 -5.018 500 HH21 ARG 84 1HH2 ARG 84 -17.971 26.643 -4.842 501 HH22 ARG 84 2HH2 ARG 84 -17.812 25.245 -5.853 502 H LEU 85 H LEU 85 -13.669 20.704 -0.011 503 HA LEU 85 HA LEU 85 -13.970 20.203 -2.929 504 HB2 LEU 85 2HB LEU 85 -11.766 20.748 -2.233 505 HB3 LEU 85 3HB LEU 85 -11.772 19.501 -0.970 506 HG LEU 85 HG LEU 85 -11.656 17.738 -2.571 507 HD11 LEU 85 1HD1 LEU 85 -11.562 18.051 -5.018 508 HD12 LEU 85 2HD1 LEU 85 -11.918 19.777 -4.831 509 HD13 LEU 85 3HD1 LEU 85 -13.133 18.553 -4.415 510 HD21 LEU 85 1HD2 LEU 85 -9.801 19.925 -3.603 511 HD22 LEU 85 2HD2 LEU 85 -9.508 18.167 -3.561 512 HD23 LEU 85 3HD2 LEU 85 -9.571 19.110 -2.059 513 H CYS 86 H CYS 86 -13.649 18.018 0.033 514 HA CYS 86 HA CYS 86 -14.375 15.738 -1.367 515 HB2 CYS 86 2HB CYS 86 -14.860 14.722 0.760 516 HB3 CYS 86 3HB CYS 86 -13.361 15.656 0.825 517 HG CYS 86 HG CYS 86 -14.597 15.892 3.128 518 H ALA 87 H ALA 87 -16.676 18.092 -0.000 519 HA ALA 87 HA ALA 87 -19.028 16.494 -0.612 520 HB1 ALA 87 1HB ALA 87 -18.735 19.513 -0.298 521 HB2 ALA 87 2HB ALA 87 -20.246 18.588 -0.244 522 HB3 ALA 87 3HB ALA 87 -19.029 18.355 1.023 523 H ALA 88 H ALA 88 -17.160 18.891 -2.485 524 HA ALA 88 HA ALA 88 -19.048 19.109 -4.657 525 HB1 ALA 88 1HB ALA 88 -16.107 19.888 -4.345 526 HB2 ALA 88 2HB ALA 88 -17.153 20.398 -5.683 527 HB3 ALA 88 3HB ALA 88 -17.525 20.909 -4.033 528 H THR 89 H THR 89 -15.838 17.487 -4.416 529 HA THR 89 HA THR 89 -15.835 16.282 -6.985 530 HB THR 89 HB THR 89 -13.837 16.372 -5.585 531 HG1 THR 89 HG1 THR 89 -13.167 14.283 -6.090 532 HG21 THR 89 1HG2 THR 89 -13.424 15.065 -3.679 533 HG22 THR 89 2HG2 THR 89 -14.785 13.964 -3.993 534 HG23 THR 89 3HG2 THR 89 -15.089 15.598 -3.408 535 H LYS 90 H LYS 90 -17.020 14.937 -3.922 536 HA LYS 90 HA LYS 90 -17.817 12.405 -4.704 537 HB2 LYS 90 2HB LYS 90 -17.683 13.242 -2.431 538 HB3 LYS 90 3HB LYS 90 -18.957 14.435 -2.755 539 HG2 LYS 90 2HG LYS 90 -20.411 12.228 -3.184 540 HG3 LYS 90 3HG LYS 90 -19.142 11.481 -2.186 541 HD2 LYS 90 2HD LYS 90 -20.740 13.973 -1.475 542 HD3 LYS 90 3HD LYS 90 -21.142 12.332 -0.911 543 HE2 LYS 90 2HE LYS 90 -18.868 12.186 0.175 544 HE3 LYS 90 3HE LYS 90 -18.549 13.852 -0.316 545 HZ1 LYS 90 HZ1 LYS 90 -20.733 12.990 1.522 546 HZ2 LYS 90 HZ2 LYS 90 -20.492 14.530 1.048 547 HZ3 LYS 90 HZ3 LYS 90 -19.370 13.775 1.959 548 H ARG 91 H ARG 91 -19.752 15.395 -4.865 549 HA ARG 91 HA ARG 91 -22.105 14.193 -6.025 550 HB2 ARG 91 2HB ARG 91 -21.065 17.036 -6.029 551 HB3 ARG 91 3HB ARG 91 -22.647 16.585 -6.672 552 HG2 ARG 91 2HG ARG 91 -23.446 15.813 -4.548 553 HG3 ARG 91 3HG ARG 91 -21.842 15.933 -3.812 554 HD2 ARG 91 2HD ARG 91 -21.864 18.398 -4.171 555 HD3 ARG 91 3HD ARG 91 -23.512 18.266 -4.816 556 HE ARG 91 HE ARG 91 -23.622 17.003 -2.338 557 HH11 ARG 91 1HH1 ARG 91 -22.770 20.280 -3.362 558 HH12 ARG 91 2HH1 ARG 91 -23.199 20.974 -1.826 559 HH21 ARG 91 1HH2 ARG 91 -24.188 17.969 -0.392 560 HH22 ARG 91 2HH2 ARG 91 -24.000 19.682 -0.183 561 H ALA 92 H ALA 92 -19.235 15.716 -7.570 562 HA ALA 92 HA ALA 92 -20.087 15.427 -10.286 563 HB1 ALA 92 1HB ALA 92 -17.316 15.676 -9.029 564 HB2 ALA 92 2HB ALA 92 -17.665 15.787 -10.756 565 HB3 ALA 92 3HB ALA 92 -18.364 16.970 -9.647 566 H VAL 93 H VAL 93 -18.003 13.272 -8.283 567 HA VAL 93 HA VAL 93 -17.693 11.264 -10.217 568 HB VAL 93 HB VAL 93 -17.855 10.468 -7.315 569 HG11 VAL 93 1HG1 VAL 93 -17.318 8.822 -9.200 570 HG12 VAL 93 2HG1 VAL 93 -15.842 9.759 -9.468 571 HG13 VAL 93 3HG1 VAL 93 -16.113 8.948 -7.924 572 HG21 VAL 93 1HG2 VAL 93 -15.222 11.165 -7.531 573 HG22 VAL 93 2HG2 VAL 93 -15.958 12.404 -8.546 574 HG23 VAL 93 3HG2 VAL 93 -16.468 12.194 -6.848 575 H ALA 94 H ALA 94 -20.436 11.921 -8.159 576 HA ALA 94 HA ALA 94 -21.758 9.332 -8.591 577 HB1 ALA 94 1HB ALA 94 -23.591 10.377 -7.327 578 HB2 ALA 94 2HB ALA 94 -22.050 10.626 -6.492 579 HB3 ALA 94 3HB ALA 94 -22.798 11.962 -7.406 580 H GLN 95 H GLN 95 -21.269 12.005 -10.594 581 HA GLN 95 HA GLN 95 -23.699 11.344 -12.228 582 HB2 GLN 95 2HB GLN 95 -24.117 13.681 -12.603 583 HB3 GLN 95 3HB GLN 95 -24.077 13.340 -10.873 584 HG2 GLN 95 2HG GLN 95 -22.826 15.331 -10.984 585 HG3 GLN 95 3HG GLN 95 -21.654 14.105 -10.905 586 HE21 GLN 95 1HE2 GLN 95 -20.050 14.160 -12.518 587 HE22 GLN 95 2HE2 GLN 95 -20.174 15.181 -13.953 588 H VAL 96 H VAL 96 -20.257 11.738 -12.285 589 HA VAL 96 HA VAL 96 -19.734 12.357 -14.964 590 HB VAL 96 HB VAL 96 -17.840 10.734 -14.803 591 HG11 VAL 96 1HG1 VAL 96 -17.904 12.584 -12.422 592 HG12 VAL 96 2HG1 VAL 96 -16.523 12.003 -13.327 593 HG13 VAL 96 3HG1 VAL 96 -17.664 13.115 -14.102 594 HG21 VAL 96 1HG2 VAL 96 -17.810 10.241 -12.011 595 HG22 VAL 96 2HG2 VAL 96 -19.349 9.629 -12.618 596 HG23 VAL 96 3HG2 VAL 96 -17.856 9.067 -13.357 597 H ASN 97 H ASN 97 -19.466 11.240 -16.898 598 HA ASN 97 HA ASN 97 -21.405 9.217 -17.511 599 HB2 ASN 97 2HB ASN 97 -20.537 11.004 -19.058 600 HB3 ASN 97 3HB ASN 97 -19.007 10.129 -19.164 601 HD21 ASN 97 1HD2 ASN 97 -19.072 7.861 -20.160 602 HD22 ASN 97 2HD2 ASN 97 -20.379 7.551 -21.287 603 H SER 98 H SER 98 -17.842 9.038 -17.301 604 HA SER 98 HA SER 98 -17.408 6.526 -16.227 605 HB2 SER 98 2HB SER 98 -16.688 5.241 -18.277 606 HB3 SER 98 3HB SER 98 -18.436 5.351 -18.050 607 HG SER 98 HG SER 98 -17.778 5.748 -20.220 608 H PHE 99 H PHE 99 -15.188 6.050 -16.092 609 HA PHE 99 HA PHE 99 -13.444 8.356 -16.734 610 HB2 PHE 99 2HB PHE 99 -12.864 5.922 -15.020 611 HB3 PHE 99 3HB PHE 99 -12.012 7.461 -15.039 612 HD1 PHE 99 HD1 PHE 99 -13.312 9.561 -14.310 613 HD2 PHE 99 HD2 PHE 99 -14.739 5.557 -13.614 614 HE1 PHE 99 HE1 PHE 99 -14.854 10.408 -12.541 615 HE2 PHE 99 HE2 PHE 99 -16.283 6.410 -11.890 616 HZ PHE 99 HZ PHE 99 -16.313 8.801 -11.323 617 HA PRO 100 HA PRO 100 -12.081 5.508 -19.990 618 HB2 PRO 100 2HB PRO 100 -10.779 7.207 -21.664 619 HB3 PRO 100 3HB PRO 100 -12.562 7.102 -21.552 620 HG2 PRO 100 2HG PRO 100 -10.717 9.112 -20.211 621 HG3 PRO 100 3HG PRO 100 -12.240 9.431 -21.093 622 HD2 PRO 100 2HD PRO 100 -12.113 9.231 -18.356 623 HD3 PRO 100 3HD PRO 100 -13.545 8.686 -19.288 624 H LEU 101 H LEU 101 -10.506 4.187 -19.460 625 HA LEU 101 HA LEU 101 -7.867 5.115 -18.513 626 HB2 LEU 101 2HB LEU 101 -7.483 2.647 -18.174 627 HB3 LEU 101 3HB LEU 101 -8.649 3.421 -17.121 628 HG LEU 101 HG LEU 101 -9.745 2.065 -19.576 629 HD11 LEU 101 1HD1 LEU 101 -8.933 0.471 -17.124 630 HD12 LEU 101 2HD1 LEU 101 -8.036 0.448 -18.663 631 HD13 LEU 101 3HD1 LEU 101 -9.705 -0.136 -18.598 632 HD21 LEU 101 1HD2 LEU 101 -10.679 2.116 -16.665 633 HD22 LEU 101 2HD2 LEU 101 -11.573 1.432 -18.036 634 HD23 LEU 101 3HD2 LEU 101 -11.284 3.179 -17.943 635 HA PRO 102 HA PRO 102 -6.147 4.525 -22.581 636 HB2 PRO 102 2HB PRO 102 -3.474 4.536 -22.046 637 HB3 PRO 102 3HB PRO 102 -4.506 5.997 -21.872 638 HG2 PRO 102 2HG PRO 102 -3.599 4.063 -19.713 639 HG3 PRO 102 3HG PRO 102 -3.561 5.857 -19.688 640 HD2 PRO 102 2HD PRO 102 -5.587 4.422 -18.533 641 HD3 PRO 102 3HD PRO 102 -5.861 6.012 -19.311 642 H LYS 103 H LYS 103 -5.454 2.245 -19.972 643 HA LYS 103 HA LYS 103 -4.313 0.196 -21.735 644 HB2 LYS 103 2HB LYS 103 -5.041 0.069 -18.785 645 HB3 LYS 103 3HB LYS 103 -3.961 -1.007 -19.653 646 HG2 LYS 103 2HG LYS 103 -3.463 1.892 -18.873 647 HG3 LYS 103 3HG LYS 103 -2.694 0.446 -18.249 648 HD2 LYS 103 2HD LYS 103 -1.633 0.026 -20.483 649 HD3 LYS 103 3HD LYS 103 -2.367 1.521 -21.072 650 HE2 LYS 103 2HE LYS 103 -0.131 2.062 -20.508 651 HE3 LYS 103 3HE LYS 103 -1.167 2.796 -19.277 652 HZ1 LYS 103 HZ1 LYS 103 0.371 0.266 -18.972 653 HZ2 LYS 103 HZ2 LYS 103 -0.582 0.932 -17.806 654 HZ3 LYS 103 HZ3 LYS 103 0.771 1.700 -18.296 655 H ASP 104 H ASP 104 -5.180 -2.115 -21.164 656 HA ASP 104 HA ASP 104 -8.099 -2.341 -20.883 657 HB2 ASP 104 2HB ASP 104 -7.588 -1.723 -23.304 658 HB3 ASP 104 3HB ASP 104 -6.702 -3.233 -23.437 659 H GLN 105 H GLN 105 -5.494 -3.454 -19.556 660 HA GLN 105 HA GLN 105 -5.792 -6.331 -20.192 661 HB2 GLN 105 2HB GLN 105 -3.568 -4.930 -18.715 662 HB3 GLN 105 3HB GLN 105 -3.750 -6.665 -18.861 663 HG2 GLN 105 2HG GLN 105 -2.178 -5.927 -20.520 664 HG3 GLN 105 3HG GLN 105 -3.620 -6.565 -21.314 665 HE21 GLN 105 1HE2 GLN 105 -2.683 -3.333 -19.978 666 HE22 GLN 105 2HE2 GLN 105 -2.975 -2.478 -21.484 667 HA PRO 106 HA PRO 106 -8.204 -6.697 -16.358 668 HB2 PRO 106 2HB PRO 106 -7.256 -9.554 -16.645 669 HB3 PRO 106 3HB PRO 106 -8.893 -8.940 -16.229 670 HG2 PRO 106 2HG PRO 106 -8.377 -9.786 -18.732 671 HG3 PRO 106 3HG PRO 106 -9.279 -8.252 -18.492 672 HD2 PRO 106 2HD PRO 106 -6.346 -8.628 -19.102 673 HD3 PRO 106 3HD PRO 106 -7.527 -7.484 -19.821 674 H ASP 107 H ASP 107 -4.814 -6.961 -16.565 675 HA ASP 107 HA ASP 107 -4.438 -7.637 -13.699 676 HB2 ASP 107 2HB ASP 107 -2.782 -8.379 -15.426 677 HB3 ASP 107 3HB ASP 107 -2.430 -6.692 -15.769 678 H VAL 108 H VAL 108 -4.283 -4.818 -15.873 679 HA VAL 108 HA VAL 108 -3.590 -3.024 -13.602 680 HB VAL 108 HB VAL 108 -3.060 -1.347 -15.201 681 HG11 VAL 108 1HG1 VAL 108 -1.832 -3.976 -16.136 682 HG12 VAL 108 2HG1 VAL 108 -1.134 -2.344 -16.284 683 HG13 VAL 108 3HG1 VAL 108 -1.346 -3.076 -14.683 684 HG21 VAL 108 1HG2 VAL 108 -3.082 -1.806 -17.662 685 HG22 VAL 108 2HG2 VAL 108 -4.102 -3.218 -17.336 686 HG23 VAL 108 3HG2 VAL 108 -4.686 -1.587 -16.925 687 H VAL 109 H VAL 109 -6.296 -3.719 -15.764 688 HA VAL 109 HA VAL 109 -7.989 -1.499 -15.192 689 HB VAL 109 HB VAL 109 -8.544 -4.450 -15.607 690 HG11 VAL 109 1HG1 VAL 109 -10.526 -3.636 -14.414 691 HG12 VAL 109 2HG1 VAL 109 -10.603 -2.195 -15.469 692 HG13 VAL 109 3HG1 VAL 109 -10.924 -3.813 -16.114 693 HG21 VAL 109 1HG2 VAL 109 -9.154 -3.804 -17.865 694 HG22 VAL 109 2HG2 VAL 109 -9.066 -2.088 -17.464 695 HG23 VAL 109 3HG2 VAL 109 -7.589 -3.049 -17.533 696 H GLU 110 H GLU 110 -6.879 -4.112 -13.132 697 HA GLU 110 HA GLU 110 -8.824 -3.666 -11.002 698 HB2 GLU 110 2HB GLU 110 -6.346 -5.384 -11.173 699 HB3 GLU 110 3HB GLU 110 -7.493 -5.397 -9.830 700 HG2 GLU 110 2HG GLU 110 -8.138 -6.085 -12.730 701 HG3 GLU 110 3HG GLU 110 -7.918 -7.203 -11.407 702 H LYS 111 H LYS 111 -5.984 -2.023 -11.899 703 HA LYS 111 HA LYS 111 -5.261 -1.285 -9.097 704 HB2 LYS 111 2HB LYS 111 -3.829 -1.110 -11.760 705 HB3 LYS 111 3HB LYS 111 -3.376 -0.026 -10.450 706 HG2 LYS 111 2HG LYS 111 -1.969 -2.043 -10.578 707 HG3 LYS 111 3HG LYS 111 -2.718 -1.809 -9.009 708 HD2 LYS 111 2HD LYS 111 -4.296 -3.567 -9.365 709 HD3 LYS 111 3HD LYS 111 -3.945 -3.647 -11.086 710 HE2 LYS 111 2HE LYS 111 -1.888 -4.256 -8.934 711 HE3 LYS 111 3HE LYS 111 -2.987 -5.480 -9.568 712 HZ1 LYS 111 HZ1 LYS 111 -2.070 -5.128 -11.795 713 HZ2 LYS 111 HZ2 LYS 111 -0.880 -5.532 -10.765 714 HZ3 LYS 111 HZ3 LYS 111 -1.043 -3.985 -11.235 715 H LEU 112 H LEU 112 -6.227 0.178 -12.132 716 HA LEU 112 HA LEU 112 -6.217 2.870 -11.038 717 HB2 LEU 112 2HB LEU 112 -6.991 3.545 -13.295 718 HB3 LEU 112 3HB LEU 112 -5.577 2.566 -13.245 719 HG LEU 112 HG LEU 112 -6.983 0.610 -13.708 720 HD11 LEU 112 1HD1 LEU 112 -9.009 0.671 -14.839 721 HD12 LEU 112 2HD1 LEU 112 -9.058 2.453 -14.721 722 HD13 LEU 112 3HD1 LEU 112 -9.171 1.403 -13.268 723 HD21 LEU 112 1HD2 LEU 112 -6.883 0.894 -16.140 724 HD22 LEU 112 2HD2 LEU 112 -5.447 1.538 -15.356 725 HD23 LEU 112 3HD2 LEU 112 -6.727 2.649 -15.907 726 H LYS 113 H LYS 113 -8.600 0.346 -11.106 727 HA LYS 113 HA LYS 113 -10.949 1.929 -10.756 728 HB2 LYS 113 2HB LYS 113 -11.909 -0.153 -9.828 729 HB3 LYS 113 3HB LYS 113 -11.085 -0.399 -11.380 730 HG2 LYS 113 2HG LYS 113 -9.252 -1.476 -10.379 731 HG3 LYS 113 3HG LYS 113 -9.571 -0.874 -8.768 732 HD2 LYS 113 2HD LYS 113 -10.005 -3.306 -9.106 733 HD3 LYS 113 3HD LYS 113 -11.333 -2.373 -8.384 734 HE2 LYS 113 2HE LYS 113 -12.536 -2.293 -10.479 735 HE3 LYS 113 3HE LYS 113 -11.190 -3.033 -11.347 736 HZ1 LYS 113 HZ1 LYS 113 -11.514 -5.058 -10.027 737 HZ2 LYS 113 HZ2 LYS 113 -12.878 -4.681 -10.836 738 HZ3 LYS 113 HZ3 LYS 113 -12.777 -4.379 -9.223 739 H ASN 114 H ASN 114 -8.414 1.216 -8.510 740 HA ASN 114 HA ASN 114 -10.080 2.280 -6.244 741 HB2 ASN 114 2HB ASN 114 -7.921 0.179 -5.971 742 HB3 ASN 114 3HB ASN 114 -9.005 0.822 -4.723 743 HD21 ASN 114 1HD2 ASN 114 -11.431 0.638 -6.569 744 HD22 ASN 114 2HD2 ASN 114 -11.793 -1.078 -6.528 745 H ILE 115 H ILE 115 -9.326 4.357 -6.792 746 HA ILE 115 HA ILE 115 -6.467 4.917 -6.201 747 HB ILE 115 HB ILE 115 -6.756 7.076 -7.254 748 HG12 ILE 115 2HG1 ILE 115 -9.231 7.235 -6.984 749 HG13 ILE 115 3HG1 ILE 115 -8.557 7.778 -8.501 750 HG21 ILE 115 1HG2 ILE 115 -5.651 5.343 -8.442 751 HG22 ILE 115 2HG2 ILE 115 -7.166 4.611 -8.961 752 HG23 ILE 115 3HG2 ILE 115 -6.691 6.198 -9.595 753 HD11 ILE 115 1HD1 ILE 115 -10.585 6.622 -8.997 754 HD12 ILE 115 2HD1 ILE 115 -9.239 5.642 -9.581 755 HD13 ILE 115 3HD1 ILE 115 -10.076 5.188 -8.084 756 H ASN 116 H ASN 116 -5.905 6.739 -4.975 757 HA ASN 116 HA ASN 116 -8.112 7.904 -3.347 758 HB2 ASN 116 2HB ASN 116 -5.207 7.836 -2.532 759 HB3 ASN 116 3HB ASN 116 -6.579 8.513 -1.644 760 HD21 ASN 116 1HD2 ASN 116 -7.936 5.676 -2.706 761 HD22 ASN 116 2HD2 ASN 116 -7.425 4.647 -1.375 762 H LEU 117 H LEU 117 -8.525 9.912 -3.877 763 HA LEU 117 HA LEU 117 -6.575 11.560 -5.442 764 HB2 LEU 117 2HB LEU 117 -9.447 12.224 -4.674 765 HB3 LEU 117 3HB LEU 117 -8.358 13.186 -5.680 766 HG LEU 117 HG LEU 117 -9.524 10.435 -6.358 767 HD11 LEU 117 1HD1 LEU 117 -10.053 13.178 -7.574 768 HD12 LEU 117 2HD1 LEU 117 -11.143 12.285 -6.486 769 HD13 LEU 117 3HD1 LEU 117 -10.772 11.638 -8.087 770 HD21 LEU 117 1HD2 LEU 117 -7.641 12.190 -7.967 771 HD22 LEU 117 2HD2 LEU 117 -8.552 10.807 -8.631 772 HD23 LEU 117 3HD2 LEU 117 -7.329 10.539 -7.388 773 H THR 118 H THR 118 -5.149 12.479 -4.210 774 HA THR 118 HA THR 118 -5.886 13.604 -1.557 775 HB THR 118 HB THR 118 -3.473 11.865 -2.162 776 HG1 THR 118 HG1 THR 118 -4.494 10.545 -0.653 777 HG21 THR 118 1HG2 THR 118 -4.286 13.492 0.288 778 HG22 THR 118 2HG2 THR 118 -2.764 13.575 -0.616 779 HG23 THR 118 3HG2 THR 118 -3.136 12.138 0.354 780 H VAL 119 H VAL 119 -5.307 15.613 -1.346 781 HA VAL 119 HA VAL 119 -3.292 16.868 -3.156 782 HB VAL 119 HB VAL 119 -4.796 18.598 -3.710 783 HG11 VAL 119 1HG1 VAL 119 -6.388 16.032 -4.078 784 HG12 VAL 119 2HG1 VAL 119 -6.460 17.489 -5.081 785 HG13 VAL 119 3HG1 VAL 119 -4.991 16.498 -5.079 786 HG21 VAL 119 1HG2 VAL 119 -6.111 18.862 -1.673 787 HG22 VAL 119 2HG2 VAL 119 -7.161 18.707 -3.079 788 HG23 VAL 119 3HG2 VAL 119 -6.939 17.311 -2.004 789 H ALA 120 H ALA 120 -2.370 18.780 -2.438 790 HA ALA 120 HA ALA 120 -2.957 20.102 0.045 791 HB1 ALA 120 1HB ALA 120 -0.925 19.333 1.288 792 HB2 ALA 120 2HB ALA 120 -1.946 17.943 0.914 793 HB3 ALA 120 3HB ALA 120 -0.494 18.260 -0.057 794 HA PRO 121 HA PRO 121 -0.304 23.182 -1.848 795 HB2 PRO 121 2HB PRO 121 0.986 23.654 0.823 796 HB3 PRO 121 3HB PRO 121 0.212 24.831 -0.284 797 HG2 PRO 121 2HG PRO 121 -1.073 24.020 1.955 798 HG3 PRO 121 3HG PRO 121 -1.963 24.138 0.397 799 HD2 PRO 121 2HD PRO 121 -0.739 21.657 1.645 800 HD3 PRO 121 3HD PRO 121 -2.402 21.899 1.021 801 H GLU 122 H GLU 122 1.849 23.599 -2.565 802 HA GLU 122 HA GLU 122 4.153 22.208 -1.540 803 HB2 GLU 122 2HB GLU 122 3.119 20.332 -2.763 804 HB3 GLU 122 3HB GLU 122 2.974 21.318 -4.214 805 HG2 GLU 122 2HG GLU 122 4.836 19.754 -4.382 806 HG3 GLU 122 3HG GLU 122 5.416 21.413 -4.449 Start of MODEL 2 1 H1 ALA 22 H ALA 22 15.470 4.384 -20.621 2 HA ALA 22 HA ALA 22 12.786 5.415 -20.253 3 HB1 ALA 22 1HB ALA 22 13.276 6.271 -22.545 4 HB2 ALA 22 2HB ALA 22 13.664 4.607 -23.056 5 HB3 ALA 22 3HB ALA 22 12.020 5.016 -22.554 6 H ALA 23 H ALA 23 11.355 3.732 -19.868 7 HA ALA 23 HA ALA 23 12.012 0.950 -20.200 8 HB1 ALA 23 1HB ALA 23 12.441 2.153 -17.424 9 HB2 ALA 23 2HB ALA 23 12.622 0.446 -17.884 10 HB3 ALA 23 3HB ALA 23 13.755 1.680 -18.515 11 H ARG 24 H ARG 24 10.608 -0.406 -18.906 12 HA ARG 24 HA ARG 24 8.008 0.656 -18.070 13 HB2 ARG 24 2HB ARG 24 6.803 -0.428 -19.943 14 HB3 ARG 24 3HB ARG 24 7.855 0.899 -20.429 15 HG2 ARG 24 2HG ARG 24 9.591 -1.118 -20.889 16 HG3 ARG 24 3HG ARG 24 8.091 -2.038 -21.010 17 HD2 ARG 24 2HD ARG 24 7.299 -0.352 -22.715 18 HD3 ARG 24 3HD ARG 24 8.877 0.456 -22.576 19 HE ARG 24 HE ARG 24 8.868 -2.441 -23.203 20 HH11 ARG 24 1HH1 ARG 24 9.230 0.815 -24.708 21 HH12 ARG 24 2HH1 ARG 24 9.992 0.059 -26.101 22 HH21 ARG 24 1HH2 ARG 24 9.873 -3.158 -25.111 23 HH22 ARG 24 2HH2 ARG 24 10.369 -1.953 -26.286 24 H GLN 25 H GLN 25 10.160 -1.127 -17.000 25 HA GLN 25 HA GLN 25 8.743 -3.740 -16.636 26 HB2 GLN 25 2HB GLN 25 11.555 -2.988 -15.793 27 HB3 GLN 25 3HB GLN 25 10.853 -4.601 -15.895 28 HG2 GLN 25 2HG GLN 25 11.463 -2.769 -18.266 29 HG3 GLN 25 3HG GLN 25 12.428 -4.127 -17.753 30 HE21 GLN 25 1HE2 GLN 25 9.743 -3.145 -19.733 31 HE22 GLN 25 2HE2 GLN 25 9.220 -4.771 -20.144 32 H GLN 26 H GLN 26 9.568 -0.823 -14.975 33 HA GLN 26 HA GLN 26 8.449 -1.785 -12.382 34 HB2 GLN 26 2HB GLN 26 10.322 -0.901 -11.206 35 HB3 GLN 26 3HB GLN 26 10.912 -2.045 -12.401 36 HG2 GLN 26 2HG GLN 26 10.915 0.989 -12.693 37 HG3 GLN 26 3HG GLN 26 12.297 0.010 -12.215 38 HE21 GLN 26 1HE2 GLN 26 13.155 -1.602 -13.874 39 HE22 GLN 26 2HE2 GLN 26 12.964 -1.157 -15.555 40 H PHE 27 H PHE 27 8.733 0.767 -14.713 41 HA PHE 27 HA PHE 27 8.383 3.058 -13.195 42 HB2 PHE 27 2HB PHE 27 8.312 4.131 -15.167 43 HB3 PHE 27 3HB PHE 27 9.091 2.636 -15.662 44 HD1 PHE 27 HD1 PHE 27 7.424 4.868 -17.201 45 HD2 PHE 27 HD2 PHE 27 6.521 0.893 -15.802 46 HE1 PHE 27 HE1 PHE 27 5.619 4.672 -18.890 47 HE2 PHE 27 HE2 PHE 27 4.748 0.694 -17.482 48 HZ PHE 27 HZ PHE 27 4.264 2.577 -19.043 49 H VAL 28 H VAL 28 6.136 0.796 -12.940 50 HA VAL 28 HA VAL 28 3.637 1.980 -13.635 51 HB VAL 28 HB VAL 28 2.668 0.473 -11.851 52 HG11 VAL 28 1HG1 VAL 28 4.425 -0.832 -13.973 53 HG12 VAL 28 2HG1 VAL 28 3.005 -1.567 -13.191 54 HG13 VAL 28 3HG1 VAL 28 2.801 -0.146 -14.237 55 HG21 VAL 28 1HG2 VAL 28 3.996 -1.305 -10.906 56 HG22 VAL 28 2HG2 VAL 28 5.474 -0.660 -11.625 57 HG23 VAL 28 3HG2 VAL 28 4.630 0.244 -10.354 58 H THR 29 H THR 29 5.685 2.441 -10.801 59 HA THR 29 HA THR 29 3.897 3.943 -9.180 60 HB THR 29 HB THR 29 5.940 3.060 -8.356 61 HG1 THR 29 HG1 THR 29 6.514 4.911 -7.190 62 HG21 THR 29 1HG2 THR 29 8.132 3.993 -8.786 63 HG22 THR 29 2HG2 THR 29 7.471 5.213 -9.895 64 HG23 THR 29 3HG2 THR 29 7.450 3.490 -10.345 65 H SER 30 H SER 30 6.130 5.126 -11.742 66 HA SER 30 HA SER 30 5.285 7.852 -11.672 67 HB2 SER 30 2HB SER 30 6.350 6.255 -14.035 68 HB3 SER 30 3HB SER 30 6.366 8.011 -13.841 69 HG SER 30 HG SER 30 7.839 7.765 -12.118 70 H GLU 31 H GLU 31 3.894 5.015 -13.318 71 HA GLU 31 HA GLU 31 1.944 6.535 -14.827 72 HB2 GLU 31 2HB GLU 31 1.961 3.614 -14.032 73 HB3 GLU 31 3HB GLU 31 0.795 4.342 -15.111 74 HG2 GLU 31 2HG GLU 31 3.767 4.501 -15.680 75 HG3 GLU 31 3HG GLU 31 2.791 3.113 -16.157 76 H VAL 32 H VAL 32 2.019 5.649 -11.371 77 HA VAL 32 HA VAL 32 -0.825 5.623 -10.938 78 HB VAL 32 HB VAL 32 1.341 6.581 -9.039 79 HG11 VAL 32 1HG1 VAL 32 -0.343 6.067 -7.251 80 HG12 VAL 32 2HG1 VAL 32 -0.784 7.436 -8.256 81 HG13 VAL 32 3HG1 VAL 32 -1.573 5.863 -8.526 82 HG21 VAL 32 1HG2 VAL 32 -0.084 3.876 -9.293 83 HG22 VAL 32 2HG2 VAL 32 1.612 4.204 -9.678 84 HG23 VAL 32 3HG2 VAL 32 1.074 4.320 -8.011 85 H GLY 33 H GLY 33 1.452 8.248 -11.484 86 HA2 GLY 33 HA2 GLY 33 -0.299 10.442 -10.745 87 HA3 GLY 33 HA3 GLY 33 1.215 10.538 -11.689 88 H ARG 34 H ARG 34 -0.329 8.355 -13.475 89 HA ARG 34 HA ARG 34 -1.954 10.285 -15.092 90 HB2 ARG 34 2HB ARG 34 -0.845 7.560 -15.820 91 HB3 ARG 34 3HB ARG 34 -1.708 8.678 -16.887 92 HG2 ARG 34 2HG ARG 34 0.141 10.319 -16.709 93 HG3 ARG 34 3HG ARG 34 0.943 9.302 -15.504 94 HD2 ARG 34 2HD ARG 34 2.110 8.796 -17.401 95 HD3 ARG 34 3HD ARG 34 0.967 7.449 -17.222 96 HE ARG 34 HE ARG 34 -0.161 9.456 -18.908 97 HH11 ARG 34 1HH1 ARG 34 2.317 6.915 -18.975 98 HH12 ARG 34 2HH1 ARG 34 2.437 6.953 -20.722 99 HH21 ARG 34 1HH2 ARG 34 -0.051 9.348 -21.178 100 HH22 ARG 34 2HH2 ARG 34 1.050 8.251 -21.945 101 H TYR 35 H TYR 35 -1.957 6.959 -13.807 102 HA TYR 35 HA TYR 35 -4.521 6.070 -14.456 103 HB2 TYR 35 2HB TYR 35 -2.562 5.513 -12.221 104 HB3 TYR 35 3HB TYR 35 -4.169 4.821 -12.134 105 HD1 TYR 35 HD1 TYR 35 -1.772 5.290 -15.040 106 HD2 TYR 35 HD2 TYR 35 -4.072 2.585 -12.608 107 HE1 TYR 35 HE1 TYR 35 -1.209 3.443 -16.581 108 HE2 TYR 35 HE2 TYR 35 -3.693 0.780 -14.231 109 HH TYR 35 HH TYR 35 -1.490 1.245 -17.082 110 H GLY 36 H GLY 36 -3.670 7.917 -11.532 111 HA2 GLY 36 HA2 GLY 36 -6.467 8.179 -10.687 112 HA3 GLY 36 HA3 GLY 36 -5.059 8.949 -9.937 113 H ALA 37 H ALA 37 -4.447 9.926 -12.894 114 HA ALA 37 HA ALA 37 -5.688 12.491 -12.559 115 HB1 ALA 37 1HB ALA 37 -4.026 11.486 -14.907 116 HB2 ALA 37 2HB ALA 37 -4.413 13.161 -14.507 117 HB3 ALA 37 3HB ALA 37 -3.374 12.211 -13.428 118 H ILE 38 H ILE 38 -6.267 9.628 -14.623 119 HA ILE 38 HA ILE 38 -8.084 10.843 -16.451 120 HB ILE 38 HB ILE 38 -8.717 8.660 -17.082 121 HG12 ILE 38 2HG1 ILE 38 -8.046 7.848 -14.263 122 HG13 ILE 38 3HG1 ILE 38 -9.576 7.717 -15.106 123 HG21 ILE 38 1HG2 ILE 38 -6.675 7.609 -17.544 124 HG22 ILE 38 2HG2 ILE 38 -6.196 9.279 -17.282 125 HG23 ILE 38 3HG2 ILE 38 -5.940 8.072 -16.004 126 HD11 ILE 38 1HD1 ILE 38 -8.755 5.524 -14.952 127 HD12 ILE 38 2HD1 ILE 38 -8.495 6.000 -16.626 128 HD13 ILE 38 3HD1 ILE 38 -7.128 5.984 -15.466 129 H TYR 39 H TYR 39 -8.552 9.842 -13.180 130 HA TYR 39 HA TYR 39 -11.456 10.113 -13.225 131 HB2 TYR 39 2HB TYR 39 -9.568 9.802 -10.856 132 HB3 TYR 39 3HB TYR 39 -11.317 9.687 -10.817 133 HD1 TYR 39 HD1 TYR 39 -8.215 7.877 -11.678 134 HD2 TYR 39 HD2 TYR 39 -12.503 7.801 -11.813 135 HE1 TYR 39 HE1 TYR 39 -8.111 5.440 -12.388 136 HE2 TYR 39 HE2 TYR 39 -12.397 5.469 -12.697 137 HH TYR 39 HH TYR 39 -11.136 3.750 -13.319 138 H THR 40 H THR 40 -8.762 11.896 -11.657 139 HA THR 40 HA THR 40 -10.350 13.977 -10.566 140 HB THR 40 HB THR 40 -7.938 13.186 -10.034 141 HG1 THR 40 HG1 THR 40 -7.599 15.260 -9.099 142 HG21 THR 40 1HG2 THR 40 -6.118 14.323 -10.935 143 HG22 THR 40 2HG2 THR 40 -7.129 15.562 -11.727 144 HG23 THR 40 3HG2 THR 40 -7.093 13.905 -12.346 145 H GLN 41 H GLN 41 -8.837 13.739 -13.736 146 HA GLN 41 HA GLN 41 -9.338 16.489 -14.512 147 HB2 GLN 41 2HB GLN 41 -8.616 13.958 -16.039 148 HB3 GLN 41 3HB GLN 41 -8.784 15.532 -16.815 149 HG2 GLN 41 2HG GLN 41 -6.763 14.884 -14.625 150 HG3 GLN 41 3HG GLN 41 -6.411 15.028 -16.340 151 HE21 GLN 41 1HE2 GLN 41 -5.288 16.596 -14.059 152 HE22 GLN 41 2HE2 GLN 41 -5.710 18.262 -14.419 153 H LEU 42 H LEU 42 -11.204 13.444 -14.734 154 HA LEU 42 HA LEU 42 -13.188 14.642 -16.514 155 HB2 LEU 42 2HB LEU 42 -12.724 12.183 -16.374 156 HB3 LEU 42 3HB LEU 42 -13.412 12.201 -14.740 157 HG LEU 42 HG LEU 42 -15.591 12.954 -15.652 158 HD11 LEU 42 1HD1 LEU 42 -14.935 14.162 -17.695 159 HD12 LEU 42 2HD1 LEU 42 -16.015 12.838 -18.114 160 HD13 LEU 42 3HD1 LEU 42 -14.275 12.660 -18.398 161 HD21 LEU 42 1HD2 LEU 42 -15.271 10.604 -15.354 162 HD22 LEU 42 2HD2 LEU 42 -14.444 10.451 -16.925 163 HD23 LEU 42 3HD2 LEU 42 -16.184 10.852 -16.837 164 H ILE 43 H ILE 43 -12.801 14.210 -12.996 165 HA ILE 43 HA ILE 43 -15.386 15.114 -12.226 166 HB ILE 43 HB ILE 43 -12.699 14.673 -10.919 167 HG12 ILE 43 2HG1 ILE 43 -14.168 13.390 -9.355 168 HG13 ILE 43 3HG1 ILE 43 -15.585 13.917 -10.277 169 HG21 ILE 43 1HG2 ILE 43 -13.461 15.491 -8.760 170 HG22 ILE 43 2HG2 ILE 43 -13.291 16.827 -9.882 171 HG23 ILE 43 3HG2 ILE 43 -14.917 16.193 -9.492 172 HD11 ILE 43 1HD1 ILE 43 -14.586 12.700 -12.282 173 HD12 ILE 43 2HD1 ILE 43 -13.381 12.028 -11.142 174 HD13 ILE 43 3HD1 ILE 43 -15.101 11.689 -10.927 175 H ARG 44 H ARG 44 -12.408 16.905 -12.749 176 HA ARG 44 HA ARG 44 -13.518 19.421 -11.818 177 HB2 ARG 44 2HB ARG 44 -11.450 20.413 -12.328 178 HB3 ARG 44 3HB ARG 44 -11.180 18.796 -11.679 179 HG2 ARG 44 2HG ARG 44 -9.601 18.929 -13.339 180 HG3 ARG 44 3HG ARG 44 -10.904 18.025 -14.092 181 HD2 ARG 44 2HD ARG 44 -11.593 20.031 -15.358 182 HD3 ARG 44 3HD ARG 44 -10.397 21.006 -14.467 183 HE ARG 44 HE ARG 44 -8.959 18.910 -15.621 184 HH11 ARG 44 1HH1 ARG 44 -10.883 21.574 -16.963 185 HH12 ARG 44 2HH1 ARG 44 -9.984 21.552 -18.449 186 HH21 ARG 44 1HH2 ARG 44 -7.878 18.959 -17.433 187 HH22 ARG 44 2HH2 ARG 44 -8.278 20.067 -18.731 188 H GLN 45 H GLN 45 -13.764 17.766 -14.785 189 HA GLN 45 HA GLN 45 -14.487 19.928 -16.588 190 HB2 GLN 45 2HB GLN 45 -15.871 17.241 -16.272 191 HB3 GLN 45 3HB GLN 45 -15.992 18.320 -17.652 192 HG2 GLN 45 2HG GLN 45 -13.615 16.713 -16.790 193 HG3 GLN 45 3HG GLN 45 -14.590 16.439 -18.218 194 HE21 GLN 45 1HE2 GLN 45 -11.620 17.284 -17.447 195 HE22 GLN 45 2HE2 GLN 45 -11.285 18.394 -18.772 196 H ASN 46 H ASN 46 -16.178 18.386 -13.813 197 HA ASN 46 HA ASN 46 -18.722 19.679 -14.551 198 HB2 ASN 46 2HB ASN 46 -17.910 18.185 -12.036 199 HB3 ASN 46 3HB ASN 46 -19.552 18.636 -12.506 200 HD21 ASN 46 1HD2 ASN 46 -17.123 16.235 -12.753 201 HD22 ASN 46 2HD2 ASN 46 -18.070 15.197 -13.824 202 H LEU 47 H LEU 47 -16.029 20.264 -12.381 203 HA LEU 47 HA LEU 47 -17.095 22.870 -11.558 204 HB2 LEU 47 2HB LEU 47 -15.959 21.754 -9.257 205 HB3 LEU 47 3HB LEU 47 -17.593 22.300 -9.525 206 HG LEU 47 HG LEU 47 -17.875 19.786 -10.438 207 HD11 LEU 47 1HD1 LEU 47 -15.417 19.271 -10.163 208 HD12 LEU 47 2HD1 LEU 47 -16.459 18.213 -9.184 209 HD13 LEU 47 3HD1 LEU 47 -15.584 19.542 -8.422 210 HD21 LEU 47 1HD2 LEU 47 -19.227 20.545 -8.695 211 HD22 LEU 47 2HD2 LEU 47 -17.863 20.723 -7.591 212 HD23 LEU 47 3HD2 LEU 47 -18.400 19.098 -8.085 213 H LEU 48 H LEU 48 -15.568 23.653 -13.063 214 HA LEU 48 HA LEU 48 -12.736 23.115 -12.791 215 HB2 LEU 48 2HB LEU 48 -12.545 24.853 -14.610 216 HB3 LEU 48 3HB LEU 48 -13.457 23.385 -14.930 217 HG LEU 48 HG LEU 48 -15.584 24.528 -14.765 218 HD11 LEU 48 1HD1 LEU 48 -15.121 26.270 -13.103 219 HD12 LEU 48 2HD1 LEU 48 -15.776 26.974 -14.580 220 HD13 LEU 48 3HD1 LEU 48 -14.028 27.099 -14.254 221 HD21 LEU 48 1HD2 LEU 48 -13.618 26.003 -16.559 222 HD22 LEU 48 2HD2 LEU 48 -15.379 25.929 -16.782 223 HD23 LEU 48 3HD2 LEU 48 -14.407 24.450 -16.916 224 H VAL 49 H VAL 49 -13.547 23.947 -10.340 225 HA VAL 49 HA VAL 49 -13.496 26.799 -10.080 226 HB VAL 49 HB VAL 49 -13.429 24.878 -7.739 227 HG11 VAL 49 1HG1 VAL 49 -13.044 27.216 -7.111 228 HG12 VAL 49 2HG1 VAL 49 -14.440 27.741 -8.089 229 HG13 VAL 49 3HG1 VAL 49 -14.696 26.760 -6.640 230 HG21 VAL 49 1HG2 VAL 49 -15.915 25.052 -7.750 231 HG22 VAL 49 2HG2 VAL 49 -15.840 25.896 -9.315 232 HG23 VAL 49 3HG2 VAL 49 -15.302 24.204 -9.171 233 H GLU 50 H GLU 50 -11.250 24.352 -8.826 234 HA GLU 50 HA GLU 50 -9.053 24.278 -8.427 235 HB2 GLU 50 2HB GLU 50 -8.756 26.981 -9.793 236 HB3 GLU 50 3HB GLU 50 -7.499 25.811 -9.449 237 HG2 GLU 50 2HG GLU 50 -8.639 24.165 -10.957 238 HG3 GLU 50 3HG GLU 50 -9.833 25.395 -11.363 239 H ASP 51 H ASP 51 -9.950 27.732 -7.838 240 HA ASP 51 HA ASP 51 -7.849 28.146 -5.990 241 HB2 ASP 51 2HB ASP 51 -9.029 29.888 -7.297 242 HB3 ASP 51 3HB ASP 51 -10.461 29.684 -6.288 243 H SER 52 H SER 52 -11.191 27.115 -5.352 244 HA SER 52 HA SER 52 -10.785 27.112 -2.411 245 HB2 SER 52 2HB SER 52 -13.111 26.423 -2.322 246 HB3 SER 52 3HB SER 52 -12.927 27.880 -3.315 247 HG SER 52 HG SER 52 -14.319 26.298 -4.278 248 H PHE 53 H PHE 53 -9.846 25.033 -4.863 249 HA PHE 53 HA PHE 53 -10.104 22.562 -3.212 250 HB2 PHE 53 2HB PHE 53 -9.267 22.986 -6.094 251 HB3 PHE 53 3HB PHE 53 -9.419 21.439 -5.278 252 HD1 PHE 53 HD1 PHE 53 -12.147 22.420 -3.776 253 HD2 PHE 53 HD2 PHE 53 -10.809 22.255 -7.882 254 HE1 PHE 53 HE1 PHE 53 -14.446 22.047 -4.500 255 HE2 PHE 53 HE2 PHE 53 -13.118 21.811 -8.591 256 HZ PHE 53 HZ PHE 53 -14.954 21.676 -6.936 257 H ARG 54 H ARG 54 -7.873 24.950 -4.386 258 HA ARG 54 HA ARG 54 -5.461 23.599 -3.326 259 HB2 ARG 54 2HB ARG 54 -5.930 26.248 -4.758 260 HB3 ARG 54 3HB ARG 54 -4.346 25.653 -4.293 261 HG2 ARG 54 2HG ARG 54 -6.223 24.182 -6.197 262 HG3 ARG 54 3HG ARG 54 -4.954 25.269 -6.707 263 HD2 ARG 54 2HD ARG 54 -4.568 22.700 -5.104 264 HD3 ARG 54 3HD ARG 54 -4.341 22.863 -6.852 265 HE ARG 54 HE ARG 54 -2.639 24.745 -6.017 266 HH11 ARG 54 1HH1 ARG 54 -2.967 21.430 -4.804 267 HH12 ARG 54 2HH1 ARG 54 -1.304 21.367 -4.301 268 HH21 ARG 54 1HH2 ARG 54 -0.466 24.502 -5.487 269 HH22 ARG 54 2HH2 ARG 54 0.122 22.960 -4.914 270 H GLY 55 H GLY 55 -3.957 25.112 -2.073 271 HA2 GLY 55 HA2 GLY 55 -3.425 26.536 -0.317 272 HA3 GLY 55 HA3 GLY 55 -5.102 27.134 -0.307 273 H LYS 56 H LYS 56 -6.321 24.571 0.103 274 HA LYS 56 HA LYS 56 -5.496 23.774 2.869 275 HB2 LYS 56 2HB LYS 56 -7.824 22.880 3.045 276 HB3 LYS 56 3HB LYS 56 -7.696 24.620 2.888 277 HG2 LYS 56 2HG LYS 56 -9.555 23.870 1.638 278 HG3 LYS 56 3HG LYS 56 -8.371 24.503 0.520 279 HD2 LYS 56 2HD LYS 56 -7.723 22.257 -0.180 280 HD3 LYS 56 3HD LYS 56 -8.727 21.509 1.077 281 HE2 LYS 56 2HE LYS 56 -9.647 23.187 -1.266 282 HE3 LYS 56 3HE LYS 56 -9.701 21.424 -1.212 283 HZ1 LYS 56 HZ1 LYS 56 -11.230 23.153 0.674 284 HZ2 LYS 56 HZ2 LYS 56 -11.396 21.542 0.474 285 HZ3 LYS 56 HZ3 LYS 56 -11.832 22.606 -0.722 286 H GLN 57 H GLN 57 -6.574 21.247 2.989 287 HA GLN 57 HA GLN 57 -5.324 19.739 0.742 288 HB2 GLN 57 2HB GLN 57 -3.852 18.673 2.071 289 HB3 GLN 57 3HB GLN 57 -3.996 20.071 3.045 290 HG2 GLN 57 2HG GLN 57 -4.373 18.683 4.726 291 HG3 GLN 57 3HG GLN 57 -6.021 18.596 4.164 292 HE21 GLN 57 1HE2 GLN 57 -4.327 16.889 1.802 293 HE22 GLN 57 2HE2 GLN 57 -4.559 15.317 2.523 294 H CYS 58 H CYS 58 -6.161 17.560 0.457 295 HA CYS 58 HA CYS 58 -8.371 16.620 2.105 296 HB2 CYS 58 2HB CYS 58 -9.534 18.192 0.588 297 HB3 CYS 58 3HB CYS 58 -8.746 17.444 -0.802 298 HG CYS 58 HG CYS 58 -10.778 15.878 1.324 299 H ARG 59 H ARG 59 -8.733 14.429 1.869 300 HA ARG 59 HA ARG 59 -7.426 12.937 -0.291 301 HB2 ARG 59 2HB ARG 59 -6.748 11.132 1.234 302 HB3 ARG 59 3HB ARG 59 -5.798 12.603 1.361 303 HG2 ARG 59 2HG ARG 59 -7.961 12.610 3.324 304 HG3 ARG 59 3HG ARG 59 -6.997 11.148 3.466 305 HD2 ARG 59 2HD ARG 59 -5.891 13.948 3.376 306 HD3 ARG 59 3HD ARG 59 -6.246 13.061 4.875 307 HE ARG 59 HE ARG 59 -4.584 11.397 3.334 308 HH11 ARG 59 1HH1 ARG 59 -4.218 14.508 5.013 309 HH12 ARG 59 2HH1 ARG 59 -2.561 14.172 5.426 310 HH21 ARG 59 1HH2 ARG 59 -2.425 11.082 3.839 311 HH22 ARG 59 2HH2 ARG 59 -1.560 12.287 4.727 312 H VAL 60 H VAL 60 -8.909 11.773 -1.265 313 HA VAL 60 HA VAL 60 -10.965 10.331 0.314 314 HB VAL 60 HB VAL 60 -12.800 10.928 -1.132 315 HG11 VAL 60 1HG1 VAL 60 -11.431 13.514 -0.319 316 HG12 VAL 60 2HG1 VAL 60 -13.162 13.252 -0.522 317 HG13 VAL 60 3HG1 VAL 60 -12.280 12.476 0.813 318 HG21 VAL 60 1HG2 VAL 60 -10.928 12.776 -2.639 319 HG22 VAL 60 2HG2 VAL 60 -11.603 11.253 -3.271 320 HG23 VAL 60 3HG2 VAL 60 -12.672 12.622 -2.885 321 H ASN 61 H ASN 61 -11.940 8.564 -1.045 322 HA ASN 61 HA ASN 61 -10.042 7.681 -3.130 323 HB2 ASN 61 2HB ASN 61 -9.302 6.703 -1.072 324 HB3 ASN 61 3HB ASN 61 -10.934 6.240 -0.607 325 HD21 ASN 61 1HD2 ASN 61 -12.040 4.601 -2.040 326 HD22 ASN 61 2HD2 ASN 61 -11.025 3.352 -2.751 327 H LEU 62 H LEU 62 -10.812 6.728 -4.844 328 HA LEU 62 HA LEU 62 -13.797 6.401 -5.091 329 HB2 LEU 62 2HB LEU 62 -11.539 7.125 -6.961 330 HB3 LEU 62 3HB LEU 62 -12.967 6.317 -7.598 331 HG LEU 62 HG LEU 62 -14.402 8.130 -6.837 332 HD11 LEU 62 1HD1 LEU 62 -13.231 8.987 -4.853 333 HD12 LEU 62 2HD1 LEU 62 -13.366 10.288 -6.037 334 HD13 LEU 62 3HD1 LEU 62 -11.821 9.445 -5.832 335 HD21 LEU 62 1HD2 LEU 62 -13.367 8.204 -9.073 336 HD22 LEU 62 2HD2 LEU 62 -11.938 9.031 -8.408 337 HD23 LEU 62 3HD2 LEU 62 -13.504 9.841 -8.422 338 H LYS 63 H LYS 63 -14.605 4.455 -5.263 339 HA LYS 63 HA LYS 63 -12.908 2.129 -6.072 340 HB2 LYS 63 2HB LYS 63 -15.435 2.167 -4.386 341 HB3 LYS 63 3HB LYS 63 -14.460 0.752 -4.787 342 HG2 LYS 63 2HG LYS 63 -12.547 1.715 -3.493 343 HG3 LYS 63 3HG LYS 63 -13.552 3.127 -3.097 344 HD2 LYS 63 2HD LYS 63 -15.190 1.634 -1.964 345 HD3 LYS 63 3HD LYS 63 -14.117 0.253 -2.268 346 HE2 LYS 63 2HE LYS 63 -12.307 1.389 -0.980 347 HE3 LYS 63 3HE LYS 63 -13.367 2.780 -0.715 348 HZ1 LYS 63 HZ1 LYS 63 -13.384 1.336 1.207 349 HZ2 LYS 63 HZ2 LYS 63 -13.871 0.044 0.321 350 HZ3 LYS 63 HZ3 LYS 63 -14.868 1.321 0.531 351 H LEU 64 H LEU 64 -13.237 1.946 -8.318 352 HA LEU 64 HA LEU 64 -15.996 2.372 -9.297 353 HB2 LEU 64 2HB LEU 64 -13.476 1.982 -10.932 354 HB3 LEU 64 3HB LEU 64 -15.048 2.539 -11.478 355 HG LEU 64 HG LEU 64 -13.902 4.437 -11.556 356 HD11 LEU 64 1HD1 LEU 64 -14.981 4.647 -8.734 357 HD12 LEU 64 2HD1 LEU 64 -15.840 4.905 -10.271 358 HD13 LEU 64 3HD1 LEU 64 -14.530 5.990 -9.809 359 HD21 LEU 64 1HD2 LEU 64 -12.227 5.235 -10.026 360 HD22 LEU 64 2HD2 LEU 64 -11.837 3.618 -10.629 361 HD23 LEU 64 3HD2 LEU 64 -12.454 3.838 -8.965 362 H ILE 65 H ILE 65 -16.868 1.024 -10.851 363 HA ILE 65 HA ILE 65 -16.099 -1.872 -10.700 364 HB ILE 65 HB ILE 65 -18.386 -2.222 -11.744 365 HG12 ILE 65 2HG1 ILE 65 -19.079 0.516 -10.603 366 HG13 ILE 65 3HG1 ILE 65 -18.655 0.305 -12.311 367 HG21 ILE 65 1HG2 ILE 65 -19.497 -2.183 -9.534 368 HG22 ILE 65 2HG2 ILE 65 -17.828 -2.747 -9.397 369 HG23 ILE 65 3HG2 ILE 65 -18.250 -1.084 -8.913 370 HD11 ILE 65 1HD1 ILE 65 -20.485 -1.266 -12.619 371 HD12 ILE 65 2HD1 ILE 65 -20.969 -1.045 -10.912 372 HD13 ILE 65 3HD1 ILE 65 -21.035 0.316 -12.048 373 HA PRO 66 HA PRO 66 -14.745 -1.287 -14.932 374 HB2 PRO 66 2HB PRO 66 -14.352 -3.857 -15.743 375 HB3 PRO 66 3HB PRO 66 -13.292 -3.034 -14.556 376 HG2 PRO 66 2HG PRO 66 -15.574 -4.950 -13.992 377 HG3 PRO 66 3HG PRO 66 -13.924 -4.931 -13.282 378 HD2 PRO 66 2HD PRO 66 -16.102 -3.822 -12.035 379 HD3 PRO 66 3HD PRO 66 -14.448 -3.159 -11.853 380 H THR 67 H THR 67 -16.013 -0.723 -16.575 381 HA THR 67 HA THR 67 -18.623 -2.123 -17.043 382 HB THR 67 HB THR 67 -17.740 0.761 -17.463 383 HG1 THR 67 HG1 THR 67 -18.260 -0.025 -15.349 384 HG21 THR 67 1HG2 THR 67 -20.413 -0.563 -18.090 385 HG22 THR 67 2HG2 THR 67 -19.328 0.229 -19.259 386 HG23 THR 67 3HG2 THR 67 -20.125 1.193 -18.012 387 H GLY 68 H GLY 68 -15.670 -0.997 -18.597 388 HA2 GLY 68 HA2 GLY 68 -15.591 -2.876 -20.656 389 HA3 GLY 68 HA3 GLY 68 -16.481 -1.509 -21.321 390 H THR 69 H THR 69 -15.241 -0.074 -22.357 391 HA THR 69 HA THR 69 -12.364 0.231 -22.081 392 HB THR 69 HB THR 69 -12.795 2.281 -23.524 393 HG1 THR 69 HG1 THR 69 -14.923 2.471 -24.315 394 HG21 THR 69 1HG2 THR 69 -12.305 0.055 -24.523 395 HG22 THR 69 2HG2 THR 69 -13.400 1.017 -25.523 396 HG23 THR 69 3HG2 THR 69 -14.047 -0.309 -24.544 397 H GLY 70 H GLY 70 -14.828 1.221 -20.030 398 HA2 GLY 70 HA2 GLY 70 -12.917 2.924 -18.567 399 HA3 GLY 70 HA3 GLY 70 -14.519 3.598 -18.896 400 H ALA 71 H ALA 71 -13.820 3.517 -16.373 401 HA ALA 71 HA ALA 71 -15.309 1.261 -15.118 402 HB1 ALA 71 1HB ALA 71 -14.087 1.642 -13.155 403 HB2 ALA 71 2HB ALA 71 -12.896 1.777 -14.434 404 HB3 ALA 71 3HB ALA 71 -13.536 3.254 -13.676 405 H LEU 72 H LEU 72 -16.765 1.864 -13.326 406 HA LEU 72 HA LEU 72 -18.084 4.561 -13.539 407 HB2 LEU 72 2HB LEU 72 -19.140 1.868 -14.067 408 HB3 LEU 72 3HB LEU 72 -19.979 2.566 -12.706 409 HG LEU 72 HG LEU 72 -20.690 4.485 -14.013 410 HD11 LEU 72 1HD1 LEU 72 -20.231 4.474 -16.525 411 HD12 LEU 72 2HD1 LEU 72 -18.953 3.287 -16.207 412 HD13 LEU 72 3HD1 LEU 72 -18.871 4.904 -15.467 413 HD21 LEU 72 1HD2 LEU 72 -21.138 1.884 -15.527 414 HD22 LEU 72 2HD2 LEU 72 -22.171 3.326 -15.592 415 HD23 LEU 72 3HD2 LEU 72 -22.039 2.404 -14.084 416 H LEU 73 H LEU 73 -18.853 5.473 -11.621 417 HA LEU 73 HA LEU 73 -17.563 4.762 -9.216 418 HB2 LEU 73 2HB LEU 73 -18.473 6.986 -9.898 419 HB3 LEU 73 3HB LEU 73 -20.084 6.443 -9.487 420 HG LEU 73 HG LEU 73 -18.895 7.903 -7.803 421 HD11 LEU 73 1HD1 LEU 73 -19.740 5.222 -6.668 422 HD12 LEU 73 2HD1 LEU 73 -20.825 6.554 -7.128 423 HD13 LEU 73 3HD1 LEU 73 -19.667 6.775 -5.819 424 HD21 LEU 73 1HD2 LEU 73 -16.646 6.743 -8.079 425 HD22 LEU 73 2HD2 LEU 73 -17.277 5.426 -7.086 426 HD23 LEU 73 3HD2 LEU 73 -17.137 7.058 -6.410 427 H GLY 74 H GLY 74 -17.709 3.021 -8.107 428 HA2 GLY 74 HA2 GLY 74 -20.266 1.589 -7.640 429 HA3 GLY 74 HA3 GLY 74 -18.627 1.047 -7.208 430 H SER 75 H SER 75 -17.589 3.229 -5.852 431 HA SER 75 HA SER 75 -19.424 4.171 -3.772 432 HB2 SER 75 2HB SER 75 -17.289 2.105 -3.149 433 HB3 SER 75 3HB SER 75 -17.898 3.234 -1.940 434 HG SER 75 HG SER 75 -19.012 1.193 -1.906 435 H LEU 76 H LEU 76 -18.487 5.840 -2.489 436 HA LEU 76 HA LEU 76 -15.696 6.621 -3.118 437 HB2 LEU 76 2HB LEU 76 -17.410 7.966 -4.384 438 HB3 LEU 76 3HB LEU 76 -18.014 8.593 -2.859 439 HG LEU 76 HG LEU 76 -15.046 8.821 -3.428 440 HD11 LEU 76 1HD1 LEU 76 -15.957 9.471 -5.552 441 HD12 LEU 76 2HD1 LEU 76 -15.513 10.959 -4.695 442 HD13 LEU 76 3HD1 LEU 76 -17.220 10.441 -4.783 443 HD21 LEU 76 1HD2 LEU 76 -15.270 10.978 -2.268 444 HD22 LEU 76 2HD2 LEU 76 -15.924 9.681 -1.258 445 HD23 LEU 76 3HD2 LEU 76 -17.023 10.755 -2.145 446 H THR 77 H THR 77 -14.510 6.850 -1.423 447 HA THR 77 HA THR 77 -15.650 6.889 1.341 448 HB THR 77 HB THR 77 -12.957 6.015 0.198 449 HG1 THR 77 HG1 THR 77 -15.097 4.527 1.339 450 HG21 THR 77 1HG2 THR 77 -12.591 6.805 2.463 451 HG22 THR 77 2HG2 THR 77 -12.529 5.042 2.436 452 HG23 THR 77 3HG2 THR 77 -13.973 5.870 3.065 453 H VAL 78 H VAL 78 -15.488 8.863 2.346 454 HA VAL 78 HA VAL 78 -13.330 10.744 1.529 455 HB VAL 78 HB VAL 78 -14.280 12.356 3.093 456 HG11 VAL 78 1HG1 VAL 78 -16.234 12.962 1.715 457 HG12 VAL 78 2HG1 VAL 78 -14.885 12.443 0.711 458 HG13 VAL 78 3HG1 VAL 78 -16.239 11.330 0.999 459 HG21 VAL 78 1HG2 VAL 78 -15.487 10.942 4.690 460 HG22 VAL 78 2HG2 VAL 78 -16.591 12.088 3.929 461 HG23 VAL 78 3HG2 VAL 78 -16.586 10.393 3.406 462 H LEU 79 H LEU 79 -11.431 10.833 2.621 463 HA LEU 79 HA LEU 79 -11.232 9.293 5.184 464 HB2 LEU 79 2HB LEU 79 -9.933 8.438 3.275 465 HB3 LEU 79 3HB LEU 79 -9.130 9.990 3.096 466 HG LEU 79 HG LEU 79 -8.030 9.731 5.276 467 HD11 LEU 79 1HD1 LEU 79 -9.468 7.028 5.402 468 HD12 LEU 79 2HD1 LEU 79 -9.686 8.392 6.524 469 HD13 LEU 79 3HD1 LEU 79 -8.144 7.544 6.474 470 HD21 LEU 79 1HD2 LEU 79 -7.744 7.261 3.506 471 HD22 LEU 79 2HD2 LEU 79 -6.535 7.886 4.652 472 HD23 LEU 79 3HD2 LEU 79 -6.972 8.830 3.216 473 H ASP 80 H ASP 80 -10.347 12.380 3.605 474 HA ASP 80 HA ASP 80 -10.967 13.853 5.960 475 HB2 ASP 80 2HB ASP 80 -8.438 12.861 6.263 476 HB3 ASP 80 3HB ASP 80 -8.069 14.288 5.316 477 H GLY 81 H GLY 81 -10.457 16.217 5.664 478 HA2 GLY 81 HA2 GLY 81 -9.215 17.653 3.910 479 HA3 GLY 81 HA3 GLY 81 -10.507 17.135 2.826 480 H ASP 82 H ASP 82 -10.207 19.656 2.950 481 HA ASP 82 HA ASP 82 -12.111 20.899 4.859 482 HB2 ASP 82 2HB ASP 82 -10.189 22.225 4.173 483 HB3 ASP 82 3HB ASP 82 -10.522 21.891 2.490 484 H SER 83 H SER 83 -14.203 20.689 4.523 485 HA SER 83 HA SER 83 -15.143 18.772 2.790 486 HB2 SER 83 2HB SER 83 -17.400 19.405 3.602 487 HB3 SER 83 3HB SER 83 -16.189 19.259 4.894 488 HG SER 83 HG SER 83 -17.497 21.152 5.135 489 H ARG 84 H ARG 84 -14.905 22.134 1.995 490 HA ARG 84 HA ARG 84 -16.796 22.350 -0.112 491 HB2 ARG 84 2HB ARG 84 -14.025 23.590 0.139 492 HB3 ARG 84 3HB ARG 84 -15.249 24.101 -1.012 493 HG2 ARG 84 2HG ARG 84 -15.510 24.268 2.021 494 HG3 ARG 84 3HG ARG 84 -15.102 25.595 0.924 495 HD2 ARG 84 2HD ARG 84 -17.291 25.294 -0.235 496 HD3 ARG 84 3HD ARG 84 -17.732 24.047 0.943 497 HE ARG 84 HE ARG 84 -16.990 26.320 2.424 498 HH11 ARG 84 1HH1 ARG 84 -19.575 25.527 0.135 499 HH12 ARG 84 2HH1 ARG 84 -20.680 26.654 0.859 500 HH21 ARG 84 1HH2 ARG 84 -18.473 27.719 3.317 501 HH22 ARG 84 2HH2 ARG 84 -20.060 27.876 2.636 502 H LEU 85 H LEU 85 -13.671 20.595 -0.075 503 HA LEU 85 HA LEU 85 -13.963 20.051 -2.991 504 HB2 LEU 85 2HB LEU 85 -11.757 20.568 -2.228 505 HB3 LEU 85 3HB LEU 85 -11.816 19.317 -0.979 506 HG LEU 85 HG LEU 85 -11.709 17.557 -2.580 507 HD11 LEU 85 1HD1 LEU 85 -11.876 19.618 -4.837 508 HD12 LEU 85 2HD1 LEU 85 -13.111 18.409 -4.460 509 HD13 LEU 85 3HD1 LEU 85 -11.530 17.895 -5.035 510 HD21 LEU 85 1HD2 LEU 85 -9.793 19.722 -3.557 511 HD22 LEU 85 2HD2 LEU 85 -9.522 17.968 -3.523 512 HD23 LEU 85 3HD2 LEU 85 -9.622 18.907 -2.009 513 H CYS 86 H CYS 86 -13.802 18.024 0.061 514 HA CYS 86 HA CYS 86 -14.558 15.629 -0.892 515 HB2 CYS 86 2HB CYS 86 -15.856 16.843 1.590 516 HB3 CYS 86 3HB CYS 86 -15.519 15.138 1.250 517 HG CYS 86 HG CYS 86 -13.843 15.903 3.090 518 H ALA 87 H ALA 87 -17.005 18.214 -0.176 519 HA ALA 87 HA ALA 87 -19.248 16.560 -0.978 520 HB1 ALA 87 1HB ALA 87 -18.996 19.596 -0.652 521 HB2 ALA 87 2HB ALA 87 -20.513 18.679 -0.745 522 HB3 ALA 87 3HB ALA 87 -19.422 18.442 0.633 523 H ALA 88 H ALA 88 -17.315 19.061 -2.657 524 HA ALA 88 HA ALA 88 -18.892 19.229 -5.028 525 HB1 ALA 88 1HB ALA 88 -16.678 20.213 -5.910 526 HB2 ALA 88 2HB ALA 88 -17.310 20.965 -4.436 527 HB3 ALA 88 3HB ALA 88 -15.954 19.811 -4.366 528 H THR 89 H THR 89 -15.818 17.444 -4.512 529 HA THR 89 HA THR 89 -15.822 16.208 -7.079 530 HB THR 89 HB THR 89 -13.826 16.364 -5.614 531 HG1 THR 89 HG1 THR 89 -13.103 14.308 -6.229 532 HG21 THR 89 1HG2 THR 89 -15.021 15.464 -3.466 533 HG22 THR 89 2HG2 THR 89 -13.383 14.891 -3.813 534 HG23 THR 89 3HG2 THR 89 -14.781 13.862 -4.167 535 H LYS 90 H LYS 90 -17.024 14.945 -3.950 536 HA LYS 90 HA LYS 90 -17.876 12.407 -4.736 537 HB2 LYS 90 2HB LYS 90 -17.724 13.234 -2.449 538 HB3 LYS 90 3HB LYS 90 -18.962 14.459 -2.789 539 HG2 LYS 90 2HG LYS 90 -20.480 12.314 -3.226 540 HG3 LYS 90 3HG LYS 90 -19.243 11.513 -2.236 541 HD2 LYS 90 2HD LYS 90 -20.750 14.051 -1.492 542 HD3 LYS 90 3HD LYS 90 -21.216 12.416 -0.943 543 HE2 LYS 90 2HE LYS 90 -18.954 12.174 0.131 544 HE3 LYS 90 3HE LYS 90 -18.562 13.837 -0.323 545 HZ1 LYS 90 HZ1 LYS 90 -19.385 13.712 1.952 546 HZ2 LYS 90 HZ2 LYS 90 -20.781 13.024 1.472 547 HZ3 LYS 90 HZ3 LYS 90 -20.451 14.563 1.040 548 H ARG 91 H ARG 91 -19.733 15.472 -4.887 549 HA ARG 91 HA ARG 91 -22.103 14.277 -6.017 550 HB2 ARG 91 2HB ARG 91 -21.017 17.100 -6.004 551 HB3 ARG 91 3HB ARG 91 -22.574 16.692 -6.738 552 HG2 ARG 91 2HG ARG 91 -23.508 15.946 -4.656 553 HG3 ARG 91 3HG ARG 91 -21.952 16.014 -3.833 554 HD2 ARG 91 2HD ARG 91 -21.880 18.475 -4.153 555 HD3 ARG 91 3HD ARG 91 -23.450 18.402 -4.990 556 HE ARG 91 HE ARG 91 -23.798 17.152 -2.499 557 HH11 ARG 91 1HH1 ARG 91 -23.122 20.436 -3.637 558 HH12 ARG 91 2HH1 ARG 91 -23.868 21.172 -2.254 559 HH21 ARG 91 1HH2 ARG 91 -24.719 18.183 -0.715 560 HH22 ARG 91 2HH2 ARG 91 -24.742 19.920 -0.635 561 H ALA 92 H ALA 92 -19.249 15.760 -7.594 562 HA ALA 92 HA ALA 92 -20.148 15.452 -10.283 563 HB1 ALA 92 1HB ALA 92 -17.724 15.729 -10.818 564 HB2 ALA 92 2HB ALA 92 -18.365 16.964 -9.704 565 HB3 ALA 92 3HB ALA 92 -17.346 15.640 -9.103 566 H VAL 93 H VAL 93 -18.024 13.316 -8.313 567 HA VAL 93 HA VAL 93 -17.747 11.319 -10.281 568 HB VAL 93 HB VAL 93 -17.796 10.480 -7.379 569 HG11 VAL 93 1HG1 VAL 93 -16.018 9.017 -8.065 570 HG12 VAL 93 2HG1 VAL 93 -17.278 8.886 -9.290 571 HG13 VAL 93 3HG1 VAL 93 -15.839 9.856 -9.610 572 HG21 VAL 93 1HG2 VAL 93 -16.419 12.148 -6.860 573 HG22 VAL 93 2HG2 VAL 93 -15.170 11.266 -7.724 574 HG23 VAL 93 3HG2 VAL 93 -16.043 12.563 -8.554 575 H ALA 94 H ALA 94 -20.419 11.962 -8.180 576 HA ALA 94 HA ALA 94 -21.745 9.362 -8.492 577 HB1 ALA 94 1HB ALA 94 -22.776 12.021 -7.396 578 HB2 ALA 94 2HB ALA 94 -23.566 10.438 -7.243 579 HB3 ALA 94 3HB ALA 94 -22.005 10.719 -6.448 580 H GLN 95 H GLN 95 -21.300 12.006 -10.578 581 HA GLN 95 HA GLN 95 -23.752 11.304 -12.159 582 HB2 GLN 95 2HB GLN 95 -24.229 13.628 -12.515 583 HB3 GLN 95 3HB GLN 95 -24.154 13.274 -10.793 584 HG2 GLN 95 2HG GLN 95 -22.958 15.305 -10.897 585 HG3 GLN 95 3HG GLN 95 -21.749 14.118 -10.860 586 HE21 GLN 95 1HE2 GLN 95 -20.175 14.280 -12.505 587 HE22 GLN 95 2HE2 GLN 95 -20.401 15.340 -13.911 588 H VAL 96 H VAL 96 -20.319 11.818 -12.284 589 HA VAL 96 HA VAL 96 -19.986 12.454 -15.013 590 HB VAL 96 HB VAL 96 -17.839 11.143 -14.866 591 HG11 VAL 96 1HG1 VAL 96 -18.046 13.561 -14.268 592 HG12 VAL 96 2HG1 VAL 96 -18.126 13.076 -12.563 593 HG13 VAL 96 3HG1 VAL 96 -16.688 12.704 -13.503 594 HG21 VAL 96 1HG2 VAL 96 -17.161 10.560 -12.485 595 HG22 VAL 96 2HG2 VAL 96 -18.865 10.518 -12.096 596 HG23 VAL 96 3HG2 VAL 96 -18.233 9.405 -13.316 597 H ASN 97 H ASN 97 -19.700 11.276 -16.905 598 HA ASN 97 HA ASN 97 -21.545 9.163 -17.266 599 HB2 ASN 97 2HB ASN 97 -20.674 9.123 -19.602 600 HB3 ASN 97 3HB ASN 97 -21.134 10.714 -19.029 601 HD21 ASN 97 1HD2 ASN 97 -18.284 8.660 -19.833 602 HD22 ASN 97 2HD2 ASN 97 -17.195 10.029 -19.978 603 H SER 98 H SER 98 -17.963 8.996 -17.213 604 HA SER 98 HA SER 98 -17.535 6.391 -16.294 605 HB2 SER 98 2HB SER 98 -16.940 5.270 -18.502 606 HB3 SER 98 3HB SER 98 -18.658 5.388 -18.155 607 HG SER 98 HG SER 98 -18.172 5.975 -20.329 608 H PHE 99 H PHE 99 -15.374 5.969 -16.110 609 HA PHE 99 HA PHE 99 -13.549 8.169 -16.872 610 HB2 PHE 99 2HB PHE 99 -12.996 5.769 -15.108 611 HB3 PHE 99 3HB PHE 99 -12.109 7.281 -15.178 612 HD1 PHE 99 HD1 PHE 99 -14.818 5.463 -13.599 613 HD2 PHE 99 HD2 PHE 99 -13.346 9.447 -14.434 614 HE1 PHE 99 HE1 PHE 99 -16.344 6.396 -11.897 615 HE2 PHE 99 HE2 PHE 99 -14.867 10.360 -12.732 616 HZ PHE 99 HZ PHE 99 -16.366 8.803 -11.445 617 HA PRO 100 HA PRO 100 -12.349 5.180 -20.110 618 HB2 PRO 100 2HB PRO 100 -10.894 6.804 -21.757 619 HB3 PRO 100 3HB PRO 100 -12.682 6.861 -21.668 620 HG2 PRO 100 2HG PRO 100 -10.696 8.676 -20.270 621 HG3 PRO 100 3HG PRO 100 -12.157 9.141 -21.186 622 HD2 PRO 100 2HD PRO 100 -12.150 8.910 -18.453 623 HD3 PRO 100 3HD PRO 100 -13.584 8.471 -19.441 624 H LEU 101 H LEU 101 -10.650 3.753 -20.036 625 HA LEU 101 HA LEU 101 -8.572 4.299 -18.112 626 HB2 LEU 101 2HB LEU 101 -8.712 1.861 -19.897 627 HB3 LEU 101 3HB LEU 101 -7.962 2.032 -18.311 628 HG LEU 101 HG LEU 101 -10.905 1.893 -18.976 629 HD11 LEU 101 1HD1 LEU 101 -9.725 -0.231 -18.965 630 HD12 LEU 101 2HD1 LEU 101 -10.879 -0.135 -17.621 631 HD13 LEU 101 3HD1 LEU 101 -9.136 0.077 -17.310 632 HD21 LEU 101 1HD2 LEU 101 -11.388 2.012 -16.545 633 HD22 LEU 101 2HD2 LEU 101 -10.707 3.530 -17.152 634 HD23 LEU 101 3HD2 LEU 101 -9.686 2.415 -16.250 635 HA PRO 102 HA PRO 102 -5.316 5.401 -21.032 636 HB2 PRO 102 2HB PRO 102 -3.088 5.146 -19.507 637 HB3 PRO 102 3HB PRO 102 -4.323 6.410 -19.178 638 HG2 PRO 102 2HG PRO 102 -4.046 3.710 -17.811 639 HG3 PRO 102 3HG PRO 102 -4.236 5.320 -17.051 640 HD2 PRO 102 2HD PRO 102 -6.353 3.637 -17.500 641 HD3 PRO 102 3HD PRO 102 -6.510 5.407 -17.594 642 H LYS 103 H LYS 103 -5.363 2.324 -19.286 643 HA LYS 103 HA LYS 103 -4.458 0.890 -21.669 644 HB2 LYS 103 2HB LYS 103 -3.172 0.558 -18.936 645 HB3 LYS 103 3HB LYS 103 -3.167 -0.708 -20.162 646 HG2 LYS 103 2HG LYS 103 -1.176 0.229 -20.690 647 HG3 LYS 103 3HG LYS 103 -2.212 1.219 -21.722 648 HD2 LYS 103 2HD LYS 103 -2.359 2.739 -19.553 649 HD3 LYS 103 3HD LYS 103 -0.870 1.880 -19.095 650 HE2 LYS 103 2HE LYS 103 0.127 2.583 -21.314 651 HE3 LYS 103 3HE LYS 103 -1.392 3.438 -21.667 652 HZ1 LYS 103 HZ1 LYS 103 0.363 4.909 -20.792 653 HZ2 LYS 103 HZ2 LYS 103 0.398 4.099 -19.367 654 HZ3 LYS 103 HZ3 LYS 103 -0.951 4.908 -19.815 655 H ASP 104 H ASP 104 -5.297 -1.267 -21.754 656 HA ASP 104 HA ASP 104 -7.819 -1.569 -20.199 657 HB2 ASP 104 2HB ASP 104 -7.856 -0.697 -22.563 658 HB3 ASP 104 3HB ASP 104 -7.211 -2.248 -23.102 659 H GLN 105 H GLN 105 -5.220 -3.000 -19.514 660 HA GLN 105 HA GLN 105 -5.765 -5.763 -20.376 661 HB2 GLN 105 2HB GLN 105 -3.519 -4.760 -18.591 662 HB3 GLN 105 3HB GLN 105 -3.755 -6.392 -19.166 663 HG2 GLN 105 2HG GLN 105 -2.144 -5.636 -20.620 664 HG3 GLN 105 3HG GLN 105 -3.608 -5.407 -21.572 665 HE21 GLN 105 1HE2 GLN 105 -3.867 -3.294 -22.435 666 HE22 GLN 105 2HE2 GLN 105 -2.954 -1.910 -21.833 667 HA PRO 106 HA PRO 106 -8.057 -6.587 -16.572 668 HB2 PRO 106 2HB PRO 106 -7.776 -9.307 -16.314 669 HB3 PRO 106 3HB PRO 106 -8.798 -8.526 -17.556 670 HG2 PRO 106 2HG PRO 106 -5.945 -9.505 -17.857 671 HG3 PRO 106 3HG PRO 106 -7.364 -9.869 -18.912 672 HD2 PRO 106 2HD PRO 106 -5.605 -7.916 -19.557 673 HD3 PRO 106 3HD PRO 106 -7.354 -7.672 -19.823 674 H ASP 107 H ASP 107 -4.683 -6.754 -16.811 675 HA ASP 107 HA ASP 107 -4.201 -7.404 -13.958 676 HB2 ASP 107 2HB ASP 107 -2.646 -8.155 -15.763 677 HB3 ASP 107 3HB ASP 107 -2.310 -6.462 -16.148 678 H VAL 108 H VAL 108 -4.472 -4.572 -16.126 679 HA VAL 108 HA VAL 108 -3.585 -2.751 -13.938 680 HB VAL 108 HB VAL 108 -3.447 -1.012 -15.523 681 HG11 VAL 108 1HG1 VAL 108 -1.499 -2.548 -15.308 682 HG12 VAL 108 2HG1 VAL 108 -2.100 -3.490 -16.690 683 HG13 VAL 108 3HG1 VAL 108 -1.583 -1.815 -16.919 684 HG21 VAL 108 1HG2 VAL 108 -5.296 -1.474 -17.036 685 HG22 VAL 108 2HG2 VAL 108 -3.784 -1.300 -17.931 686 HG23 VAL 108 3HG2 VAL 108 -4.444 -2.905 -17.652 687 H VAL 109 H VAL 109 -6.475 -3.656 -15.781 688 HA VAL 109 HA VAL 109 -8.268 -1.654 -14.928 689 HB VAL 109 HB VAL 109 -8.607 -4.648 -15.335 690 HG11 VAL 109 1HG1 VAL 109 -10.494 -4.030 -13.918 691 HG12 VAL 109 2HG1 VAL 109 -10.833 -2.606 -14.928 692 HG13 VAL 109 3HG1 VAL 109 -11.068 -4.244 -15.575 693 HG21 VAL 109 1HG2 VAL 109 -9.582 -2.334 -17.056 694 HG22 VAL 109 2HG2 VAL 109 -8.025 -3.126 -17.338 695 HG23 VAL 109 3HG2 VAL 109 -9.532 -4.050 -17.492 696 H GLU 110 H GLU 110 -6.650 -4.112 -13.060 697 HA GLU 110 HA GLU 110 -8.381 -3.931 -10.711 698 HB2 GLU 110 2HB GLU 110 -5.731 -5.289 -11.204 699 HB3 GLU 110 3HB GLU 110 -6.670 -5.457 -9.722 700 HG2 GLU 110 2HG GLU 110 -7.632 -6.238 -12.512 701 HG3 GLU 110 3HG GLU 110 -7.040 -7.306 -11.262 702 H LYS 111 H LYS 111 -5.938 -1.902 -11.878 703 HA LYS 111 HA LYS 111 -4.924 -1.124 -9.160 704 HB2 LYS 111 2HB LYS 111 -3.900 -0.763 -11.989 705 HB3 LYS 111 3HB LYS 111 -3.377 0.317 -10.704 706 HG2 LYS 111 2HG LYS 111 -1.847 -1.583 -11.144 707 HG3 LYS 111 3HG LYS 111 -2.344 -1.400 -9.465 708 HD2 LYS 111 2HD LYS 111 -3.807 -3.277 -9.558 709 HD3 LYS 111 3HD LYS 111 -3.730 -3.368 -11.322 710 HE2 LYS 111 2HE LYS 111 -1.299 -3.789 -9.541 711 HE3 LYS 111 3HE LYS 111 -2.414 -5.089 -9.950 712 HZ1 LYS 111 HZ1 LYS 111 -0.903 -3.512 -11.950 713 HZ2 LYS 111 HZ2 LYS 111 -1.983 -4.697 -12.298 714 HZ3 LYS 111 HZ3 LYS 111 -0.590 -5.054 -11.523 715 H LEU 112 H LEU 112 -6.359 0.237 -12.069 716 HA LEU 112 HA LEU 112 -6.645 2.899 -10.959 717 HB2 LEU 112 2HB LEU 112 -7.709 3.434 -13.166 718 HB3 LEU 112 3HB LEU 112 -6.121 2.747 -13.209 719 HG LEU 112 HG LEU 112 -7.018 0.621 -13.685 720 HD11 LEU 112 1HD1 LEU 112 -9.244 0.491 -13.025 721 HD12 LEU 112 2HD1 LEU 112 -9.262 0.345 -14.770 722 HD13 LEU 112 3HD1 LEU 112 -9.704 1.886 -14.019 723 HD21 LEU 112 1HD2 LEU 112 -7.529 2.689 -15.781 724 HD22 LEU 112 2HD2 LEU 112 -7.319 0.924 -16.064 725 HD23 LEU 112 3HD2 LEU 112 -5.992 1.857 -15.390 726 H LYS 113 H LYS 113 -8.647 0.118 -10.850 727 HA LYS 113 HA LYS 113 -11.196 1.359 -10.450 728 HB2 LYS 113 2HB LYS 113 -11.751 -0.775 -9.270 729 HB3 LYS 113 3HB LYS 113 -11.068 -1.002 -10.879 730 HG2 LYS 113 2HG LYS 113 -8.971 -1.696 -10.043 731 HG3 LYS 113 3HG LYS 113 -9.250 -1.062 -8.424 732 HD2 LYS 113 2HD LYS 113 -9.319 -3.559 -8.648 733 HD3 LYS 113 3HD LYS 113 -10.698 -2.816 -7.820 734 HE2 LYS 113 2HE LYS 113 -12.102 -2.997 -9.752 735 HE3 LYS 113 3HE LYS 113 -10.762 -3.580 -10.757 736 HZ1 LYS 113 HZ1 LYS 113 -12.135 -5.419 -10.003 737 HZ2 LYS 113 HZ2 LYS 113 -11.902 -5.039 -8.429 738 HZ3 LYS 113 HZ3 LYS 113 -10.646 -5.565 -9.363 739 H ASN 114 H ASN 114 -8.460 1.167 -8.333 740 HA ASN 114 HA ASN 114 -10.064 2.228 -6.052 741 HB2 ASN 114 2HB ASN 114 -7.780 0.257 -5.791 742 HB3 ASN 114 3HB ASN 114 -8.844 0.913 -4.527 743 HD21 ASN 114 1HD2 ASN 114 -11.382 0.490 -6.048 744 HD22 ASN 114 2HD2 ASN 114 -11.597 -1.246 -5.991 745 H ILE 115 H ILE 115 -9.364 4.351 -6.752 746 HA ILE 115 HA ILE 115 -6.473 4.959 -6.338 747 HB ILE 115 HB ILE 115 -6.798 7.017 -7.543 748 HG12 ILE 115 2HG1 ILE 115 -9.269 7.234 -7.163 749 HG13 ILE 115 3HG1 ILE 115 -8.663 7.671 -8.713 750 HG21 ILE 115 1HG2 ILE 115 -7.367 4.475 -9.087 751 HG22 ILE 115 2HG2 ILE 115 -6.876 6.010 -9.825 752 HG23 ILE 115 3HG2 ILE 115 -5.796 5.179 -8.692 753 HD11 ILE 115 1HD1 ILE 115 -10.706 6.533 -9.028 754 HD12 ILE 115 2HD1 ILE 115 -9.428 5.493 -9.645 755 HD13 ILE 115 3HD1 ILE 115 -10.166 5.136 -8.076 756 H ASN 116 H ASN 116 -5.838 6.707 -5.116 757 HA ASN 116 HA ASN 116 -7.948 7.987 -3.455 758 HB2 ASN 116 2HB ASN 116 -5.080 8.618 -2.958 759 HB3 ASN 116 3HB ASN 116 -6.467 8.571 -1.870 760 HD21 ASN 116 1HD2 ASN 116 -7.317 5.818 -2.117 761 HD22 ASN 116 2HD2 ASN 116 -5.991 4.858 -1.520 762 H LEU 117 H LEU 117 -8.548 9.989 -3.959 763 HA LEU 117 HA LEU 117 -6.789 11.758 -5.628 764 HB2 LEU 117 2HB LEU 117 -9.589 12.294 -4.572 765 HB3 LEU 117 3HB LEU 117 -8.625 13.356 -5.602 766 HG LEU 117 HG LEU 117 -9.774 10.610 -6.355 767 HD11 LEU 117 1HD1 LEU 117 -11.446 12.408 -6.177 768 HD12 LEU 117 2HD1 LEU 117 -11.244 11.883 -7.858 769 HD13 LEU 117 3HD1 LEU 117 -10.507 13.408 -7.324 770 HD21 LEU 117 1HD2 LEU 117 -7.722 10.825 -7.583 771 HD22 LEU 117 2HD2 LEU 117 -8.055 12.533 -7.957 772 HD23 LEU 117 3HD2 LEU 117 -9.032 11.238 -8.699 773 H THR 118 H THR 118 -5.274 12.639 -4.429 774 HA THR 118 HA THR 118 -5.891 13.636 -1.693 775 HB THR 118 HB THR 118 -3.446 12.001 -2.471 776 HG1 THR 118 HG1 THR 118 -4.367 10.559 -0.986 777 HG21 THR 118 1HG2 THR 118 -3.034 12.172 0.047 778 HG22 THR 118 2HG2 THR 118 -4.248 13.472 0.070 779 HG23 THR 118 3HG2 THR 118 -2.749 13.665 -0.875 780 H VAL 119 H VAL 119 -5.321 15.648 -1.427 781 HA VAL 119 HA VAL 119 -3.367 16.968 -3.249 782 HB VAL 119 HB VAL 119 -4.878 18.713 -3.746 783 HG11 VAL 119 1HG1 VAL 119 -6.485 16.170 -4.129 784 HG12 VAL 119 2HG1 VAL 119 -6.580 17.659 -5.088 785 HG13 VAL 119 3HG1 VAL 119 -5.108 16.665 -5.158 786 HG21 VAL 119 1HG2 VAL 119 -7.227 18.820 -3.044 787 HG22 VAL 119 2HG2 VAL 119 -6.968 17.401 -1.993 788 HG23 VAL 119 3HG2 VAL 119 -6.144 18.947 -1.671 789 H ALA 120 H ALA 120 -2.468 18.910 -2.456 790 HA ALA 120 HA ALA 120 -3.041 20.084 0.107 791 HB1 ALA 120 1HB ALA 120 -0.541 18.304 -0.145 792 HB2 ALA 120 2HB ALA 120 -0.950 19.315 1.252 793 HB3 ALA 120 3HB ALA 120 -1.955 17.915 0.855 794 HA PRO 121 HA PRO 121 -0.450 23.327 -1.627 795 HB2 PRO 121 2HB PRO 121 0.831 23.680 1.062 796 HB3 PRO 121 3HB PRO 121 0.013 24.898 0.029 797 HG2 PRO 121 2HG PRO 121 -1.223 23.918 2.233 798 HG3 PRO 121 3HG PRO 121 -2.139 24.123 0.700 799 HD2 PRO 121 2HD PRO 121 -0.844 21.596 1.765 800 HD3 PRO 121 3HD PRO 121 -2.521 21.839 1.187 801 H GLU 122 H GLU 122 1.894 23.995 -1.921 802 HA GLU 122 HA GLU 122 3.532 21.634 -2.379 803 HB2 GLU 122 2HB GLU 122 4.279 24.562 -2.770 804 HB3 GLU 122 3HB GLU 122 5.101 23.149 -3.427 805 HG2 GLU 122 2HG GLU 122 2.354 24.219 -4.158 806 HG3 GLU 122 3HG GLU 122 3.790 24.154 -5.170 Start of MODEL 3 1 H1 ALA 22 H ALA 22 14.135 4.442 -22.596 2 HA ALA 22 HA ALA 22 11.541 3.262 -22.543 3 HB1 ALA 22 1HB ALA 22 13.771 1.650 -23.878 4 HB2 ALA 22 2HB ALA 22 12.233 0.973 -23.305 5 HB3 ALA 22 3HB ALA 22 12.238 2.143 -24.630 6 H ALA 23 H ALA 23 11.360 2.115 -20.597 7 HA ALA 23 HA ALA 23 13.533 1.249 -18.976 8 HB1 ALA 23 1HB ALA 23 12.320 3.928 -18.143 9 HB2 ALA 23 2HB ALA 23 13.565 3.017 -17.281 10 HB3 ALA 23 3HB ALA 23 13.939 3.753 -18.860 11 H ARG 24 H ARG 24 12.850 0.896 -16.742 12 HA ARG 24 HA ARG 24 10.076 0.342 -16.092 13 HB2 ARG 24 2HB ARG 24 10.223 -2.120 -16.329 14 HB3 ARG 24 3HB ARG 24 10.358 -1.288 -17.856 15 HG2 ARG 24 2HG ARG 24 12.985 -1.506 -17.394 16 HG3 ARG 24 3HG ARG 24 12.456 -2.804 -16.310 17 HD2 ARG 24 2HD ARG 24 11.416 -3.966 -18.209 18 HD3 ARG 24 3HD ARG 24 11.734 -2.571 -19.262 19 HE ARG 24 HE ARG 24 14.009 -3.010 -19.319 20 HH11 ARG 24 1HH1 ARG 24 12.410 -5.655 -17.564 21 HH12 ARG 24 2HH1 ARG 24 13.913 -6.481 -17.300 22 HH21 ARG 24 1HH2 ARG 24 15.851 -4.153 -19.005 23 HH22 ARG 24 2HH2 ARG 24 15.830 -5.690 -18.183 24 H GLN 25 H GLN 25 12.566 1.480 -14.885 25 HA GLN 25 HA GLN 25 13.065 -0.366 -12.573 26 HB2 GLN 25 2HB GLN 25 14.679 2.058 -13.374 27 HB3 GLN 25 3HB GLN 25 15.128 0.792 -12.258 28 HG2 GLN 25 2HG GLN 25 14.793 0.473 -15.275 29 HG3 GLN 25 3HG GLN 25 16.313 0.638 -14.441 30 HE21 GLN 25 1HE2 GLN 25 14.183 -1.675 -15.728 31 HE22 GLN 25 2HE2 GLN 25 14.776 -3.042 -14.807 32 H GLN 26 H GLN 26 11.652 2.688 -13.423 33 HA GLN 26 HA GLN 26 11.267 3.502 -10.576 34 HB2 GLN 26 2HB GLN 26 12.124 5.671 -11.056 35 HB3 GLN 26 3HB GLN 26 13.346 4.489 -11.490 36 HG2 GLN 26 2HG GLN 26 11.459 5.875 -13.456 37 HG3 GLN 26 3HG GLN 26 13.112 6.373 -13.115 38 HE21 GLN 26 1HE2 GLN 26 14.892 4.808 -13.713 39 HE22 GLN 26 2HE2 GLN 26 14.580 3.733 -15.058 40 H PHE 27 H PHE 27 9.787 3.025 -13.555 41 HA PHE 27 HA PHE 27 8.594 5.506 -13.980 42 HB2 PHE 27 2HB PHE 27 7.763 4.599 -15.909 43 HB3 PHE 27 3HB PHE 27 9.225 3.664 -15.618 44 HD1 PHE 27 HD1 PHE 27 8.931 1.359 -14.419 45 HD2 PHE 27 HD2 PHE 27 5.664 3.554 -16.153 46 HE1 PHE 27 HE1 PHE 27 7.590 -0.710 -14.494 47 HE2 PHE 27 HE2 PHE 27 4.326 1.484 -16.269 48 HZ PHE 27 HZ PHE 27 5.271 -0.669 -15.454 49 H VAL 28 H VAL 28 7.573 3.573 -11.554 50 HA VAL 28 HA VAL 28 4.717 3.601 -11.705 51 HB VAL 28 HB VAL 28 4.774 3.693 -9.198 52 HG11 VAL 28 1HG1 VAL 28 5.646 1.403 -8.970 53 HG12 VAL 28 2HG1 VAL 28 4.724 1.574 -10.474 54 HG13 VAL 28 3HG1 VAL 28 6.502 1.549 -10.523 55 HG21 VAL 28 1HG2 VAL 28 6.873 3.318 -8.013 56 HG22 VAL 28 2HG2 VAL 28 7.800 3.544 -9.501 57 HG23 VAL 28 3HG2 VAL 28 6.882 4.898 -8.801 58 H THR 29 H THR 29 7.001 6.161 -10.817 59 HA THR 29 HA THR 29 5.136 8.137 -9.971 60 HB THR 29 HB THR 29 7.543 8.261 -9.649 61 HG1 THR 29 HG1 THR 29 7.631 10.479 -10.010 62 HG21 THR 29 1HG2 THR 29 9.077 8.972 -11.373 63 HG22 THR 29 2HG2 THR 29 7.778 9.137 -12.565 64 HG23 THR 29 3HG2 THR 29 8.260 7.531 -11.989 65 H SER 30 H SER 30 6.108 7.180 -13.249 66 HA SER 30 HA SER 30 4.510 9.301 -14.492 67 HB2 SER 30 2HB SER 30 6.672 8.319 -15.459 68 HB3 SER 30 3HB SER 30 5.756 6.841 -15.798 69 HG SER 30 HG SER 30 5.403 9.449 -16.893 70 H GLU 31 H GLU 31 3.927 5.955 -13.525 71 HA GLU 31 HA GLU 31 1.319 5.868 -14.831 72 HB2 GLU 31 2HB GLU 31 2.388 4.288 -12.462 73 HB3 GLU 31 3HB GLU 31 0.825 4.032 -13.257 74 HG2 GLU 31 2HG GLU 31 2.080 3.681 -15.426 75 HG3 GLU 31 3HG GLU 31 3.580 3.683 -14.497 76 H VAL 32 H VAL 32 2.492 7.180 -11.701 77 HA VAL 32 HA VAL 32 -0.182 7.518 -10.600 78 HB VAL 32 HB VAL 32 2.476 8.801 -9.920 79 HG11 VAL 32 1HG1 VAL 32 0.828 10.499 -9.272 80 HG12 VAL 32 2HG1 VAL 32 -0.172 9.255 -8.482 81 HG13 VAL 32 3HG1 VAL 32 1.421 9.678 -7.826 82 HG21 VAL 32 1HG2 VAL 32 2.094 6.388 -9.339 83 HG22 VAL 32 2HG2 VAL 32 2.322 7.414 -7.916 84 HG23 VAL 32 3HG2 VAL 32 0.692 6.860 -8.373 85 H GLY 33 H GLY 33 1.767 9.362 -12.812 86 HA2 GLY 33 HA2 GLY 33 0.116 11.751 -12.950 87 HA3 GLY 33 HA3 GLY 33 1.344 11.209 -14.120 88 H ARG 34 H ARG 34 -0.728 8.643 -13.785 89 HA ARG 34 HA ARG 34 -2.682 9.547 -15.883 90 HB2 ARG 34 2HB ARG 34 -1.222 6.898 -15.802 91 HB3 ARG 34 3HB ARG 34 -2.386 7.434 -17.012 92 HG2 ARG 34 2HG ARG 34 -0.772 9.150 -17.789 93 HG3 ARG 34 3HG ARG 34 0.328 8.739 -16.469 94 HD2 ARG 34 2HD ARG 34 0.144 6.291 -17.521 95 HD3 ARG 34 3HD ARG 34 -0.264 7.207 -18.975 96 HE ARG 34 HE ARG 34 2.167 7.866 -17.350 97 HH11 ARG 34 1HH1 ARG 34 4.156 7.861 -18.346 98 HH12 ARG 34 2HH1 ARG 34 4.315 7.369 -20.007 99 HH21 ARG 34 1HH2 ARG 34 0.953 6.661 -20.469 100 HH22 ARG 34 2HH2 ARG 34 2.540 6.685 -21.178 101 H TYR 35 H TYR 35 -2.004 6.685 -13.848 102 HA TYR 35 HA TYR 35 -4.541 5.545 -13.960 103 HB2 TYR 35 2HB TYR 35 -2.113 5.224 -12.154 104 HB3 TYR 35 3HB TYR 35 -3.575 4.338 -11.802 105 HD1 TYR 35 HD1 TYR 35 -1.190 5.003 -14.615 106 HD2 TYR 35 HD2 TYR 35 -4.100 2.368 -12.884 107 HE1 TYR 35 HE1 TYR 35 -0.843 3.394 -16.497 108 HE2 TYR 35 HE2 TYR 35 -3.893 0.841 -14.787 109 HH TYR 35 HH TYR 35 -1.494 1.443 -17.461 110 H GLY 36 H GLY 36 -3.595 8.034 -11.853 111 HA2 GLY 36 HA2 GLY 36 -6.270 7.998 -10.457 112 HA3 GLY 36 HA3 GLY 36 -4.816 8.721 -9.793 113 H ALA 37 H ALA 37 -4.425 9.614 -12.859 114 HA ALA 37 HA ALA 37 -5.396 12.316 -12.405 115 HB1 ALA 37 1HB ALA 37 -3.084 11.875 -13.216 116 HB2 ALA 37 2HB ALA 37 -3.772 11.138 -14.691 117 HB3 ALA 37 3HB ALA 37 -4.031 12.847 -14.353 118 H ILE 38 H ILE 38 -6.109 9.474 -14.465 119 HA ILE 38 HA ILE 38 -7.887 10.796 -16.293 120 HB ILE 38 HB ILE 38 -8.706 8.567 -16.815 121 HG12 ILE 38 2HG1 ILE 38 -7.452 7.667 -14.182 122 HG13 ILE 38 3HG1 ILE 38 -9.161 7.667 -14.625 123 HG21 ILE 38 1HG2 ILE 38 -5.817 7.938 -16.206 124 HG22 ILE 38 2HG2 ILE 38 -6.770 7.633 -17.653 125 HG23 ILE 38 3HG2 ILE 38 -6.201 9.275 -17.309 126 HD11 ILE 38 1HD1 ILE 38 -8.681 5.980 -16.389 127 HD12 ILE 38 2HD1 ILE 38 -7.000 5.889 -15.748 128 HD13 ILE 38 3HD1 ILE 38 -8.369 5.425 -14.741 129 H TYR 39 H TYR 39 -8.359 9.734 -13.016 130 HA TYR 39 HA TYR 39 -11.256 10.052 -13.033 131 HB2 TYR 39 2HB TYR 39 -9.256 9.742 -10.751 132 HB3 TYR 39 3HB TYR 39 -11.002 9.684 -10.593 133 HD1 TYR 39 HD1 TYR 39 -12.315 7.847 -11.606 134 HD2 TYR 39 HD2 TYR 39 -8.012 7.781 -11.598 135 HE1 TYR 39 HE1 TYR 39 -12.325 5.516 -12.467 136 HE2 TYR 39 HE2 TYR 39 -8.030 5.358 -12.313 137 HH TYR 39 HH TYR 39 -11.152 3.783 -13.156 138 H THR 40 H THR 40 -8.531 11.823 -11.510 139 HA THR 40 HA THR 40 -10.053 13.974 -10.479 140 HB THR 40 HB THR 40 -7.638 13.156 -9.984 141 HG1 THR 40 HG1 THR 40 -7.280 15.242 -9.111 142 HG21 THR 40 1HG2 THR 40 -6.881 15.437 -11.834 143 HG22 THR 40 2HG2 THR 40 -6.824 13.751 -12.323 144 HG23 THR 40 3HG2 THR 40 -5.820 14.274 -10.958 145 H GLN 41 H GLN 41 -8.653 13.591 -13.683 146 HA GLN 41 HA GLN 41 -9.041 16.295 -14.625 147 HB2 GLN 41 2HB GLN 41 -8.596 13.642 -15.988 148 HB3 GLN 41 3HB GLN 41 -8.863 15.122 -16.899 149 HG2 GLN 41 2HG GLN 41 -6.933 16.224 -15.865 150 HG3 GLN 41 3HG GLN 41 -6.640 14.784 -14.866 151 HE21 GLN 41 1HE2 GLN 41 -6.415 12.726 -16.092 152 HE22 GLN 41 2HE2 GLN 41 -5.433 12.772 -17.571 153 H LEU 42 H LEU 42 -11.082 13.367 -14.548 154 HA LEU 42 HA LEU 42 -13.177 14.632 -16.186 155 HB2 LEU 42 2HB LEU 42 -12.672 12.147 -16.115 156 HB3 LEU 42 3HB LEU 42 -13.311 12.155 -14.467 157 HG LEU 42 HG LEU 42 -15.519 12.888 -15.299 158 HD11 LEU 42 1HD1 LEU 42 -14.276 12.712 -18.080 159 HD12 LEU 42 2HD1 LEU 42 -14.974 14.162 -17.311 160 HD13 LEU 42 3HD1 LEU 42 -16.013 12.813 -17.756 161 HD21 LEU 42 1HD2 LEU 42 -16.101 10.795 -16.548 162 HD22 LEU 42 2HD2 LEU 42 -15.152 10.520 -15.087 163 HD23 LEU 42 3HD2 LEU 42 -14.363 10.442 -16.683 164 H ILE 43 H ILE 43 -12.560 14.117 -12.706 165 HA ILE 43 HA ILE 43 -15.130 15.105 -11.859 166 HB ILE 43 HB ILE 43 -12.486 14.553 -10.488 167 HG12 ILE 43 2HG1 ILE 43 -14.045 13.194 -9.052 168 HG13 ILE 43 3HG1 ILE 43 -15.394 13.731 -10.086 169 HG21 ILE 43 1HG2 ILE 43 -13.194 16.643 -9.409 170 HG22 ILE 43 2HG2 ILE 43 -14.855 16.008 -9.255 171 HG23 ILE 43 3HG2 ILE 43 -13.506 15.272 -8.339 172 HD11 ILE 43 1HD1 ILE 43 -14.295 12.541 -12.003 173 HD12 ILE 43 2HD1 ILE 43 -13.070 11.940 -10.848 174 HD13 ILE 43 3HD1 ILE 43 -14.774 11.496 -10.664 175 H ARG 44 H ARG 44 -11.977 16.762 -11.997 176 HA ARG 44 HA ARG 44 -12.909 19.309 -11.166 177 HB2 ARG 44 2HB ARG 44 -10.810 20.179 -11.974 178 HB3 ARG 44 3HB ARG 44 -10.560 18.570 -11.314 179 HG2 ARG 44 2HG ARG 44 -9.278 18.409 -13.216 180 HG3 ARG 44 3HG ARG 44 -10.803 17.760 -13.776 181 HD2 ARG 44 2HD ARG 44 -11.215 20.299 -14.549 182 HD3 ARG 44 3HD ARG 44 -9.449 20.349 -14.462 183 HE ARG 44 HE ARG 44 -10.440 18.011 -15.882 184 HH11 ARG 44 1HH1 ARG 44 -9.869 21.473 -16.396 185 HH12 ARG 44 2HH1 ARG 44 -9.745 21.280 -18.118 186 HH21 ARG 44 1HH2 ARG 44 -10.212 17.835 -18.088 187 HH22 ARG 44 2HH2 ARG 44 -9.972 19.247 -19.068 188 H GLN 45 H GLN 45 -13.247 17.746 -14.285 189 HA GLN 45 HA GLN 45 -13.799 20.234 -15.721 190 HB2 GLN 45 2HB GLN 45 -13.635 19.176 -17.579 191 HB3 GLN 45 3HB GLN 45 -12.782 18.037 -16.557 192 HG2 GLN 45 2HG GLN 45 -14.864 16.637 -16.496 193 HG3 GLN 45 3HG GLN 45 -15.649 17.787 -17.587 194 HE21 GLN 45 1HE2 GLN 45 -12.353 16.211 -17.430 195 HE22 GLN 45 2HE2 GLN 45 -12.338 15.903 -19.157 196 H ASN 46 H ASN 46 -15.769 18.171 -13.676 197 HA ASN 46 HA ASN 46 -18.255 19.476 -14.621 198 HB2 ASN 46 2HB ASN 46 -17.707 17.988 -12.031 199 HB3 ASN 46 3HB ASN 46 -19.271 18.479 -12.665 200 HD21 ASN 46 1HD2 ASN 46 -16.913 16.019 -12.610 201 HD22 ASN 46 2HD2 ASN 46 -17.829 14.940 -13.661 202 H LEU 47 H LEU 47 -15.790 19.775 -12.072 203 HA LEU 47 HA LEU 47 -17.369 21.688 -10.531 204 HB2 LEU 47 2HB LEU 47 -14.693 20.352 -10.050 205 HB3 LEU 47 3HB LEU 47 -15.637 21.305 -8.903 206 HG LEU 47 HG LEU 47 -16.486 18.686 -10.034 207 HD11 LEU 47 1HD1 LEU 47 -15.444 19.611 -7.369 208 HD12 LEU 47 2HD1 LEU 47 -14.577 18.657 -8.589 209 HD13 LEU 47 3HD1 LEU 47 -15.979 17.939 -7.748 210 HD21 LEU 47 1HD2 LEU 47 -17.862 20.554 -8.054 211 HD22 LEU 47 2HD2 LEU 47 -18.240 18.824 -8.179 212 HD23 LEU 47 3HD2 LEU 47 -18.534 19.896 -9.560 213 H LEU 48 H LEU 48 -17.335 23.409 -11.743 214 HA LEU 48 HA LEU 48 -14.901 24.743 -12.587 215 HB2 LEU 48 2HB LEU 48 -16.471 26.428 -13.574 216 HB3 LEU 48 3HB LEU 48 -16.607 24.782 -14.149 217 HG LEU 48 HG LEU 48 -18.622 24.393 -12.865 218 HD11 LEU 48 1HD1 LEU 48 -18.418 27.284 -11.907 219 HD12 LEU 48 2HD1 LEU 48 -18.329 25.826 -10.881 220 HD13 LEU 48 3HD1 LEU 48 -19.827 26.233 -11.715 221 HD21 LEU 48 1HD2 LEU 48 -18.741 26.989 -14.459 222 HD22 LEU 48 2HD2 LEU 48 -20.105 25.900 -14.123 223 HD23 LEU 48 3HD2 LEU 48 -18.759 25.349 -15.135 224 H VAL 49 H VAL 49 -15.086 24.471 -9.793 225 HA VAL 49 HA VAL 49 -16.071 27.018 -8.730 226 HB VAL 49 HB VAL 49 -14.948 24.814 -7.007 227 HG11 VAL 49 1HG1 VAL 49 -15.325 26.970 -5.877 228 HG12 VAL 49 2HG1 VAL 49 -16.985 27.025 -6.513 229 HG13 VAL 49 3HG1 VAL 49 -16.518 25.775 -5.340 230 HG21 VAL 49 1HG2 VAL 49 -16.668 23.741 -8.377 231 HG22 VAL 49 2HG2 VAL 49 -17.302 24.000 -6.755 232 HG23 VAL 49 3HG2 VAL 49 -17.792 25.077 -8.084 233 H GLU 50 H GLU 50 -12.986 25.260 -8.319 234 HA GLU 50 HA GLU 50 -10.838 25.875 -8.291 235 HB2 GLU 50 2HB GLU 50 -11.680 28.708 -9.021 236 HB3 GLU 50 3HB GLU 50 -10.065 28.009 -9.096 237 HG2 GLU 50 2HG GLU 50 -10.866 26.360 -10.785 238 HG3 GLU 50 3HG GLU 50 -12.462 27.121 -10.756 239 H ASP 51 H ASP 51 -12.618 28.638 -6.811 240 HA ASP 51 HA ASP 51 -10.522 29.248 -4.960 241 HB2 ASP 51 2HB ASP 51 -12.276 30.801 -5.895 242 HB3 ASP 51 3HB ASP 51 -13.435 30.067 -4.787 243 H SER 52 H SER 52 -13.177 27.038 -4.773 244 HA SER 52 HA SER 52 -12.955 26.558 -1.847 245 HB2 SER 52 2HB SER 52 -14.570 25.237 -4.043 246 HB3 SER 52 3HB SER 52 -14.608 24.740 -2.349 247 HG SER 52 HG SER 52 -15.245 27.378 -3.261 248 H PHE 53 H PHE 53 -11.013 25.692 -4.437 249 HA PHE 53 HA PHE 53 -10.335 22.993 -3.340 250 HB2 PHE 53 2HB PHE 53 -9.975 24.072 -6.141 251 HB3 PHE 53 3HB PHE 53 -9.682 22.429 -5.598 252 HD1 PHE 53 HD1 PHE 53 -11.570 23.550 -7.882 253 HD2 PHE 53 HD2 PHE 53 -12.287 22.199 -3.843 254 HE1 PHE 53 HE1 PHE 53 -13.813 22.781 -8.519 255 HE2 PHE 53 HE2 PHE 53 -14.587 21.566 -4.464 256 HZ PHE 53 HZ PHE 53 -15.354 21.822 -6.813 257 H ARG 54 H ARG 54 -9.105 26.162 -3.991 258 HA ARG 54 HA ARG 54 -6.282 25.419 -4.078 259 HB2 ARG 54 2HB ARG 54 -5.865 27.747 -4.466 260 HB3 ARG 54 3HB ARG 54 -7.143 27.155 -5.524 261 HG2 ARG 54 2HG ARG 54 -8.858 28.206 -4.101 262 HG3 ARG 54 3HG ARG 54 -7.616 28.764 -2.975 263 HD2 ARG 54 2HD ARG 54 -8.230 30.605 -4.351 264 HD3 ARG 54 3HD ARG 54 -6.580 30.119 -4.739 265 HE ARG 54 HE ARG 54 -7.511 28.941 -6.740 266 HH11 ARG 54 1HH1 ARG 54 -9.579 31.548 -5.456 267 HH12 ARG 54 2HH1 ARG 54 -9.988 32.075 -7.063 268 HH21 ARG 54 1HH2 ARG 54 -8.190 29.628 -8.727 269 HH22 ARG 54 2HH2 ARG 54 -9.288 30.964 -8.869 270 H GLY 55 H GLY 55 -4.706 26.076 -2.628 271 HA2 GLY 55 HA2 GLY 55 -3.683 26.917 -0.738 272 HA3 GLY 55 HA3 GLY 55 -5.222 27.690 -0.290 273 H LYS 56 H LYS 56 -6.159 24.585 -0.472 274 HA LYS 56 HA LYS 56 -5.335 23.842 2.304 275 HB2 LYS 56 2HB LYS 56 -7.673 23.042 2.647 276 HB3 LYS 56 3HB LYS 56 -7.508 24.770 2.474 277 HG2 LYS 56 2HG LYS 56 -9.477 24.075 1.359 278 HG3 LYS 56 3HG LYS 56 -8.361 24.676 0.165 279 HD2 LYS 56 2HD LYS 56 -7.868 22.525 -0.684 280 HD3 LYS 56 3HD LYS 56 -8.598 21.697 0.714 281 HE2 LYS 56 2HE LYS 56 -10.005 23.329 -1.418 282 HE3 LYS 56 3HE LYS 56 -9.952 21.554 -1.341 283 HZ1 LYS 56 HZ1 LYS 56 -11.392 21.606 0.555 284 HZ2 LYS 56 HZ2 LYS 56 -12.003 22.693 -0.528 285 HZ3 LYS 56 HZ3 LYS 56 -11.208 23.229 0.773 286 H GLN 57 H GLN 57 -6.258 21.422 2.650 287 HA GLN 57 HA GLN 57 -5.270 19.784 0.347 288 HB2 GLN 57 2HB GLN 57 -4.048 18.410 1.730 289 HB3 GLN 57 3HB GLN 57 -3.672 20.002 2.322 290 HG2 GLN 57 2HG GLN 57 -4.339 19.433 4.398 291 HG3 GLN 57 3HG GLN 57 -5.932 18.953 3.850 292 HE21 GLN 57 1HE2 GLN 57 -5.563 16.677 2.318 293 HE22 GLN 57 2HE2 GLN 57 -4.763 15.459 3.296 294 H CYS 58 H CYS 58 -6.166 17.664 0.142 295 HA CYS 58 HA CYS 58 -8.322 16.786 1.899 296 HB2 CYS 58 2HB CYS 58 -9.467 18.418 0.377 297 HB3 CYS 58 3HB CYS 58 -8.910 17.470 -1.015 298 HG CYS 58 HG CYS 58 -10.193 15.299 -0.467 299 H ARG 59 H ARG 59 -8.641 14.610 1.787 300 HA ARG 59 HA ARG 59 -7.446 13.028 -0.385 301 HB2 ARG 59 2HB ARG 59 -6.826 11.258 1.170 302 HB3 ARG 59 3HB ARG 59 -5.829 12.688 1.311 303 HG2 ARG 59 2HG ARG 59 -8.105 12.469 3.248 304 HG3 ARG 59 3HG ARG 59 -6.823 11.285 3.418 305 HD2 ARG 59 2HD ARG 59 -6.514 14.301 3.423 306 HD3 ARG 59 3HD ARG 59 -6.626 13.277 4.861 307 HE ARG 59 HE ARG 59 -4.460 12.574 2.986 308 HH11 ARG 59 1HH1 ARG 59 -5.247 14.226 6.024 309 HH12 ARG 59 2HH1 ARG 59 -3.595 14.204 6.552 310 HH21 ARG 59 1HH2 ARG 59 -2.359 12.549 3.768 311 HH22 ARG 59 2HH2 ARG 59 -2.008 13.238 5.323 312 H VAL 60 H VAL 60 -8.932 11.763 -1.288 313 HA VAL 60 HA VAL 60 -11.008 10.470 0.392 314 HB VAL 60 HB VAL 60 -12.846 10.941 -1.093 315 HG11 VAL 60 1HG1 VAL 60 -11.538 13.578 -0.341 316 HG12 VAL 60 2HG1 VAL 60 -13.266 13.273 -0.576 317 HG13 VAL 60 3HG1 VAL 60 -12.385 12.539 0.796 318 HG21 VAL 60 1HG2 VAL 60 -10.996 12.767 -2.686 319 HG22 VAL 60 2HG2 VAL 60 -11.629 11.185 -3.231 320 HG23 VAL 60 3HG2 VAL 60 -12.734 12.532 -2.942 321 H ASN 61 H ASN 61 -12.187 8.764 -1.108 322 HA ASN 61 HA ASN 61 -10.189 7.551 -2.878 323 HB2 ASN 61 2HB ASN 61 -9.662 6.628 -0.827 324 HB3 ASN 61 3HB ASN 61 -11.296 6.762 -0.187 325 HD21 ASN 61 1HD2 ASN 61 -10.496 5.122 -3.236 326 HD22 ASN 61 2HD2 ASN 61 -10.911 3.524 -2.671 327 H LEU 62 H LEU 62 -10.905 6.632 -4.645 328 HA LEU 62 HA LEU 62 -13.878 6.316 -5.030 329 HB2 LEU 62 2HB LEU 62 -11.579 7.086 -6.832 330 HB3 LEU 62 3HB LEU 62 -12.971 6.259 -7.508 331 HG LEU 62 HG LEU 62 -14.453 8.059 -6.756 332 HD11 LEU 62 1HD1 LEU 62 -13.438 10.250 -5.996 333 HD12 LEU 62 2HD1 LEU 62 -11.902 9.407 -5.735 334 HD13 LEU 62 3HD1 LEU 62 -13.341 8.972 -4.781 335 HD21 LEU 62 1HD2 LEU 62 -11.980 8.972 -8.316 336 HD22 LEU 62 2HD2 LEU 62 -13.569 9.766 -8.367 337 HD23 LEU 62 3HD2 LEU 62 -13.387 8.116 -8.985 338 H LYS 63 H LYS 63 -14.598 4.332 -5.171 339 HA LYS 63 HA LYS 63 -12.806 2.119 -6.105 340 HB2 LYS 63 2HB LYS 63 -15.065 2.114 -4.084 341 HB3 LYS 63 3HB LYS 63 -14.413 0.643 -4.822 342 HG2 LYS 63 2HG LYS 63 -12.153 1.188 -3.978 343 HG3 LYS 63 3HG LYS 63 -12.775 2.646 -3.196 344 HD2 LYS 63 2HD LYS 63 -13.889 -0.105 -2.556 345 HD3 LYS 63 3HD LYS 63 -12.443 0.489 -1.765 346 HE2 LYS 63 2HE LYS 63 -14.847 2.306 -1.806 347 HE3 LYS 63 3HE LYS 63 -14.934 0.875 -0.781 348 HZ1 LYS 63 HZ1 LYS 63 -12.727 2.867 -0.599 349 HZ2 LYS 63 HZ2 LYS 63 -13.012 1.609 0.418 350 HZ3 LYS 63 HZ3 LYS 63 -14.046 2.879 0.353 351 H LEU 64 H LEU 64 -13.241 1.898 -8.274 352 HA LEU 64 HA LEU 64 -15.994 2.315 -9.235 353 HB2 LEU 64 2HB LEU 64 -13.433 1.979 -10.817 354 HB3 LEU 64 3HB LEU 64 -14.985 2.501 -11.424 355 HG LEU 64 HG LEU 64 -13.880 4.418 -11.438 356 HD11 LEU 64 1HD1 LEU 64 -15.061 4.580 -8.642 357 HD12 LEU 64 2HD1 LEU 64 -15.863 4.848 -10.215 358 HD13 LEU 64 3HD1 LEU 64 -14.598 5.944 -9.680 359 HD21 LEU 64 1HD2 LEU 64 -12.506 3.880 -8.794 360 HD22 LEU 64 2HD2 LEU 64 -12.291 5.274 -9.851 361 HD23 LEU 64 3HD2 LEU 64 -11.811 3.666 -10.430 362 H ILE 65 H ILE 65 -16.845 0.962 -10.818 363 HA ILE 65 HA ILE 65 -16.091 -1.935 -10.666 364 HB ILE 65 HB ILE 65 -18.349 -2.273 -11.782 365 HG12 ILE 65 2HG1 ILE 65 -18.992 0.523 -10.788 366 HG13 ILE 65 3HG1 ILE 65 -18.548 0.180 -12.462 367 HG21 ILE 65 1HG2 ILE 65 -19.547 -2.196 -9.642 368 HG22 ILE 65 2HG2 ILE 65 -17.887 -2.744 -9.398 369 HG23 ILE 65 3HG2 ILE 65 -18.336 -1.079 -8.977 370 HD11 ILE 65 1HD1 ILE 65 -20.453 -1.339 -12.682 371 HD12 ILE 65 2HD1 ILE 65 -20.932 -0.959 -10.996 372 HD13 ILE 65 3HD1 ILE 65 -20.939 0.310 -12.239 373 HA PRO 66 HA PRO 66 -14.657 -1.513 -14.883 374 HB2 PRO 66 2HB PRO 66 -14.826 -4.055 -15.842 375 HB3 PRO 66 3HB PRO 66 -13.644 -3.574 -14.571 376 HG2 PRO 66 2HG PRO 66 -16.341 -4.896 -14.190 377 HG3 PRO 66 3HG PRO 66 -14.763 -5.367 -13.478 378 HD2 PRO 66 2HD PRO 66 -16.581 -3.839 -12.131 379 HD3 PRO 66 3HD PRO 66 -14.816 -3.575 -11.944 380 H THR 67 H THR 67 -15.422 -1.291 -16.955 381 HA THR 67 HA THR 67 -17.947 -2.182 -18.017 382 HB THR 67 HB THR 67 -17.765 0.547 -16.736 383 HG1 THR 67 HG1 THR 67 -18.922 -1.355 -15.994 384 HG21 THR 67 1HG2 THR 67 -18.247 1.195 -19.055 385 HG22 THR 67 2HG2 THR 67 -19.706 1.332 -18.068 386 HG23 THR 67 3HG2 THR 67 -19.520 -0.053 -19.171 387 H GLY 68 H GLY 68 -18.099 -1.705 -20.224 388 HA2 GLY 68 HA2 GLY 68 -15.558 -1.980 -21.439 389 HA3 GLY 68 HA3 GLY 68 -17.106 -1.820 -22.301 390 H THR 69 H THR 69 -17.298 0.993 -20.965 391 HA THR 69 HA THR 69 -15.687 2.488 -22.968 392 HB THR 69 HB THR 69 -17.194 4.377 -22.326 393 HG1 THR 69 HG1 THR 69 -19.049 3.766 -21.059 394 HG21 THR 69 1HG2 THR 69 -19.194 3.543 -23.423 395 HG22 THR 69 2HG2 THR 69 -18.732 1.861 -23.114 396 HG23 THR 69 3HG2 THR 69 -17.775 2.864 -24.225 397 H GLY 70 H GLY 70 -15.272 1.511 -19.819 398 HA2 GLY 70 HA2 GLY 70 -13.182 2.629 -18.713 399 HA3 GLY 70 HA3 GLY 70 -14.181 4.084 -18.799 400 H ALA 71 H ALA 71 -13.344 3.250 -16.287 401 HA ALA 71 HA ALA 71 -15.125 1.355 -15.058 402 HB1 ALA 71 1HB ALA 71 -12.718 1.973 -14.405 403 HB2 ALA 71 2HB ALA 71 -13.423 3.388 -13.609 404 HB3 ALA 71 3HB ALA 71 -13.886 1.745 -13.116 405 H LEU 72 H LEU 72 -16.616 1.854 -13.287 406 HA LEU 72 HA LEU 72 -18.055 4.492 -13.516 407 HB2 LEU 72 2HB LEU 72 -18.963 1.781 -14.165 408 HB3 LEU 72 3HB LEU 72 -19.879 2.411 -12.800 409 HG LEU 72 HG LEU 72 -20.593 4.350 -14.099 410 HD11 LEU 72 1HD1 LEU 72 -18.747 4.836 -15.501 411 HD12 LEU 72 2HD1 LEU 72 -20.060 4.385 -16.596 412 HD13 LEU 72 3HD1 LEU 72 -18.752 3.225 -16.241 413 HD21 LEU 72 1HD2 LEU 72 -21.874 2.212 -14.247 414 HD22 LEU 72 2HD2 LEU 72 -20.938 1.760 -15.676 415 HD23 LEU 72 3HD2 LEU 72 -22.003 3.175 -15.732 416 H LEU 73 H LEU 73 -18.847 5.393 -11.636 417 HA LEU 73 HA LEU 73 -17.603 4.688 -9.200 418 HB2 LEU 73 2HB LEU 73 -18.489 6.908 -9.893 419 HB3 LEU 73 3HB LEU 73 -20.112 6.361 -9.546 420 HG LEU 73 HG LEU 73 -18.973 7.820 -7.811 421 HD11 LEU 73 1HD1 LEU 73 -20.956 6.472 -7.231 422 HD12 LEU 73 2HD1 LEU 73 -19.858 6.719 -5.859 423 HD13 LEU 73 3HD1 LEU 73 -19.890 5.156 -6.681 424 HD21 LEU 73 1HD2 LEU 73 -17.411 5.312 -7.060 425 HD22 LEU 73 2HD2 LEU 73 -17.302 6.911 -6.332 426 HD23 LEU 73 3HD2 LEU 73 -16.726 6.663 -7.983 427 H GLY 74 H GLY 74 -17.736 2.953 -8.097 428 HA2 GLY 74 HA2 GLY 74 -20.326 1.552 -7.592 429 HA3 GLY 74 HA3 GLY 74 -18.689 0.983 -7.194 430 H SER 75 H SER 75 -17.568 3.133 -5.830 431 HA SER 75 HA SER 75 -19.405 4.047 -3.710 432 HB2 SER 75 2HB SER 75 -17.082 2.162 -3.178 433 HB3 SER 75 3HB SER 75 -17.844 3.159 -1.934 434 HG SER 75 HG SER 75 -18.692 1.009 -1.974 435 H LEU 76 H LEU 76 -18.666 5.914 -2.714 436 HA LEU 76 HA LEU 76 -15.844 6.738 -3.232 437 HB2 LEU 76 2HB LEU 76 -17.492 8.105 -4.497 438 HB3 LEU 76 3HB LEU 76 -18.239 8.617 -2.986 439 HG LEU 76 HG LEU 76 -15.247 8.988 -3.252 440 HD11 LEU 76 1HD1 LEU 76 -17.260 10.649 -4.799 441 HD12 LEU 76 2HD1 LEU 76 -15.952 9.649 -5.462 442 HD13 LEU 76 3HD1 LEU 76 -15.564 11.102 -4.533 443 HD21 LEU 76 1HD2 LEU 76 -16.437 9.758 -1.215 444 HD22 LEU 76 2HD2 LEU 76 -17.473 10.804 -2.204 445 HD23 LEU 76 3HD2 LEU 76 -15.727 11.114 -2.088 446 H THR 77 H THR 77 -14.676 6.735 -1.468 447 HA THR 77 HA THR 77 -15.946 6.888 1.250 448 HB THR 77 HB THR 77 -13.285 5.814 0.231 449 HG1 THR 77 HG1 THR 77 -15.615 4.613 1.352 450 HG21 THR 77 1HG2 THR 77 -14.436 5.850 3.070 451 HG22 THR 77 2HG2 THR 77 -12.987 6.716 2.514 452 HG23 THR 77 3HG2 THR 77 -12.997 4.937 2.548 453 H VAL 78 H VAL 78 -15.778 8.901 2.183 454 HA VAL 78 HA VAL 78 -13.595 10.734 1.340 455 HB VAL 78 HB VAL 78 -14.534 12.399 2.842 456 HG11 VAL 78 1HG1 VAL 78 -15.152 12.315 0.449 457 HG12 VAL 78 2HG1 VAL 78 -16.553 11.306 0.834 458 HG13 VAL 78 3HG1 VAL 78 -16.456 12.967 1.453 459 HG21 VAL 78 1HG2 VAL 78 -15.712 11.063 4.519 460 HG22 VAL 78 2HG2 VAL 78 -16.830 12.171 3.710 461 HG23 VAL 78 3HG2 VAL 78 -16.832 10.451 3.269 462 H LEU 79 H LEU 79 -11.737 10.992 2.438 463 HA LEU 79 HA LEU 79 -11.369 9.338 4.903 464 HB2 LEU 79 2HB LEU 79 -9.293 10.520 3.038 465 HB3 LEU 79 3HB LEU 79 -8.991 9.460 4.394 466 HG LEU 79 HG LEU 79 -10.605 8.667 1.917 467 HD11 LEU 79 1HD1 LEU 79 -8.584 7.412 1.249 468 HD12 LEU 79 2HD1 LEU 79 -7.692 8.136 2.605 469 HD13 LEU 79 3HD1 LEU 79 -8.308 9.155 1.283 470 HD21 LEU 79 1HD2 LEU 79 -9.431 6.981 4.178 471 HD22 LEU 79 2HD2 LEU 79 -10.255 6.355 2.734 472 HD23 LEU 79 3HD2 LEU 79 -11.156 7.308 3.919 473 H ASP 80 H ASP 80 -10.434 12.568 3.610 474 HA ASP 80 HA ASP 80 -11.457 14.050 5.742 475 HB2 ASP 80 2HB ASP 80 -9.378 12.962 6.986 476 HB3 ASP 80 3HB ASP 80 -8.457 14.050 5.943 477 H GLY 81 H GLY 81 -10.755 16.383 5.624 478 HA2 GLY 81 HA2 GLY 81 -8.934 17.624 4.015 479 HA3 GLY 81 HA3 GLY 81 -10.271 17.316 2.903 480 H ASP 82 H ASP 82 -9.966 19.767 2.873 481 HA ASP 82 HA ASP 82 -11.609 21.131 4.925 482 HB2 ASP 82 2HB ASP 82 -9.730 22.358 4.116 483 HB3 ASP 82 3HB ASP 82 -10.171 22.081 2.438 484 H SER 83 H SER 83 -13.690 20.991 4.789 485 HA SER 83 HA SER 83 -14.739 18.899 3.470 486 HB2 SER 83 2HB SER 83 -16.926 19.558 4.300 487 HB3 SER 83 3HB SER 83 -15.693 19.917 5.506 488 HG SER 83 HG SER 83 -15.947 22.053 5.186 489 H ARG 84 H ARG 84 -14.788 22.115 2.078 490 HA ARG 84 HA ARG 84 -16.968 21.787 0.291 491 HB2 ARG 84 2HB ARG 84 -14.485 23.479 -0.147 492 HB3 ARG 84 3HB ARG 84 -16.052 23.662 -0.935 493 HG2 ARG 84 2HG ARG 84 -15.424 24.178 2.005 494 HG3 ARG 84 3HG ARG 84 -15.741 25.363 0.749 495 HD2 ARG 84 2HD ARG 84 -17.750 25.297 1.893 496 HD3 ARG 84 3HD ARG 84 -18.057 24.266 0.491 497 HE ARG 84 HE ARG 84 -17.128 22.910 2.959 498 HH11 ARG 84 1HH1 ARG 84 -20.024 23.782 1.114 499 HH12 ARG 84 2HH1 ARG 84 -20.984 22.579 1.922 500 HH21 ARG 84 1HH2 ARG 84 -18.389 21.487 3.973 501 HH22 ARG 84 2HH2 ARG 84 -20.074 21.299 3.564 502 H LEU 85 H LEU 85 -13.646 20.487 -0.010 503 HA LEU 85 HA LEU 85 -14.114 19.879 -2.870 504 HB2 LEU 85 2HB LEU 85 -11.915 20.541 -2.190 505 HB3 LEU 85 3HB LEU 85 -11.808 19.237 -1.004 506 HG LEU 85 HG LEU 85 -11.639 17.572 -2.677 507 HD11 LEU 85 1HD1 LEU 85 -11.664 17.989 -5.114 508 HD12 LEU 85 2HD1 LEU 85 -12.118 19.676 -4.846 509 HD13 LEU 85 3HD1 LEU 85 -13.240 18.368 -4.440 510 HD21 LEU 85 1HD2 LEU 85 -9.637 19.095 -2.203 511 HD22 LEU 85 2HD2 LEU 85 -9.997 19.938 -3.706 512 HD23 LEU 85 3HD2 LEU 85 -9.559 18.215 -3.751 513 H CYS 86 H CYS 86 -13.838 17.891 0.167 514 HA CYS 86 HA CYS 86 -14.775 15.445 -0.768 515 HB2 CYS 86 2HB CYS 86 -15.474 16.931 1.808 516 HB3 CYS 86 3HB CYS 86 -15.936 15.263 1.477 517 HG CYS 86 HG CYS 86 -12.807 16.396 1.335 518 H ALA 87 H ALA 87 -16.840 18.268 0.102 519 HA ALA 87 HA ALA 87 -19.348 17.039 -0.500 520 HB1 ALA 87 1HB ALA 87 -19.058 19.051 0.907 521 HB2 ALA 87 2HB ALA 87 -18.538 19.981 -0.511 522 HB3 ALA 87 3HB ALA 87 -20.196 19.362 -0.434 523 H ALA 88 H ALA 88 -17.290 19.155 -2.573 524 HA ALA 88 HA ALA 88 -19.087 19.134 -4.789 525 HB1 ALA 88 1HB ALA 88 -16.092 19.743 -4.657 526 HB2 ALA 88 2HB ALA 88 -17.218 20.249 -5.931 527 HB3 ALA 88 3HB ALA 88 -17.399 20.894 -4.302 528 H THR 89 H THR 89 -16.036 17.275 -4.291 529 HA THR 89 HA THR 89 -16.057 15.915 -6.792 530 HB THR 89 HB THR 89 -14.123 16.071 -5.242 531 HG1 THR 89 HG1 THR 89 -13.434 14.006 -5.848 532 HG21 THR 89 1HG2 THR 89 -15.447 15.199 -3.166 533 HG22 THR 89 2HG2 THR 89 -13.803 14.598 -3.415 534 HG23 THR 89 3HG2 THR 89 -15.202 13.589 -3.851 535 H LYS 90 H LYS 90 -17.442 14.936 -3.688 536 HA LYS 90 HA LYS 90 -18.372 12.370 -4.229 537 HB2 LYS 90 2HB LYS 90 -18.310 13.449 -2.065 538 HB3 LYS 90 3HB LYS 90 -19.439 14.690 -2.596 539 HG2 LYS 90 2HG LYS 90 -21.048 12.523 -2.891 540 HG3 LYS 90 3HG LYS 90 -19.934 11.883 -1.670 541 HD2 LYS 90 2HD LYS 90 -21.436 14.533 -1.546 542 HD3 LYS 90 3HD LYS 90 -21.997 13.062 -0.765 543 HE2 LYS 90 2HE LYS 90 -19.323 14.411 -0.135 544 HE3 LYS 90 3HE LYS 90 -20.820 14.727 0.754 545 HZ1 LYS 90 HZ1 LYS 90 -19.517 12.077 0.563 546 HZ2 LYS 90 HZ2 LYS 90 -20.897 12.392 1.386 547 HZ3 LYS 90 HZ3 LYS 90 -19.485 13.052 1.866 548 H ARG 91 H ARG 91 -20.008 15.449 -4.936 549 HA ARG 91 HA ARG 91 -22.294 14.168 -6.193 550 HB2 ARG 91 2HB ARG 91 -21.264 17.041 -6.399 551 HB3 ARG 91 3HB ARG 91 -22.827 16.489 -7.011 552 HG2 ARG 91 2HG ARG 91 -21.942 16.615 -4.104 553 HG3 ARG 91 3HG ARG 91 -23.125 17.652 -4.901 554 HD2 ARG 91 2HD ARG 91 -23.367 14.652 -4.450 555 HD3 ARG 91 3HD ARG 91 -24.149 15.887 -3.469 556 HE ARG 91 HE ARG 91 -25.012 14.891 -6.054 557 HH11 ARG 91 1HH1 ARG 91 -25.290 17.722 -3.957 558 HH12 ARG 91 2HH1 ARG 91 -26.742 18.264 -4.742 559 HH21 ARG 91 1HH2 ARG 91 -26.862 15.663 -7.039 560 HH22 ARG 91 2HH2 ARG 91 -27.625 17.105 -6.451 561 H ALA 92 H ALA 92 -19.372 15.666 -7.527 562 HA ALA 92 HA ALA 92 -20.025 15.399 -10.294 563 HB1 ALA 92 1HB ALA 92 -17.316 15.466 -8.900 564 HB2 ALA 92 2HB ALA 92 -17.567 15.607 -10.644 565 HB3 ALA 92 3HB ALA 92 -18.229 16.838 -9.559 566 H VAL 93 H VAL 93 -18.121 13.186 -8.208 567 HA VAL 93 HA VAL 93 -17.770 11.203 -10.206 568 HB VAL 93 HB VAL 93 -17.851 10.409 -7.296 569 HG11 VAL 93 1HG1 VAL 93 -15.871 9.776 -9.516 570 HG12 VAL 93 2HG1 VAL 93 -16.057 8.952 -7.945 571 HG13 VAL 93 3HG1 VAL 93 -17.305 8.788 -9.183 572 HG21 VAL 93 1HG2 VAL 93 -16.127 12.517 -8.425 573 HG22 VAL 93 2HG2 VAL 93 -16.478 12.068 -6.757 574 HG23 VAL 93 3HG2 VAL 93 -15.213 11.222 -7.665 575 H ALA 94 H ALA 94 -20.520 11.870 -8.240 576 HA ALA 94 HA ALA 94 -21.824 9.250 -8.617 577 HB1 ALA 94 1HB ALA 94 -22.169 10.543 -6.532 578 HB2 ALA 94 2HB ALA 94 -22.883 11.875 -7.463 579 HB3 ALA 94 3HB ALA 94 -23.692 10.304 -7.411 580 H GLN 95 H GLN 95 -21.301 11.973 -10.603 581 HA GLN 95 HA GLN 95 -23.678 11.286 -12.296 582 HB2 GLN 95 2HB GLN 95 -24.101 13.619 -12.694 583 HB3 GLN 95 3HB GLN 95 -24.105 13.284 -10.964 584 HG2 GLN 95 2HG GLN 95 -22.873 15.291 -11.039 585 HG3 GLN 95 3HG GLN 95 -21.670 14.100 -10.962 586 HE21 GLN 95 1HE2 GLN 95 -20.065 14.186 -12.571 587 HE22 GLN 95 2HE2 GLN 95 -20.227 15.249 -13.981 588 H VAL 96 H VAL 96 -20.247 11.731 -12.287 589 HA VAL 96 HA VAL 96 -19.744 12.328 -15.007 590 HB VAL 96 HB VAL 96 -17.689 10.910 -14.730 591 HG11 VAL 96 1HG1 VAL 96 -17.728 13.317 -14.198 592 HG12 VAL 96 2HG1 VAL 96 -18.023 12.912 -12.491 593 HG13 VAL 96 3HG1 VAL 96 -16.538 12.397 -13.248 594 HG21 VAL 96 1HG2 VAL 96 -18.231 9.209 -13.197 595 HG22 VAL 96 2HG2 VAL 96 -17.159 10.325 -12.316 596 HG23 VAL 96 3HG2 VAL 96 -18.888 10.361 -12.019 597 H ASN 97 H ASN 97 -19.480 11.160 -16.877 598 HA ASN 97 HA ASN 97 -21.317 9.042 -17.330 599 HB2 ASN 97 2HB ASN 97 -20.386 9.043 -19.628 600 HB3 ASN 97 3HB ASN 97 -20.877 10.626 -19.048 601 HD21 ASN 97 1HD2 ASN 97 -17.994 8.579 -19.770 602 HD22 ASN 97 2HD2 ASN 97 -16.895 9.926 -19.874 603 H SER 98 H SER 98 -17.753 8.916 -17.120 604 HA SER 98 HA SER 98 -17.312 6.321 -16.239 605 HB2 SER 98 2HB SER 98 -16.612 5.233 -18.449 606 HB3 SER 98 3HB SER 98 -18.339 5.272 -18.119 607 HG SER 98 HG SER 98 -17.801 5.893 -20.285 608 H PHE 99 H PHE 99 -15.138 5.917 -16.024 609 HA PHE 99 HA PHE 99 -13.385 8.204 -16.612 610 HB2 PHE 99 2HB PHE 99 -12.835 5.712 -14.990 611 HB3 PHE 99 3HB PHE 99 -11.922 7.213 -14.973 612 HD1 PHE 99 HD1 PHE 99 -13.187 9.372 -14.198 613 HD2 PHE 99 HD2 PHE 99 -14.709 5.372 -13.549 614 HE1 PHE 99 HE1 PHE 99 -14.764 10.226 -12.492 615 HE2 PHE 99 HE2 PHE 99 -16.287 6.245 -11.886 616 HZ PHE 99 HZ PHE 99 -16.292 8.630 -11.314 617 HA PRO 100 HA PRO 100 -12.014 5.673 -20.077 618 HB2 PRO 100 2HB PRO 100 -10.561 7.492 -21.506 619 HB3 PRO 100 3HB PRO 100 -12.349 7.537 -21.416 620 HG2 PRO 100 2HG PRO 100 -10.357 9.158 -19.786 621 HG3 PRO 100 3HG PRO 100 -11.821 9.733 -20.645 622 HD2 PRO 100 2HD PRO 100 -11.828 9.159 -17.965 623 HD3 PRO 100 3HD PRO 100 -13.254 8.862 -19.017 624 H LEU 101 H LEU 101 -10.366 4.246 -20.124 625 HA LEU 101 HA LEU 101 -8.258 4.562 -18.167 626 HB2 LEU 101 2HB LEU 101 -8.575 2.203 -20.027 627 HB3 LEU 101 3HB LEU 101 -7.868 2.263 -18.415 628 HG LEU 101 HG LEU 101 -10.802 2.448 -19.148 629 HD11 LEU 101 1HD1 LEU 101 -9.836 0.199 -19.293 630 HD12 LEU 101 2HD1 LEU 101 -10.984 0.307 -17.949 631 HD13 LEU 101 3HD1 LEU 101 -9.233 0.335 -17.628 632 HD21 LEU 101 1HD2 LEU 101 -10.305 3.888 -17.129 633 HD22 LEU 101 2HD2 LEU 101 -9.621 2.470 -16.347 634 HD23 LEU 101 3HD2 LEU 101 -11.332 2.494 -16.762 635 HA PRO 102 HA PRO 102 -4.922 5.405 -21.120 636 HB2 PRO 102 2HB PRO 102 -2.723 4.719 -19.654 637 HB3 PRO 102 3HB PRO 102 -3.719 6.156 -19.278 638 HG2 PRO 102 2HG PRO 102 -3.843 3.406 -17.998 639 HG3 PRO 102 3HG PRO 102 -3.764 5.001 -17.183 640 HD2 PRO 102 2HD PRO 102 -6.133 3.685 -17.607 641 HD3 PRO 102 3HD PRO 102 -6.007 5.477 -17.676 642 H LYS 103 H LYS 103 -5.236 2.279 -19.457 643 HA LYS 103 HA LYS 103 -4.732 0.825 -21.937 644 HB2 LYS 103 2HB LYS 103 -3.186 0.374 -19.377 645 HB3 LYS 103 3HB LYS 103 -3.481 -0.932 -20.504 646 HG2 LYS 103 2HG LYS 103 -1.478 -0.283 -21.350 647 HG3 LYS 103 3HG LYS 103 -2.497 0.817 -22.290 648 HD2 LYS 103 2HD LYS 103 -2.177 2.402 -20.190 649 HD3 LYS 103 3HD LYS 103 -0.782 1.389 -19.858 650 HE2 LYS 103 2HE LYS 103 -1.339 2.869 -22.466 651 HE3 LYS 103 3HE LYS 103 -0.302 3.476 -21.171 652 HZ1 LYS 103 HZ1 LYS 103 1.125 1.533 -21.460 653 HZ2 LYS 103 HZ2 LYS 103 1.033 2.387 -22.854 654 HZ3 LYS 103 HZ3 LYS 103 0.203 0.980 -22.703 655 H ASP 104 H ASP 104 -5.721 -1.284 -21.925 656 HA ASP 104 HA ASP 104 -8.125 -1.389 -20.178 657 HB2 ASP 104 2HB ASP 104 -8.320 -0.555 -22.533 658 HB3 ASP 104 3HB ASP 104 -7.788 -2.128 -23.112 659 H GLN 105 H GLN 105 -5.535 -3.004 -19.774 660 HA GLN 105 HA GLN 105 -6.339 -5.738 -20.509 661 HB2 GLN 105 2HB GLN 105 -3.898 -4.821 -18.944 662 HB3 GLN 105 3HB GLN 105 -4.277 -6.468 -19.429 663 HG2 GLN 105 2HG GLN 105 -2.760 -5.866 -21.047 664 HG3 GLN 105 3HG GLN 105 -4.288 -5.571 -21.877 665 HE21 GLN 105 1HE2 GLN 105 -4.582 -3.431 -22.692 666 HE22 GLN 105 2HE2 GLN 105 -3.467 -2.126 -22.311 667 HA PRO 106 HA PRO 106 -8.374 -6.416 -16.490 668 HB2 PRO 106 2HB PRO 106 -7.191 -9.169 -16.830 669 HB3 PRO 106 3HB PRO 106 -8.839 -8.709 -16.308 670 HG2 PRO 106 2HG PRO 106 -8.417 -9.528 -18.852 671 HG3 PRO 106 3HG PRO 106 -9.471 -8.108 -18.531 672 HD2 PRO 106 2HD PRO 106 -6.566 -8.150 -19.408 673 HD3 PRO 106 3HD PRO 106 -7.920 -7.137 -20.001 674 H ASP 107 H ASP 107 -4.983 -6.754 -17.070 675 HA ASP 107 HA ASP 107 -4.183 -7.355 -14.309 676 HB2 ASP 107 2HB ASP 107 -2.602 -6.489 -16.762 677 HB3 ASP 107 3HB ASP 107 -1.911 -6.998 -15.225 678 H VAL 108 H VAL 108 -4.711 -4.522 -16.321 679 HA VAL 108 HA VAL 108 -3.593 -2.709 -14.224 680 HB VAL 108 HB VAL 108 -3.502 -0.993 -15.837 681 HG11 VAL 108 1HG1 VAL 108 -1.814 -1.817 -17.413 682 HG12 VAL 108 2HG1 VAL 108 -1.571 -2.572 -15.821 683 HG13 VAL 108 3HG1 VAL 108 -2.336 -3.488 -17.137 684 HG21 VAL 108 1HG2 VAL 108 -4.049 -1.203 -18.171 685 HG22 VAL 108 2HG2 VAL 108 -4.664 -2.829 -17.933 686 HG23 VAL 108 3HG2 VAL 108 -5.488 -1.436 -17.184 687 H VAL 109 H VAL 109 -6.590 -3.537 -15.947 688 HA VAL 109 HA VAL 109 -8.285 -1.502 -15.024 689 HB VAL 109 HB VAL 109 -8.747 -4.466 -15.423 690 HG11 VAL 109 1HG1 VAL 109 -11.195 -3.992 -15.588 691 HG12 VAL 109 2HG1 VAL 109 -10.567 -3.834 -13.951 692 HG13 VAL 109 3HG1 VAL 109 -10.908 -2.377 -14.926 693 HG21 VAL 109 1HG2 VAL 109 -9.688 -2.068 -17.082 694 HG22 VAL 109 2HG2 VAL 109 -8.194 -2.944 -17.432 695 HG23 VAL 109 3HG2 VAL 109 -9.752 -3.782 -17.545 696 H GLU 110 H GLU 110 -6.727 -4.045 -13.234 697 HA GLU 110 HA GLU 110 -8.400 -3.926 -10.852 698 HB2 GLU 110 2HB GLU 110 -5.766 -5.208 -11.543 699 HB3 GLU 110 3HB GLU 110 -6.495 -5.392 -9.955 700 HG2 GLU 110 2HG GLU 110 -8.131 -6.061 -12.429 701 HG3 GLU 110 3HG GLU 110 -6.928 -7.182 -11.804 702 H LYS 111 H LYS 111 -5.892 -1.863 -12.017 703 HA LYS 111 HA LYS 111 -4.910 -1.186 -9.288 704 HB2 LYS 111 2HB LYS 111 -3.857 -0.725 -12.090 705 HB3 LYS 111 3HB LYS 111 -3.371 0.351 -10.782 706 HG2 LYS 111 2HG LYS 111 -1.765 -1.462 -11.137 707 HG3 LYS 111 3HG LYS 111 -2.407 -1.449 -9.490 708 HD2 LYS 111 2HD LYS 111 -3.797 -3.372 -9.931 709 HD3 LYS 111 3HD LYS 111 -3.525 -3.225 -11.681 710 HE2 LYS 111 2HE LYS 111 -1.059 -3.640 -11.232 711 HE3 LYS 111 3HE LYS 111 -1.489 -3.944 -9.532 712 HZ1 LYS 111 HZ1 LYS 111 -1.352 -6.005 -10.853 713 HZ2 LYS 111 HZ2 LYS 111 -2.534 -5.479 -11.860 714 HZ3 LYS 111 HZ3 LYS 111 -2.863 -5.793 -10.279 715 H LEU 112 H LEU 112 -6.345 0.254 -12.158 716 HA LEU 112 HA LEU 112 -6.553 2.925 -11.020 717 HB2 LEU 112 2HB LEU 112 -7.696 3.472 -13.195 718 HB3 LEU 112 3HB LEU 112 -6.102 2.812 -13.262 719 HG LEU 112 HG LEU 112 -7.037 0.660 -13.749 720 HD11 LEU 112 1HD1 LEU 112 -9.270 0.427 -14.815 721 HD12 LEU 112 2HD1 LEU 112 -9.673 1.995 -14.130 722 HD13 LEU 112 3HD1 LEU 112 -9.260 0.637 -13.061 723 HD21 LEU 112 1HD2 LEU 112 -7.500 2.792 -15.798 724 HD22 LEU 112 2HD2 LEU 112 -7.394 1.046 -16.145 725 HD23 LEU 112 3HD2 LEU 112 -6.002 1.886 -15.483 726 H LYS 113 H LYS 113 -8.632 0.172 -10.915 727 HA LYS 113 HA LYS 113 -11.113 1.530 -10.529 728 HB2 LYS 113 2HB LYS 113 -11.829 -0.632 -9.531 729 HB3 LYS 113 3HB LYS 113 -11.060 -0.804 -11.116 730 HG2 LYS 113 2HG LYS 113 -9.043 -1.663 -10.171 731 HG3 LYS 113 3HG LYS 113 -9.428 -1.130 -8.550 732 HD2 LYS 113 2HD LYS 113 -9.623 -3.613 -9.043 733 HD3 LYS 113 3HD LYS 113 -10.956 -2.843 -8.169 734 HE2 LYS 113 2HE LYS 113 -12.316 -2.710 -10.159 735 HE3 LYS 113 3HE LYS 113 -10.984 -3.303 -11.178 736 HZ1 LYS 113 HZ1 LYS 113 -11.111 -5.422 -10.047 737 HZ2 LYS 113 HZ2 LYS 113 -12.587 -5.069 -10.635 738 HZ3 LYS 113 HZ3 LYS 113 -12.287 -4.902 -9.028 739 H ASN 114 H ASN 114 -8.475 1.073 -8.316 740 HA ASN 114 HA ASN 114 -10.162 2.131 -6.077 741 HB2 ASN 114 2HB ASN 114 -7.969 0.078 -5.718 742 HB3 ASN 114 3HB ASN 114 -9.089 0.721 -4.513 743 HD21 ASN 114 1HD2 ASN 114 -11.522 0.414 -6.295 744 HD22 ASN 114 2HD2 ASN 114 -11.810 -1.310 -6.257 745 H ILE 115 H ILE 115 -9.419 4.224 -6.638 746 HA ILE 115 HA ILE 115 -6.563 4.774 -6.016 747 HB ILE 115 HB ILE 115 -6.797 6.909 -7.123 748 HG12 ILE 115 2HG1 ILE 115 -9.292 7.103 -6.845 749 HG13 ILE 115 3HG1 ILE 115 -8.598 7.651 -8.347 750 HG21 ILE 115 1HG2 ILE 115 -6.789 6.015 -9.431 751 HG22 ILE 115 2HG2 ILE 115 -5.767 5.118 -8.309 752 HG23 ILE 115 3HG2 ILE 115 -7.325 4.445 -8.799 753 HD11 ILE 115 1HD1 ILE 115 -10.638 6.526 -8.835 754 HD12 ILE 115 2HD1 ILE 115 -9.316 5.564 -9.473 755 HD13 ILE 115 3HD1 ILE 115 -10.120 5.061 -7.983 756 H ASN 116 H ASN 116 -5.993 6.589 -4.819 757 HA ASN 116 HA ASN 116 -8.205 7.821 -3.253 758 HB2 ASN 116 2HB ASN 116 -5.280 7.841 -2.489 759 HB3 ASN 116 3HB ASN 116 -6.645 8.570 -1.623 760 HD21 ASN 116 1HD2 ASN 116 -7.960 5.647 -2.519 761 HD22 ASN 116 2HD2 ASN 116 -7.462 4.725 -1.103 762 H LEU 117 H LEU 117 -8.651 9.814 -3.836 763 HA LEU 117 HA LEU 117 -6.787 11.409 -5.562 764 HB2 LEU 117 2HB LEU 117 -9.610 12.059 -4.629 765 HB3 LEU 117 3HB LEU 117 -8.594 13.057 -5.668 766 HG LEU 117 HG LEU 117 -9.738 10.299 -6.335 767 HD11 LEU 117 1HD1 LEU 117 -11.107 11.513 -7.977 768 HD12 LEU 117 2HD1 LEU 117 -10.402 13.063 -7.441 769 HD13 LEU 117 3HD1 LEU 117 -11.402 12.110 -6.331 770 HD21 LEU 117 1HD2 LEU 117 -7.969 12.128 -8.008 771 HD22 LEU 117 2HD2 LEU 117 -8.894 10.758 -8.664 772 HD23 LEU 117 3HD2 LEU 117 -7.607 10.473 -7.479 773 H THR 118 H THR 118 -5.267 12.387 -4.428 774 HA THR 118 HA THR 118 -5.904 13.629 -1.794 775 HB THR 118 HB THR 118 -3.419 12.018 -2.436 776 HG1 THR 118 HG1 THR 118 -4.312 10.639 -0.896 777 HG21 THR 118 1HG2 THR 118 -2.841 13.839 -0.949 778 HG22 THR 118 2HG2 THR 118 -3.056 12.398 0.066 779 HG23 THR 118 3HG2 THR 118 -4.339 13.628 -0.019 780 H VAL 119 H VAL 119 -5.430 15.670 -1.737 781 HA VAL 119 HA VAL 119 -3.489 16.895 -3.641 782 HB VAL 119 HB VAL 119 -5.006 18.618 -4.174 783 HG11 VAL 119 1HG1 VAL 119 -6.776 17.502 -5.396 784 HG12 VAL 119 2HG1 VAL 119 -5.333 16.489 -5.455 785 HG13 VAL 119 3HG1 VAL 119 -6.670 16.081 -4.348 786 HG21 VAL 119 1HG2 VAL 119 -7.296 18.825 -3.399 787 HG22 VAL 119 2HG2 VAL 119 -7.082 17.440 -2.305 788 HG23 VAL 119 3HG2 VAL 119 -6.195 18.962 -2.032 789 H ALA 120 H ALA 120 -2.509 18.848 -2.936 790 HA ALA 120 HA ALA 120 -3.011 20.056 -0.354 791 HB1 ALA 120 1HB ALA 120 -0.823 19.294 0.665 792 HB2 ALA 120 2HB ALA 120 -1.954 17.951 0.422 793 HB3 ALA 120 3HB ALA 120 -0.606 18.191 -0.705 794 HA PRO 121 HA PRO 121 -0.502 23.229 -2.313 795 HB2 PRO 121 2HB PRO 121 0.292 24.778 -0.215 796 HB3 PRO 121 3HB PRO 121 -1.417 24.668 -0.738 797 HG2 PRO 121 2HG PRO 121 -0.064 23.114 1.499 798 HG3 PRO 121 3HG PRO 121 -1.601 24.042 1.570 799 HD2 PRO 121 2HD PRO 121 -1.564 21.352 1.160 800 HD3 PRO 121 3HD PRO 121 -2.762 22.407 0.349 801 H GLU 122 H GLU 122 1.737 24.082 -2.392 802 HA GLU 122 HA GLU 122 3.728 21.991 -2.106 803 HB2 GLU 122 2HB GLU 122 3.961 24.929 -2.884 804 HB3 GLU 122 3HB GLU 122 5.291 23.763 -2.922 805 HG2 GLU 122 2HG GLU 122 3.994 22.351 -4.533 806 HG3 GLU 122 3HG GLU 122 2.705 23.568 -4.531 Start of MODEL 4 1 H1 ALA 22 H ALA 22 15.516 7.684 -20.673 2 HA ALA 22 HA ALA 22 13.785 5.344 -20.510 3 HB1 ALA 22 1HB ALA 22 16.451 5.178 -22.009 4 HB2 ALA 22 2HB ALA 22 15.482 3.787 -21.492 5 HB3 ALA 22 3HB ALA 22 14.835 4.902 -22.701 6 H ALA 23 H ALA 23 14.119 4.415 -18.580 7 HA ALA 23 HA ALA 23 16.534 4.679 -16.966 8 HB1 ALA 23 1HB ALA 23 15.688 7.028 -16.967 9 HB2 ALA 23 2HB ALA 23 14.133 6.478 -16.338 10 HB3 ALA 23 3HB ALA 23 15.604 6.295 -15.350 11 H ARG 24 H ARG 24 13.020 4.670 -16.223 12 HA ARG 24 HA ARG 24 11.609 3.154 -15.415 13 HB2 ARG 24 2HB ARG 24 13.664 0.996 -16.006 14 HB3 ARG 24 3HB ARG 24 11.958 0.752 -15.698 15 HG2 ARG 24 2HG ARG 24 13.120 2.270 -18.063 16 HG3 ARG 24 3HG ARG 24 12.488 0.619 -18.078 17 HD2 ARG 24 2HD ARG 24 10.239 1.483 -17.430 18 HD3 ARG 24 3HD ARG 24 10.877 3.134 -17.479 19 HE ARG 24 HE ARG 24 11.444 1.837 -19.953 20 HH11 ARG 24 1HH1 ARG 24 8.647 3.182 -18.241 21 HH12 ARG 24 2HH1 ARG 24 7.773 3.454 -19.717 22 HH21 ARG 24 1HH2 ARG 24 10.241 2.214 -21.815 23 HH22 ARG 24 2HH2 ARG 24 8.661 2.928 -21.702 24 H GLN 25 H GLN 25 13.910 4.277 -13.709 25 HA GLN 25 HA GLN 25 13.806 2.403 -11.395 26 HB2 GLN 25 2HB GLN 25 15.325 5.012 -11.584 27 HB3 GLN 25 3HB GLN 25 15.545 3.708 -10.437 28 HG2 GLN 25 2HG GLN 25 16.222 3.692 -13.403 29 HG3 GLN 25 3HG GLN 25 17.348 3.692 -12.064 30 HE21 GLN 25 1HE2 GLN 25 15.867 1.672 -14.341 31 HE22 GLN 25 2HE2 GLN 25 16.087 0.153 -13.473 32 H GLN 26 H GLN 26 12.346 5.315 -12.480 33 HA GLN 26 HA GLN 26 11.033 5.842 -9.854 34 HB2 GLN 26 2HB GLN 26 11.692 8.134 -9.950 35 HB3 GLN 26 3HB GLN 26 13.135 7.135 -10.069 36 HG2 GLN 26 2HG GLN 26 11.712 8.506 -12.406 37 HG3 GLN 26 3HG GLN 26 13.149 9.114 -11.582 38 HE21 GLN 26 1HE2 GLN 26 15.192 7.822 -11.775 39 HE22 GLN 26 2HE2 GLN 26 15.390 6.810 -13.183 40 H PHE 27 H PHE 27 10.813 5.937 -13.326 41 HA PHE 27 HA PHE 27 9.043 7.937 -13.799 42 HB2 PHE 27 2HB PHE 27 8.956 7.166 -15.913 43 HB3 PHE 27 3HB PHE 27 10.389 6.304 -15.362 44 HD1 PHE 27 HD1 PHE 27 9.906 3.887 -14.346 45 HD2 PHE 27 HD2 PHE 27 7.136 6.031 -16.817 46 HE1 PHE 27 HE1 PHE 27 8.723 1.757 -14.836 47 HE2 PHE 27 HE2 PHE 27 5.900 3.921 -17.281 48 HZ PHE 27 HZ PHE 27 6.718 1.773 -16.312 49 H VAL 28 H VAL 28 8.121 5.056 -12.207 50 HA VAL 28 HA VAL 28 5.428 4.666 -13.050 51 HB VAL 28 HB VAL 28 5.068 3.696 -10.740 52 HG11 VAL 28 1HG1 VAL 28 7.473 2.653 -12.296 53 HG12 VAL 28 2HG1 VAL 28 6.443 1.709 -11.204 54 HG13 VAL 28 3HG1 VAL 28 5.773 2.357 -12.707 55 HG21 VAL 28 1HG2 VAL 28 8.052 4.204 -10.346 56 HG22 VAL 28 2HG2 VAL 28 6.738 5.002 -9.451 57 HG23 VAL 28 3HG2 VAL 28 6.982 3.257 -9.296 58 H THR 29 H THR 29 6.777 7.026 -10.815 59 HA THR 29 HA THR 29 4.385 8.057 -9.683 60 HB THR 29 HB THR 29 6.706 8.536 -8.986 61 HG1 THR 29 HG1 THR 29 6.161 10.664 -8.387 62 HG21 THR 29 1HG2 THR 29 8.033 10.259 -10.030 63 HG22 THR 29 2HG2 THR 29 6.726 10.688 -11.148 64 HG23 THR 29 3HG2 THR 29 7.584 9.146 -11.332 65 H SER 30 H SER 30 5.756 8.577 -12.911 66 HA SER 30 HA SER 30 3.757 10.649 -13.547 67 HB2 SER 30 2HB SER 30 5.756 9.184 -15.322 68 HB3 SER 30 3HB SER 30 4.693 10.511 -15.818 69 HG SER 30 HG SER 30 6.717 10.683 -13.810 70 H GLU 31 H GLU 31 4.006 7.124 -13.952 71 HA GLU 31 HA GLU 31 1.583 6.979 -15.565 72 HB2 GLU 31 2HB GLU 31 3.038 4.960 -13.834 73 HB3 GLU 31 3HB GLU 31 1.485 4.591 -14.576 74 HG2 GLU 31 2HG GLU 31 3.849 5.566 -16.210 75 HG3 GLU 31 3HG GLU 31 3.596 3.862 -15.830 76 H VAL 32 H VAL 32 2.241 7.193 -12.043 77 HA VAL 32 HA VAL 32 -0.552 6.831 -11.297 78 HB VAL 32 HB VAL 32 1.774 8.136 -9.839 79 HG11 VAL 32 1HG1 VAL 32 -1.064 7.667 -8.792 80 HG12 VAL 32 2HG1 VAL 32 0.348 8.072 -7.793 81 HG13 VAL 32 3HG1 VAL 32 -0.237 9.241 -8.973 82 HG21 VAL 32 1HG2 VAL 32 1.638 6.134 -8.433 83 HG22 VAL 32 2HG2 VAL 32 0.245 5.546 -9.369 84 HG23 VAL 32 3HG2 VAL 32 1.843 5.656 -10.125 85 H GLY 33 H GLY 33 1.328 9.457 -12.543 86 HA2 GLY 33 HA2 GLY 33 -0.659 11.576 -12.255 87 HA3 GLY 33 HA3 GLY 33 0.854 11.623 -13.199 88 H ARG 34 H ARG 34 -0.650 8.842 -14.225 89 HA ARG 34 HA ARG 34 -2.586 10.197 -16.081 90 HB2 ARG 34 2HB ARG 34 -1.246 7.507 -16.436 91 HB3 ARG 34 3HB ARG 34 -2.429 8.271 -17.510 92 HG2 ARG 34 2HG ARG 34 -0.760 10.197 -17.786 93 HG3 ARG 34 3HG ARG 34 0.408 9.196 -16.912 94 HD2 ARG 34 2HD ARG 34 -0.010 7.382 -18.669 95 HD3 ARG 34 3HD ARG 34 -0.883 8.614 -19.591 96 HE ARG 34 HE ARG 34 1.943 9.046 -18.688 97 HH11 ARG 34 1HH1 ARG 34 -0.238 8.818 -21.508 98 HH12 ARG 34 2HH1 ARG 34 1.026 9.319 -22.591 99 HH21 ARG 34 1HH2 ARG 34 3.422 9.689 -20.109 100 HH22 ARG 34 2HH2 ARG 34 3.087 9.765 -21.827 101 H TYR 35 H TYR 35 -2.056 7.112 -14.372 102 HA TYR 35 HA TYR 35 -4.541 5.924 -14.606 103 HB2 TYR 35 2HB TYR 35 -2.290 5.788 -12.595 104 HB3 TYR 35 3HB TYR 35 -3.793 4.966 -12.227 105 HD1 TYR 35 HD1 TYR 35 -1.397 5.281 -15.151 106 HD2 TYR 35 HD2 TYR 35 -4.061 2.804 -12.869 107 HE1 TYR 35 HE1 TYR 35 -0.815 3.362 -16.595 108 HE2 TYR 35 HE2 TYR 35 -3.651 0.926 -14.400 109 HH TYR 35 HH TYR 35 -2.395 0.181 -16.235 110 H GLY 36 H GLY 36 -3.597 7.980 -11.859 111 HA2 GLY 36 HA2 GLY 36 -6.343 8.124 -10.820 112 HA3 GLY 36 HA3 GLY 36 -4.901 8.921 -10.175 113 H ALA 37 H ALA 37 -4.547 9.897 -13.195 114 HA ALA 37 HA ALA 37 -5.766 12.461 -12.684 115 HB1 ALA 37 1HB ALA 37 -4.187 11.534 -15.100 116 HB2 ALA 37 2HB ALA 37 -4.649 13.191 -14.697 117 HB3 ALA 37 3HB ALA 37 -3.527 12.316 -13.640 118 H ILE 38 H ILE 38 -6.414 9.643 -14.773 119 HA ILE 38 HA ILE 38 -8.348 10.876 -16.476 120 HB ILE 38 HB ILE 38 -9.046 8.670 -17.075 121 HG12 ILE 38 2HG1 ILE 38 -7.994 7.829 -14.366 122 HG13 ILE 38 3HG1 ILE 38 -9.611 7.641 -15.031 123 HG21 ILE 38 1HG2 ILE 38 -6.156 8.108 -16.358 124 HG22 ILE 38 2HG2 ILE 38 -7.045 7.699 -17.820 125 HG23 ILE 38 3HG2 ILE 38 -6.570 9.376 -17.545 126 HD11 ILE 38 1HD1 ILE 38 -8.656 5.483 -14.983 127 HD12 ILE 38 2HD1 ILE 38 -8.645 5.973 -16.673 128 HD13 ILE 38 3HD1 ILE 38 -7.146 6.039 -15.698 129 H TYR 39 H TYR 39 -8.589 9.833 -13.208 130 HA TYR 39 HA TYR 39 -11.512 10.081 -13.085 131 HB2 TYR 39 2HB TYR 39 -9.498 9.748 -10.824 132 HB3 TYR 39 3HB TYR 39 -11.240 9.611 -10.700 133 HD1 TYR 39 HD1 TYR 39 -8.181 7.827 -11.657 134 HD2 TYR 39 HD2 TYR 39 -12.469 7.755 -11.776 135 HE1 TYR 39 HE1 TYR 39 -8.083 5.410 -12.438 136 HE2 TYR 39 HE2 TYR 39 -12.381 5.463 -12.732 137 HH TYR 39 HH TYR 39 -11.134 3.761 -13.434 138 H THR 40 H THR 40 -8.717 11.809 -11.640 139 HA THR 40 HA THR 40 -10.269 13.831 -10.379 140 HB THR 40 HB THR 40 -7.840 13.001 -9.985 141 HG1 THR 40 HG1 THR 40 -7.484 14.976 -8.911 142 HG21 THR 40 1HG2 THR 40 -7.107 13.884 -12.298 143 HG22 THR 40 2HG2 THR 40 -6.050 14.159 -10.918 144 HG23 THR 40 3HG2 THR 40 -7.085 15.480 -11.553 145 H GLN 41 H GLN 41 -8.843 13.758 -13.620 146 HA GLN 41 HA GLN 41 -9.331 16.553 -14.209 147 HB2 GLN 41 2HB GLN 41 -8.778 14.106 -15.938 148 HB3 GLN 41 3HB GLN 41 -8.937 15.746 -16.587 149 HG2 GLN 41 2HG GLN 41 -6.828 14.853 -14.574 150 HG3 GLN 41 3HG GLN 41 -6.568 15.101 -16.294 151 HE21 GLN 41 1HE2 GLN 41 -5.167 16.438 -14.064 152 HE22 GLN 41 2HE2 GLN 41 -5.534 18.146 -14.232 153 H LEU 42 H LEU 42 -11.142 13.490 -14.800 154 HA LEU 42 HA LEU 42 -13.241 14.804 -16.281 155 HB2 LEU 42 2HB LEU 42 -12.693 12.336 -16.312 156 HB3 LEU 42 3HB LEU 42 -13.364 12.253 -14.666 157 HG LEU 42 HG LEU 42 -15.571 12.952 -15.524 158 HD11 LEU 42 1HD1 LEU 42 -14.960 14.296 -17.498 159 HD12 LEU 42 2HD1 LEU 42 -15.986 12.949 -18.000 160 HD13 LEU 42 3HD1 LEU 42 -14.234 12.874 -18.279 161 HD21 LEU 42 1HD2 LEU 42 -16.087 10.903 -16.826 162 HD22 LEU 42 2HD2 LEU 42 -15.161 10.599 -15.356 163 HD23 LEU 42 3HD2 LEU 42 -14.340 10.561 -16.938 164 H ILE 43 H ILE 43 -12.721 14.230 -12.817 165 HA ILE 43 HA ILE 43 -15.307 15.147 -11.963 166 HB ILE 43 HB ILE 43 -12.642 14.577 -10.667 167 HG12 ILE 43 2HG1 ILE 43 -14.171 13.256 -9.193 168 HG13 ILE 43 3HG1 ILE 43 -15.548 13.840 -10.161 169 HG21 ILE 43 1HG2 ILE 43 -13.239 16.697 -9.550 170 HG22 ILE 43 2HG2 ILE 43 -14.895 16.100 -9.292 171 HG23 ILE 43 3HG2 ILE 43 -13.509 15.330 -8.485 172 HD11 ILE 43 1HD1 ILE 43 -14.477 12.654 -12.152 173 HD12 ILE 43 2HD1 ILE 43 -13.332 11.942 -10.970 174 HD13 ILE 43 3HD1 ILE 43 -15.068 11.626 -10.852 175 H ARG 44 H ARG 44 -12.181 16.870 -12.118 176 HA ARG 44 HA ARG 44 -13.328 19.358 -11.218 177 HB2 ARG 44 2HB ARG 44 -11.235 20.323 -11.492 178 HB3 ARG 44 3HB ARG 44 -10.985 18.649 -11.008 179 HG2 ARG 44 2HG ARG 44 -9.342 18.925 -12.579 180 HG3 ARG 44 3HG ARG 44 -10.626 18.163 -13.507 181 HD2 ARG 44 2HD ARG 44 -11.239 20.366 -14.478 182 HD3 ARG 44 3HD ARG 44 -10.031 21.157 -13.453 183 HE ARG 44 HE ARG 44 -8.778 19.103 -15.004 184 HH11 ARG 44 1HH1 ARG 44 -10.146 22.339 -15.538 185 HH12 ARG 44 2HH1 ARG 44 -9.131 22.600 -16.929 186 HH21 ARG 44 1HH2 ARG 44 -7.556 19.486 -16.683 187 HH22 ARG 44 2HH2 ARG 44 -7.667 20.976 -17.607 188 H GLN 45 H GLN 45 -13.306 17.892 -14.351 189 HA GLN 45 HA GLN 45 -13.888 20.176 -16.046 190 HB2 GLN 45 2HB GLN 45 -14.967 17.335 -16.041 191 HB3 GLN 45 3HB GLN 45 -15.370 18.509 -17.291 192 HG2 GLN 45 2HG GLN 45 -12.461 18.172 -16.772 193 HG3 GLN 45 3HG GLN 45 -13.302 16.739 -17.374 194 HE21 GLN 45 1HE2 GLN 45 -12.753 16.597 -19.564 195 HE22 GLN 45 2HE2 GLN 45 -12.891 17.948 -20.668 196 H ASN 46 H ASN 46 -15.903 18.360 -13.706 197 HA ASN 46 HA ASN 46 -18.344 19.818 -14.476 198 HB2 ASN 46 2HB ASN 46 -17.748 18.247 -11.948 199 HB3 ASN 46 3HB ASN 46 -19.340 18.742 -12.529 200 HD21 ASN 46 1HD2 ASN 46 -16.961 16.309 -12.600 201 HD22 ASN 46 2HD2 ASN 46 -17.786 15.304 -13.796 202 H LEU 47 H LEU 47 -15.791 20.277 -12.052 203 HA LEU 47 HA LEU 47 -17.484 22.010 -10.388 204 HB2 LEU 47 2HB LEU 47 -14.779 20.710 -9.919 205 HB3 LEU 47 3HB LEU 47 -15.802 21.540 -8.756 206 HG LEU 47 HG LEU 47 -16.552 18.997 -10.092 207 HD11 LEU 47 1HD1 LEU 47 -14.614 18.817 -8.690 208 HD12 LEU 47 2HD1 LEU 47 -15.999 18.025 -7.897 209 HD13 LEU 47 3HD1 LEU 47 -15.452 19.639 -7.354 210 HD21 LEU 47 1HD2 LEU 47 -18.269 18.906 -8.215 211 HD22 LEU 47 2HD2 LEU 47 -18.599 20.129 -9.455 212 HD23 LEU 47 3HD2 LEU 47 -17.903 20.610 -7.899 213 H LEU 48 H LEU 48 -17.446 23.967 -10.868 214 HA LEU 48 HA LEU 48 -15.025 25.330 -11.846 215 HB2 LEU 48 2HB LEU 48 -16.645 27.102 -12.601 216 HB3 LEU 48 3HB LEU 48 -16.823 25.518 -13.322 217 HG LEU 48 HG LEU 48 -18.772 25.031 -11.963 218 HD11 LEU 48 1HD1 LEU 48 -18.375 26.308 -9.909 219 HD12 LEU 48 2HD1 LEU 48 -19.911 26.809 -10.634 220 HD13 LEU 48 3HD1 LEU 48 -18.479 27.843 -10.807 221 HD21 LEU 48 1HD2 LEU 48 -18.916 27.724 -13.380 222 HD22 LEU 48 2HD2 LEU 48 -20.298 26.650 -13.050 223 HD23 LEU 48 3HD2 LEU 48 -19.006 26.133 -14.153 224 H VAL 49 H VAL 49 -15.322 24.733 -9.055 225 HA VAL 49 HA VAL 49 -16.098 27.210 -7.725 226 HB VAL 49 HB VAL 49 -14.872 24.854 -6.316 227 HG11 VAL 49 1HG1 VAL 49 -16.195 25.731 -4.393 228 HG12 VAL 49 2HG1 VAL 49 -14.994 26.899 -4.970 229 HG13 VAL 49 3HG1 VAL 49 -16.705 27.101 -5.396 230 HG21 VAL 49 1HG2 VAL 49 -16.801 24.004 -7.579 231 HG22 VAL 49 2HG2 VAL 49 -17.205 24.100 -5.870 232 HG23 VAL 49 3HG2 VAL 49 -17.810 25.349 -6.980 233 H GLU 50 H GLU 50 -13.045 25.381 -7.481 234 HA GLU 50 HA GLU 50 -10.890 25.924 -7.590 235 HB2 GLU 50 2HB GLU 50 -11.675 28.708 -8.542 236 HB3 GLU 50 3HB GLU 50 -10.104 27.921 -8.684 237 HG2 GLU 50 2HG GLU 50 -11.161 26.145 -10.109 238 HG3 GLU 50 3HG GLU 50 -12.678 27.054 -10.071 239 H ASP 51 H ASP 51 -12.455 28.907 -6.245 240 HA ASP 51 HA ASP 51 -10.222 29.576 -4.543 241 HB2 ASP 51 2HB ASP 51 -11.988 31.133 -5.376 242 HB3 ASP 51 3HB ASP 51 -13.167 30.327 -4.333 243 H SER 52 H SER 52 -12.990 27.462 -4.061 244 HA SER 52 HA SER 52 -12.248 26.961 -1.208 245 HB2 SER 52 2HB SER 52 -14.617 25.924 -2.788 246 HB3 SER 52 3HB SER 52 -14.304 25.684 -1.071 247 HG SER 52 HG SER 52 -14.637 28.244 -2.284 248 H PHE 53 H PHE 53 -11.040 25.833 -4.072 249 HA PHE 53 HA PHE 53 -10.637 23.039 -3.115 250 HB2 PHE 53 2HB PHE 53 -10.194 24.313 -5.831 251 HB3 PHE 53 3HB PHE 53 -9.896 22.632 -5.412 252 HD1 PHE 53 HD1 PHE 53 -11.590 23.395 -7.723 253 HD2 PHE 53 HD2 PHE 53 -12.695 22.743 -3.589 254 HE1 PHE 53 HE1 PHE 53 -13.796 22.589 -8.418 255 HE2 PHE 53 HE2 PHE 53 -14.901 22.014 -4.276 256 HZ PHE 53 HZ PHE 53 -15.465 21.854 -6.700 257 H ARG 54 H ARG 54 -9.142 26.113 -3.566 258 HA ARG 54 HA ARG 54 -6.366 25.083 -3.488 259 HB2 ARG 54 2HB ARG 54 -7.550 27.804 -4.093 260 HB3 ARG 54 3HB ARG 54 -5.814 27.441 -4.068 261 HG2 ARG 54 2HG ARG 54 -6.060 25.769 -5.836 262 HG3 ARG 54 3HG ARG 54 -7.795 25.982 -5.886 263 HD2 ARG 54 2HD ARG 54 -5.812 28.216 -6.460 264 HD3 ARG 54 3HD ARG 54 -6.601 27.221 -7.706 265 HE ARG 54 HE ARG 54 -8.673 28.116 -6.128 266 HH11 ARG 54 1HH1 ARG 54 -6.204 29.774 -8.050 267 HH12 ARG 54 2HH1 ARG 54 -7.218 31.154 -8.349 268 HH21 ARG 54 1HH2 ARG 54 -9.942 29.957 -6.567 269 HH22 ARG 54 2HH2 ARG 54 -9.289 31.257 -7.516 270 H GLY 55 H GLY 55 -4.808 26.033 -2.095 271 HA2 GLY 55 HA2 GLY 55 -3.939 27.015 -0.182 272 HA3 GLY 55 HA3 GLY 55 -5.544 27.672 0.195 273 H LYS 56 H LYS 56 -6.754 24.923 0.109 274 HA LYS 56 HA LYS 56 -5.830 23.853 2.734 275 HB2 LYS 56 2HB LYS 56 -8.120 22.946 2.931 276 HB3 LYS 56 3HB LYS 56 -8.065 24.685 2.803 277 HG2 LYS 56 2HG LYS 56 -9.919 23.930 1.561 278 HG3 LYS 56 3HG LYS 56 -8.751 24.556 0.407 279 HD2 LYS 56 2HD LYS 56 -8.150 22.385 -0.365 280 HD3 LYS 56 3HD LYS 56 -8.931 21.560 1.002 281 HE2 LYS 56 2HE LYS 56 -10.243 23.123 -1.226 282 HE3 LYS 56 3HE LYS 56 -10.142 21.353 -1.132 283 HZ1 LYS 56 HZ1 LYS 56 -11.652 21.359 0.711 284 HZ2 LYS 56 HZ2 LYS 56 -12.285 22.410 -0.407 285 HZ3 LYS 56 HZ3 LYS 56 -11.565 22.981 0.915 286 H GLN 57 H GLN 57 -6.733 21.345 2.747 287 HA GLN 57 HA GLN 57 -5.606 19.993 0.334 288 HB2 GLN 57 2HB GLN 57 -4.011 18.901 1.535 289 HB3 GLN 57 3HB GLN 57 -4.114 20.311 2.505 290 HG2 GLN 57 2HG GLN 57 -4.273 18.867 4.196 291 HG3 GLN 57 3HG GLN 57 -5.986 18.886 3.819 292 HE21 GLN 57 1HE2 GLN 57 -4.340 17.118 1.399 293 HE22 GLN 57 2HE2 GLN 57 -4.683 15.541 2.089 294 H CYS 58 H CYS 58 -6.354 17.758 0.063 295 HA CYS 58 HA CYS 58 -8.133 16.688 2.020 296 HB2 CYS 58 2HB CYS 58 -10.136 16.448 0.929 297 HB3 CYS 58 3HB CYS 58 -9.668 18.034 0.322 298 HG CYS 58 HG CYS 58 -8.782 17.224 -1.977 299 H ARG 59 H ARG 59 -8.503 14.439 1.810 300 HA ARG 59 HA ARG 59 -7.262 13.018 -0.439 301 HB2 ARG 59 2HB ARG 59 -6.566 11.166 1.054 302 HB3 ARG 59 3HB ARG 59 -5.584 12.611 1.128 303 HG2 ARG 59 2HG ARG 59 -7.718 12.484 3.203 304 HG3 ARG 59 3HG ARG 59 -6.520 11.195 3.301 305 HD2 ARG 59 2HD ARG 59 -5.868 14.147 3.132 306 HD3 ARG 59 3HD ARG 59 -6.038 13.253 4.653 307 HE ARG 59 HE ARG 59 -4.186 11.850 3.036 308 HH11 ARG 59 1HH1 ARG 59 -4.288 14.929 4.776 309 HH12 ARG 59 2HH1 ARG 59 -2.612 14.813 5.245 310 HH21 ARG 59 1HH2 ARG 59 -2.002 11.827 3.569 311 HH22 ARG 59 2HH2 ARG 59 -1.330 13.105 4.527 312 H VAL 60 H VAL 60 -8.762 11.773 -1.378 313 HA VAL 60 HA VAL 60 -10.817 10.418 0.288 314 HB VAL 60 HB VAL 60 -12.644 11.026 -1.177 315 HG11 VAL 60 1HG1 VAL 60 -11.223 13.594 -0.328 316 HG12 VAL 60 2HG1 VAL 60 -12.964 13.353 -0.563 317 HG13 VAL 60 3HG1 VAL 60 -12.109 12.548 0.776 318 HG21 VAL 60 1HG2 VAL 60 -12.467 12.696 -2.943 319 HG22 VAL 60 2HG2 VAL 60 -10.708 12.807 -2.706 320 HG23 VAL 60 3HG2 VAL 60 -11.439 11.290 -3.295 321 H ASN 61 H ASN 61 -11.912 8.661 -1.095 322 HA ASN 61 HA ASN 61 -10.013 7.662 -3.114 323 HB2 ASN 61 2HB ASN 61 -9.326 6.691 -1.030 324 HB3 ASN 61 3HB ASN 61 -10.964 6.280 -0.579 325 HD21 ASN 61 1HD2 ASN 61 -12.098 4.631 -1.994 326 HD22 ASN 61 2HD2 ASN 61 -11.107 3.392 -2.730 327 H LEU 62 H LEU 62 -10.819 6.716 -4.832 328 HA LEU 62 HA LEU 62 -13.807 6.415 -5.037 329 HB2 LEU 62 2HB LEU 62 -11.574 7.116 -6.929 330 HB3 LEU 62 3HB LEU 62 -13.005 6.318 -7.567 331 HG LEU 62 HG LEU 62 -14.423 8.146 -6.827 332 HD11 LEU 62 1HD1 LEU 62 -13.274 8.990 -4.822 333 HD12 LEU 62 2HD1 LEU 62 -13.383 10.299 -5.994 334 HD13 LEU 62 3HD1 LEU 62 -11.847 9.436 -5.769 335 HD21 LEU 62 1HD2 LEU 62 -13.483 9.883 -8.395 336 HD22 LEU 62 2HD2 LEU 62 -13.374 8.244 -9.050 337 HD23 LEU 62 3HD2 LEU 62 -11.937 9.031 -8.360 338 H LYS 63 H LYS 63 -14.669 4.481 -5.287 339 HA LYS 63 HA LYS 63 -12.996 2.149 -6.149 340 HB2 LYS 63 2HB LYS 63 -15.405 2.289 -4.288 341 HB3 LYS 63 3HB LYS 63 -14.738 0.785 -4.953 342 HG2 LYS 63 2HG LYS 63 -12.572 1.214 -3.892 343 HG3 LYS 63 3HG LYS 63 -13.152 2.759 -3.259 344 HD2 LYS 63 2HD LYS 63 -14.387 0.076 -2.517 345 HD3 LYS 63 3HD LYS 63 -13.113 0.869 -1.587 346 HE2 LYS 63 2HE LYS 63 -14.552 2.882 -1.280 347 HE3 LYS 63 3HE LYS 63 -15.852 2.071 -2.160 348 HZ1 LYS 63 HZ1 LYS 63 -15.890 0.377 -0.419 349 HZ2 LYS 63 HZ2 LYS 63 -16.095 1.859 0.257 350 HZ3 LYS 63 HZ3 LYS 63 -14.659 1.102 0.377 351 H LEU 64 H LEU 64 -13.339 1.994 -8.358 352 HA LEU 64 HA LEU 64 -16.093 2.469 -9.353 353 HB2 LEU 64 2HB LEU 64 -13.559 2.085 -10.977 354 HB3 LEU 64 3HB LEU 64 -15.124 2.646 -11.523 355 HG LEU 64 HG LEU 64 -13.962 4.539 -11.586 356 HD11 LEU 64 1HD1 LEU 64 -14.623 6.081 -9.825 357 HD12 LEU 64 2HD1 LEU 64 -15.069 4.739 -8.767 358 HD13 LEU 64 3HD1 LEU 64 -15.930 4.997 -10.306 359 HD21 LEU 64 1HD2 LEU 64 -12.570 3.946 -8.964 360 HD22 LEU 64 2HD2 LEU 64 -12.315 5.336 -10.030 361 HD23 LEU 64 3HD2 LEU 64 -11.910 3.710 -10.614 362 H ILE 65 H ILE 65 -16.969 1.119 -10.945 363 HA ILE 65 HA ILE 65 -16.213 -1.780 -10.792 364 HB ILE 65 HB ILE 65 -18.454 -2.100 -11.943 365 HG12 ILE 65 2HG1 ILE 65 -19.198 0.596 -10.734 366 HG13 ILE 65 3HG1 ILE 65 -18.734 0.438 -12.436 367 HG21 ILE 65 1HG2 ILE 65 -19.626 -2.118 -9.755 368 HG22 ILE 65 2HG2 ILE 65 -17.974 -2.711 -9.604 369 HG23 ILE 65 3HG2 ILE 65 -18.382 -1.061 -9.072 370 HD11 ILE 65 1HD1 ILE 65 -20.559 -1.180 -12.795 371 HD12 ILE 65 2HD1 ILE 65 -21.088 -0.927 -11.115 372 HD13 ILE 65 3HD1 ILE 65 -21.107 0.423 -12.269 373 HA PRO 66 HA PRO 66 -14.693 -1.105 -14.987 374 HB2 PRO 66 2HB PRO 66 -14.072 -3.667 -15.694 375 HB3 PRO 66 3HB PRO 66 -13.097 -2.698 -14.561 376 HG2 PRO 66 2HG PRO 66 -15.180 -4.794 -13.904 377 HG3 PRO 66 3HG PRO 66 -13.550 -4.596 -13.199 378 HD2 PRO 66 2HD PRO 66 -15.836 -3.644 -11.995 379 HD3 PRO 66 3HD PRO 66 -14.259 -2.810 -11.841 380 H THR 67 H THR 67 -16.156 -0.579 -16.482 381 HA THR 67 HA THR 67 -18.641 -2.214 -16.847 382 HB THR 67 HB THR 67 -17.995 0.728 -17.291 383 HG1 THR 67 HG1 THR 67 -18.321 -0.102 -15.155 384 HG21 THR 67 1HG2 THR 67 -20.440 1.013 -17.683 385 HG22 THR 67 2HG2 THR 67 -20.601 -0.759 -17.797 386 HG23 THR 67 3HG2 THR 67 -19.631 0.141 -18.992 387 H GLY 68 H GLY 68 -15.885 -0.889 -18.614 388 HA2 GLY 68 HA2 GLY 68 -15.850 -2.708 -20.714 389 HA3 GLY 68 HA3 GLY 68 -16.923 -1.443 -21.271 390 H THR 69 H THR 69 -15.967 0.178 -22.341 391 HA THR 69 HA THR 69 -13.190 0.665 -22.678 392 HB THR 69 HB THR 69 -15.473 2.675 -22.952 393 HG1 THR 69 HG1 THR 69 -14.542 0.698 -24.784 394 HG21 THR 69 1HG2 THR 69 -12.807 2.376 -24.412 395 HG22 THR 69 2HG2 THR 69 -13.308 3.727 -23.363 396 HG23 THR 69 3HG2 THR 69 -14.123 3.459 -24.916 397 H GLY 70 H GLY 70 -15.346 1.700 -20.108 398 HA2 GLY 70 HA2 GLY 70 -13.025 2.888 -18.690 399 HA3 GLY 70 HA3 GLY 70 -14.511 3.826 -18.825 400 H ALA 71 H ALA 71 -13.759 3.525 -16.400 401 HA ALA 71 HA ALA 71 -15.341 1.350 -15.137 402 HB1 ALA 71 1HB ALA 71 -12.913 1.921 -14.473 403 HB2 ALA 71 2HB ALA 71 -13.605 3.347 -13.676 404 HB3 ALA 71 3HB ALA 71 -14.100 1.710 -13.194 405 H LEU 72 H LEU 72 -16.801 1.981 -13.344 406 HA LEU 72 HA LEU 72 -18.078 4.686 -13.578 407 HB2 LEU 72 2HB LEU 72 -19.164 2.092 -14.294 408 HB3 LEU 72 3HB LEU 72 -19.977 2.609 -12.842 409 HG LEU 72 HG LEU 72 -20.674 4.720 -13.941 410 HD11 LEU 72 1HD1 LEU 72 -18.900 5.107 -15.508 411 HD12 LEU 72 2HD1 LEU 72 -20.377 4.844 -16.456 412 HD13 LEU 72 3HD1 LEU 72 -19.160 3.550 -16.320 413 HD21 LEU 72 1HD2 LEU 72 -22.303 3.697 -15.476 414 HD22 LEU 72 2HD2 LEU 72 -22.115 2.701 -14.035 415 HD23 LEU 72 3HD2 LEU 72 -21.332 2.215 -15.552 416 H LEU 73 H LEU 73 -18.895 5.582 -11.656 417 HA LEU 73 HA LEU 73 -17.663 4.807 -9.251 418 HB2 LEU 73 2HB LEU 73 -18.526 7.052 -9.918 419 HB3 LEU 73 3HB LEU 73 -20.148 6.527 -9.536 420 HG LEU 73 HG LEU 73 -18.927 7.956 -7.835 421 HD11 LEU 73 1HD1 LEU 73 -19.914 5.294 -6.745 422 HD12 LEU 73 2HD1 LEU 73 -20.927 6.686 -7.183 423 HD13 LEU 73 3HD1 LEU 73 -19.755 6.816 -5.860 424 HD21 LEU 73 1HD2 LEU 73 -17.253 7.025 -6.396 425 HD22 LEU 73 2HD2 LEU 73 -16.714 6.742 -8.063 426 HD23 LEU 73 3HD2 LEU 73 -17.417 5.418 -7.121 427 H GLY 74 H GLY 74 -17.819 3.055 -8.195 428 HA2 GLY 74 HA2 GLY 74 -20.409 1.657 -7.721 429 HA3 GLY 74 HA3 GLY 74 -18.769 1.063 -7.370 430 H SER 75 H SER 75 -17.752 3.373 -5.986 431 HA SER 75 HA SER 75 -19.538 4.263 -3.879 432 HB2 SER 75 2HB SER 75 -17.614 1.986 -3.353 433 HB3 SER 75 3HB SER 75 -17.914 3.194 -2.095 434 HG SER 75 HG SER 75 -20.008 1.773 -3.397 435 H LEU 76 H LEU 76 -18.561 5.856 -2.535 436 HA LEU 76 HA LEU 76 -15.771 6.627 -3.183 437 HB2 LEU 76 2HB LEU 76 -17.499 7.973 -4.413 438 HB3 LEU 76 3HB LEU 76 -18.112 8.564 -2.881 439 HG LEU 76 HG LEU 76 -15.143 8.859 -3.432 440 HD11 LEU 76 1HD1 LEU 76 -17.332 10.461 -4.791 441 HD12 LEU 76 2HD1 LEU 76 -16.035 9.527 -5.560 442 HD13 LEU 76 3HD1 LEU 76 -15.636 11.007 -4.662 443 HD21 LEU 76 1HD2 LEU 76 -17.200 10.722 -2.165 444 HD22 LEU 76 2HD2 LEU 76 -15.446 10.993 -2.238 445 HD23 LEU 76 3HD2 LEU 76 -16.091 9.662 -1.276 446 H THR 77 H THR 77 -14.558 6.828 -1.489 447 HA THR 77 HA THR 77 -15.677 6.940 1.292 448 HB THR 77 HB THR 77 -13.000 5.993 0.184 449 HG1 THR 77 HG1 THR 77 -13.829 3.994 1.072 450 HG21 THR 77 1HG2 THR 77 -14.028 6.016 3.064 451 HG22 THR 77 2HG2 THR 77 -12.644 6.926 2.430 452 HG23 THR 77 3HG2 THR 77 -12.568 5.169 2.488 453 H VAL 78 H VAL 78 -15.227 8.794 2.462 454 HA VAL 78 HA VAL 78 -13.148 10.676 1.434 455 HB VAL 78 HB VAL 78 -13.932 12.288 3.097 456 HG11 VAL 78 1HG1 VAL 78 -15.977 12.969 1.874 457 HG12 VAL 78 2HG1 VAL 78 -14.714 12.432 0.769 458 HG13 VAL 78 3HG1 VAL 78 -16.082 11.351 1.142 459 HG21 VAL 78 1HG2 VAL 78 -16.163 12.076 4.132 460 HG22 VAL 78 2HG2 VAL 78 -16.275 10.402 3.559 461 HG23 VAL 78 3HG2 VAL 78 -15.031 10.861 4.750 462 H LEU 79 H LEU 79 -11.215 10.851 2.459 463 HA LEU 79 HA LEU 79 -10.804 9.125 4.876 464 HB2 LEU 79 2HB LEU 79 -8.747 10.263 2.958 465 HB3 LEU 79 3HB LEU 79 -8.440 9.166 4.278 466 HG LEU 79 HG LEU 79 -10.147 8.474 1.841 467 HD11 LEU 79 1HD1 LEU 79 -8.187 7.169 1.090 468 HD12 LEU 79 2HD1 LEU 79 -7.230 7.822 2.439 469 HD13 LEU 79 3HD1 LEU 79 -7.822 8.903 1.170 470 HD21 LEU 79 1HD2 LEU 79 -8.959 6.696 4.027 471 HD22 LEU 79 2HD2 LEU 79 -9.845 6.139 2.594 472 HD23 LEU 79 3HD2 LEU 79 -10.681 7.084 3.833 473 H ASP 80 H ASP 80 -10.076 12.363 3.527 474 HA ASP 80 HA ASP 80 -10.777 13.720 5.914 475 HB2 ASP 80 2HB ASP 80 -8.226 12.709 6.233 476 HB3 ASP 80 3HB ASP 80 -7.874 14.250 5.485 477 H GLY 81 H GLY 81 -10.257 16.108 5.744 478 HA2 GLY 81 HA2 GLY 81 -8.978 17.599 3.989 479 HA3 GLY 81 HA3 GLY 81 -10.309 17.106 2.951 480 H ASP 82 H ASP 82 -10.236 19.555 2.976 481 HA ASP 82 HA ASP 82 -12.065 20.715 5.012 482 HB2 ASP 82 2HB ASP 82 -10.232 22.122 4.322 483 HB3 ASP 82 3HB ASP 82 -10.581 21.850 2.633 484 H SER 83 H SER 83 -14.166 20.433 4.728 485 HA SER 83 HA SER 83 -15.036 18.483 3.006 486 HB2 SER 83 2HB SER 83 -17.284 18.949 3.873 487 HB3 SER 83 3HB SER 83 -16.061 18.977 5.149 488 HG SER 83 HG SER 83 -17.501 20.733 5.345 489 H ARG 84 H ARG 84 -14.989 21.864 2.248 490 HA ARG 84 HA ARG 84 -17.056 21.960 0.290 491 HB2 ARG 84 2HB ARG 84 -14.488 23.598 0.370 492 HB3 ARG 84 3HB ARG 84 -15.972 24.010 -0.484 493 HG2 ARG 84 2HG ARG 84 -15.569 23.905 2.529 494 HG3 ARG 84 3HG ARG 84 -15.812 25.329 1.519 495 HD2 ARG 84 2HD ARG 84 -18.097 24.431 0.913 496 HD3 ARG 84 3HD ARG 84 -17.878 23.154 2.102 497 HE ARG 84 HE ARG 84 -18.419 25.986 2.588 498 HH11 ARG 84 1HH1 ARG 84 -17.300 23.000 4.205 499 HH12 ARG 84 2HH1 ARG 84 -17.684 23.642 5.769 500 HH21 ARG 84 1HH2 ARG 84 -18.886 26.689 4.629 501 HH22 ARG 84 2HH2 ARG 84 -18.572 25.680 6.013 502 H LEU 85 H LEU 85 -13.859 20.467 0.047 503 HA LEU 85 HA LEU 85 -14.290 20.154 -2.903 504 HB2 LEU 85 2HB LEU 85 -12.057 20.774 -2.275 505 HB3 LEU 85 3HB LEU 85 -11.936 19.436 -1.122 506 HG LEU 85 HG LEU 85 -11.919 17.809 -2.907 507 HD11 LEU 85 1HD1 LEU 85 -12.222 20.098 -4.918 508 HD12 LEU 85 2HD1 LEU 85 -13.451 18.861 -4.595 509 HD13 LEU 85 3HD1 LEU 85 -11.911 18.397 -5.304 510 HD21 LEU 85 1HD2 LEU 85 -9.806 18.443 -3.974 511 HD22 LEU 85 2HD2 LEU 85 -9.811 19.050 -2.304 512 HD23 LEU 85 3HD2 LEU 85 -10.110 20.162 -3.638 513 H CYS 86 H CYS 86 -13.789 18.010 0.011 514 HA CYS 86 HA CYS 86 -14.409 15.593 -1.051 515 HB2 CYS 86 2HB CYS 86 -15.422 16.625 1.638 516 HB3 CYS 86 3HB CYS 86 -15.089 14.945 1.193 517 HG CYS 86 HG CYS 86 -13.191 15.756 2.800 518 H ALA 87 H ALA 87 -16.941 17.999 -0.096 519 HA ALA 87 HA ALA 87 -19.146 16.244 -0.861 520 HB1 ALA 87 1HB ALA 87 -19.006 19.259 -0.379 521 HB2 ALA 87 2HB ALA 87 -20.486 18.296 -0.507 522 HB3 ALA 87 3HB ALA 87 -19.370 18.030 0.846 523 H ALA 88 H ALA 88 -17.405 18.890 -2.538 524 HA ALA 88 HA ALA 88 -19.129 19.038 -4.800 525 HB1 ALA 88 1HB ALA 88 -17.253 20.306 -5.793 526 HB2 ALA 88 2HB ALA 88 -17.543 20.815 -4.127 527 HB3 ALA 88 3HB ALA 88 -16.170 19.741 -4.499 528 H THR 89 H THR 89 -15.995 17.310 -4.400 529 HA THR 89 HA THR 89 -16.033 15.981 -6.940 530 HB THR 89 HB THR 89 -14.020 16.151 -5.498 531 HG1 THR 89 HG1 THR 89 -13.369 14.037 -6.023 532 HG21 THR 89 1HG2 THR 89 -15.172 15.398 -3.328 533 HG22 THR 89 2HG2 THR 89 -13.592 14.678 -3.682 534 HG23 THR 89 3HG2 THR 89 -15.081 13.744 -3.960 535 H LYS 90 H LYS 90 -17.349 14.948 -3.764 536 HA LYS 90 HA LYS 90 -18.202 12.369 -4.542 537 HB2 LYS 90 2HB LYS 90 -17.950 13.072 -2.251 538 HB3 LYS 90 3HB LYS 90 -19.157 14.332 -2.437 539 HG2 LYS 90 2HG LYS 90 -20.350 11.747 -3.054 540 HG3 LYS 90 3HG LYS 90 -19.452 11.616 -1.557 541 HD2 LYS 90 2HD LYS 90 -21.411 13.898 -2.057 542 HD3 LYS 90 3HD LYS 90 -21.916 12.335 -1.381 543 HE2 LYS 90 2HE LYS 90 -20.264 12.611 0.465 544 HE3 LYS 90 3HE LYS 90 -19.770 14.169 -0.201 545 HZ1 LYS 90 HZ1 LYS 90 -21.411 14.424 1.578 546 HZ2 LYS 90 HZ2 LYS 90 -22.501 13.516 0.777 547 HZ3 LYS 90 HZ3 LYS 90 -22.039 14.976 0.180 548 H ARG 91 H ARG 91 -19.842 15.483 -4.961 549 HA ARG 91 HA ARG 91 -22.216 14.275 -6.172 550 HB2 ARG 91 2HB ARG 91 -21.099 17.106 -6.214 551 HB3 ARG 91 3HB ARG 91 -22.604 16.660 -7.020 552 HG2 ARG 91 2HG ARG 91 -22.090 16.411 -4.021 553 HG3 ARG 91 3HG ARG 91 -22.985 17.719 -4.823 554 HD2 ARG 91 2HD ARG 91 -24.585 16.028 -5.704 555 HD3 ARG 91 3HD ARG 91 -23.745 14.773 -4.769 556 HE ARG 91 HE ARG 91 -24.408 16.866 -2.990 557 HH11 ARG 91 1HH1 ARG 91 -26.143 14.411 -4.846 558 HH12 ARG 91 2HH1 ARG 91 -27.492 14.405 -3.760 559 HH21 ARG 91 1HH2 ARG 91 -26.169 16.807 -1.611 560 HH22 ARG 91 2HH2 ARG 91 -27.507 15.747 -1.946 561 H ALA 92 H ALA 92 -19.286 15.803 -7.551 562 HA ALA 92 HA ALA 92 -19.970 15.540 -10.297 563 HB1 ALA 92 1HB ALA 92 -17.244 15.555 -8.932 564 HB2 ALA 92 2HB ALA 92 -17.520 15.773 -10.668 565 HB3 ALA 92 3HB ALA 92 -18.163 16.956 -9.518 566 H VAL 93 H VAL 93 -18.030 13.302 -8.279 567 HA VAL 93 HA VAL 93 -17.683 11.359 -10.289 568 HB VAL 93 HB VAL 93 -17.824 10.497 -7.402 569 HG11 VAL 93 1HG1 VAL 93 -17.281 8.888 -9.276 570 HG12 VAL 93 2HG1 VAL 93 -15.813 9.836 -9.575 571 HG13 VAL 93 3HG1 VAL 93 -16.052 9.024 -8.021 572 HG21 VAL 93 1HG2 VAL 93 -15.159 11.321 -7.809 573 HG22 VAL 93 2HG2 VAL 93 -16.146 12.659 -8.381 574 HG23 VAL 93 3HG2 VAL 93 -16.371 12.040 -6.749 575 H ALA 94 H ALA 94 -20.437 11.994 -8.302 576 HA ALA 94 HA ALA 94 -21.718 9.372 -8.718 577 HB1 ALA 94 1HB ALA 94 -22.785 11.947 -7.469 578 HB2 ALA 94 2HB ALA 94 -23.588 10.373 -7.483 579 HB3 ALA 94 3HB ALA 94 -22.065 10.566 -6.607 580 H GLN 95 H GLN 95 -21.235 12.125 -10.650 581 HA GLN 95 HA GLN 95 -23.643 11.502 -12.324 582 HB2 GLN 95 2HB GLN 95 -24.047 13.838 -12.683 583 HB3 GLN 95 3HB GLN 95 -24.035 13.475 -10.964 584 HG2 GLN 95 2HG GLN 95 -22.784 15.471 -11.025 585 HG3 GLN 95 3HG GLN 95 -21.600 14.270 -10.969 586 HE21 GLN 95 1HE2 GLN 95 -19.992 14.389 -12.569 587 HE22 GLN 95 2HE2 GLN 95 -20.150 15.449 -13.975 588 H VAL 96 H VAL 96 -20.201 11.914 -12.349 589 HA VAL 96 HA VAL 96 -19.759 12.605 -15.054 590 HB VAL 96 HB VAL 96 -17.652 11.235 -14.854 591 HG11 VAL 96 1HG1 VAL 96 -16.522 12.735 -13.399 592 HG12 VAL 96 2HG1 VAL 96 -17.765 13.644 -14.263 593 HG13 VAL 96 3HG1 VAL 96 -17.992 13.169 -12.557 594 HG21 VAL 96 1HG2 VAL 96 -18.157 9.493 -13.348 595 HG22 VAL 96 2HG2 VAL 96 -17.055 10.592 -12.485 596 HG23 VAL 96 3HG2 VAL 96 -18.773 10.623 -12.128 597 H ASN 97 H ASN 97 -19.480 11.467 -16.960 598 HA ASN 97 HA ASN 97 -21.383 9.426 -17.401 599 HB2 ASN 97 2HB ASN 97 -20.536 9.434 -19.732 600 HB3 ASN 97 3HB ASN 97 -20.894 11.031 -19.101 601 HD21 ASN 97 1HD2 ASN 97 -18.173 8.802 -19.958 602 HD22 ASN 97 2HD2 ASN 97 -16.989 10.084 -20.055 603 H SER 98 H SER 98 -17.843 9.134 -17.223 604 HA SER 98 HA SER 98 -17.479 6.540 -16.339 605 HB2 SER 98 2HB SER 98 -16.888 5.351 -18.507 606 HB3 SER 98 3HB SER 98 -18.608 5.522 -18.204 607 HG SER 98 HG SER 98 -18.061 6.060 -20.367 608 H PHE 99 H PHE 99 -15.323 6.019 -16.184 609 HA PHE 99 HA PHE 99 -13.420 8.167 -16.934 610 HB2 PHE 99 2HB PHE 99 -12.938 5.795 -15.117 611 HB3 PHE 99 3HB PHE 99 -12.057 7.303 -15.198 612 HD1 PHE 99 HD1 PHE 99 -13.259 9.471 -14.392 613 HD2 PHE 99 HD2 PHE 99 -14.830 5.493 -13.693 614 HE1 PHE 99 HE1 PHE 99 -14.763 10.356 -12.663 615 HE2 PHE 99 HE2 PHE 99 -16.352 6.408 -11.989 616 HZ PHE 99 HZ PHE 99 -16.296 8.800 -11.441 617 HA PRO 100 HA PRO 100 -12.308 5.055 -20.127 618 HB2 PRO 100 2HB PRO 100 -10.921 6.648 -21.865 619 HB3 PRO 100 3HB PRO 100 -12.709 6.681 -21.726 620 HG2 PRO 100 2HG PRO 100 -10.707 8.549 -20.434 621 HG3 PRO 100 3HG PRO 100 -12.203 8.980 -21.341 622 HD2 PRO 100 2HD PRO 100 -12.146 8.860 -18.617 623 HD3 PRO 100 3HD PRO 100 -13.588 8.354 -19.550 624 H LEU 101 H LEU 101 -10.582 3.687 -20.138 625 HA LEU 101 HA LEU 101 -8.517 4.216 -18.200 626 HB2 LEU 101 2HB LEU 101 -8.600 1.800 -20.015 627 HB3 LEU 101 3HB LEU 101 -7.942 1.952 -18.389 628 HG LEU 101 HG LEU 101 -10.857 1.867 -19.190 629 HD11 LEU 101 1HD1 LEU 101 -10.876 -0.245 -17.937 630 HD12 LEU 101 2HD1 LEU 101 -9.158 -0.038 -17.530 631 HD13 LEU 101 3HD1 LEU 101 -9.647 -0.288 -19.219 632 HD21 LEU 101 1HD2 LEU 101 -9.686 2.222 -16.407 633 HD22 LEU 101 2HD2 LEU 101 -11.388 1.851 -16.749 634 HD23 LEU 101 3HD2 LEU 101 -10.682 3.394 -17.260 635 HA PRO 102 HA PRO 102 -5.191 5.280 -21.095 636 HB2 PRO 102 2HB PRO 102 -3.011 5.048 -19.500 637 HB3 PRO 102 3HB PRO 102 -4.223 6.340 -19.272 638 HG2 PRO 102 2HG PRO 102 -4.023 3.698 -17.776 639 HG3 PRO 102 3HG PRO 102 -4.215 5.345 -17.101 640 HD2 PRO 102 2HD PRO 102 -6.336 3.653 -17.532 641 HD3 PRO 102 3HD PRO 102 -6.481 5.429 -17.699 642 H LYS 103 H LYS 103 -5.285 2.239 -19.276 643 HA LYS 103 HA LYS 103 -4.304 0.762 -21.602 644 HB2 LYS 103 2HB LYS 103 -3.134 0.481 -18.819 645 HB3 LYS 103 3HB LYS 103 -3.054 -0.789 -20.028 646 HG2 LYS 103 2HG LYS 103 -1.058 0.161 -20.538 647 HG3 LYS 103 3HG LYS 103 -2.069 1.171 -21.567 648 HD2 LYS 103 2HD LYS 103 -2.282 2.670 -19.421 649 HD3 LYS 103 3HD LYS 103 -0.872 1.756 -18.845 650 HE2 LYS 103 2HE LYS 103 0.256 2.398 -21.060 651 HE3 LYS 103 3HE LYS 103 -1.138 3.452 -21.360 652 HZ1 LYS 103 HZ1 LYS 103 0.728 4.664 -20.345 653 HZ2 LYS 103 HZ2 LYS 103 0.727 3.695 -19.034 654 HZ3 LYS 103 HZ3 LYS 103 -0.549 4.676 -19.332 655 H ASP 104 H ASP 104 -5.087 -1.508 -21.580 656 HA ASP 104 HA ASP 104 -7.542 -1.856 -19.935 657 HB2 ASP 104 2HB ASP 104 -7.947 -0.720 -22.102 658 HB3 ASP 104 3HB ASP 104 -7.217 -2.089 -22.946 659 H GLN 105 H GLN 105 -5.388 -3.246 -19.112 660 HA GLN 105 HA GLN 105 -5.846 -5.999 -20.123 661 HB2 GLN 105 2HB GLN 105 -3.408 -4.956 -18.671 662 HB3 GLN 105 3HB GLN 105 -3.766 -6.643 -18.963 663 HG2 GLN 105 2HG GLN 105 -2.237 -5.950 -20.656 664 HG3 GLN 105 3HG GLN 105 -3.799 -6.299 -21.416 665 HE21 GLN 105 1HE2 GLN 105 -2.407 -3.422 -19.763 666 HE22 GLN 105 2HE2 GLN 105 -2.712 -2.313 -21.095 667 HA PRO 106 HA PRO 106 -8.011 -6.733 -16.244 668 HB2 PRO 106 2HB PRO 106 -6.618 -9.414 -16.419 669 HB3 PRO 106 3HB PRO 106 -8.323 -9.049 -15.988 670 HG2 PRO 106 2HG PRO 106 -7.729 -9.881 -18.479 671 HG3 PRO 106 3HG PRO 106 -8.854 -8.499 -18.261 672 HD2 PRO 106 2HD PRO 106 -5.910 -8.443 -18.966 673 HD3 PRO 106 3HD PRO 106 -7.265 -7.495 -19.651 674 H ASP 107 H ASP 107 -4.533 -6.928 -16.468 675 HA ASP 107 HA ASP 107 -4.071 -7.339 -13.593 676 HB2 ASP 107 2HB ASP 107 -2.482 -8.182 -15.283 677 HB3 ASP 107 3HB ASP 107 -2.226 -6.536 -15.875 678 H VAL 108 H VAL 108 -4.317 -4.632 -15.863 679 HA VAL 108 HA VAL 108 -3.499 -2.692 -13.753 680 HB VAL 108 HB VAL 108 -3.368 -1.023 -15.425 681 HG11 VAL 108 1HG1 VAL 108 -1.475 -1.837 -16.730 682 HG12 VAL 108 2HG1 VAL 108 -1.394 -2.451 -15.067 683 HG13 VAL 108 3HG1 VAL 108 -1.914 -3.521 -16.381 684 HG21 VAL 108 1HG2 VAL 108 -5.171 -1.625 -16.936 685 HG22 VAL 108 2HG2 VAL 108 -3.646 -1.423 -17.809 686 HG23 VAL 108 3HG2 VAL 108 -4.237 -3.044 -17.496 687 H VAL 109 H VAL 109 -6.333 -3.716 -15.622 688 HA VAL 109 HA VAL 109 -8.193 -1.705 -14.903 689 HB VAL 109 HB VAL 109 -8.481 -4.721 -15.200 690 HG11 VAL 109 1HG1 VAL 109 -10.407 -4.120 -13.856 691 HG12 VAL 109 2HG1 VAL 109 -10.711 -2.675 -14.846 692 HG13 VAL 109 3HG1 VAL 109 -10.947 -4.309 -15.522 693 HG21 VAL 109 1HG2 VAL 109 -9.396 -4.192 -17.404 694 HG22 VAL 109 2HG2 VAL 109 -9.429 -2.452 -17.024 695 HG23 VAL 109 3HG2 VAL 109 -7.889 -3.281 -17.253 696 H GLU 110 H GLU 110 -6.616 -4.120 -12.928 697 HA GLU 110 HA GLU 110 -8.418 -3.943 -10.640 698 HB2 GLU 110 2HB GLU 110 -5.742 -5.203 -11.119 699 HB3 GLU 110 3HB GLU 110 -6.577 -5.322 -9.563 700 HG2 GLU 110 2HG GLU 110 -7.976 -6.173 -12.129 701 HG3 GLU 110 3HG GLU 110 -6.836 -7.222 -11.294 702 H LYS 111 H LYS 111 -5.903 -1.882 -11.772 703 HA LYS 111 HA LYS 111 -5.113 -1.024 -9.025 704 HB2 LYS 111 2HB LYS 111 -3.888 -0.650 -11.759 705 HB3 LYS 111 3HB LYS 111 -3.534 0.487 -10.471 706 HG2 LYS 111 2HG LYS 111 -1.838 -1.251 -10.642 707 HG3 LYS 111 3HG LYS 111 -2.603 -1.228 -9.047 708 HD2 LYS 111 2HD LYS 111 -3.874 -3.216 -9.517 709 HD3 LYS 111 3HD LYS 111 -3.504 -3.097 -11.248 710 HE2 LYS 111 2HE LYS 111 -1.050 -3.404 -10.636 711 HE3 LYS 111 3HE LYS 111 -1.580 -3.707 -8.968 712 HZ1 LYS 111 HZ1 LYS 111 -2.780 -5.651 -9.759 713 HZ2 LYS 111 HZ2 LYS 111 -1.252 -5.762 -10.331 714 HZ3 LYS 111 HZ3 LYS 111 -2.463 -5.297 -11.328 715 H LEU 112 H LEU 112 -6.410 0.238 -12.045 716 HA LEU 112 HA LEU 112 -6.728 2.939 -11.041 717 HB2 LEU 112 2HB LEU 112 -7.720 3.416 -13.292 718 HB3 LEU 112 3HB LEU 112 -6.148 2.698 -13.259 719 HG LEU 112 HG LEU 112 -7.062 0.567 -13.692 720 HD11 LEU 112 1HD1 LEU 112 -9.274 0.267 -14.824 721 HD12 LEU 112 2HD1 LEU 112 -9.721 1.844 -14.163 722 HD13 LEU 112 3HD1 LEU 112 -9.305 0.503 -13.080 723 HD21 LEU 112 1HD2 LEU 112 -5.991 1.776 -15.439 724 HD22 LEU 112 2HD2 LEU 112 -7.545 2.548 -15.875 725 HD23 LEU 112 3HD2 LEU 112 -7.290 0.786 -16.087 726 H LYS 113 H LYS 113 -8.760 0.149 -10.903 727 HA LYS 113 HA LYS 113 -11.275 1.474 -10.533 728 HB2 LYS 113 2HB LYS 113 -11.921 -0.640 -9.393 729 HB3 LYS 113 3HB LYS 113 -11.224 -0.882 -11.003 730 HG2 LYS 113 2HG LYS 113 -9.161 -1.680 -10.110 731 HG3 LYS 113 3HG LYS 113 -9.486 -1.067 -8.504 732 HD2 LYS 113 2HD LYS 113 -9.662 -3.575 -8.865 733 HD3 LYS 113 3HD LYS 113 -10.945 -2.782 -7.955 734 HE2 LYS 113 2HE LYS 113 -12.427 -2.768 -9.859 735 HE3 LYS 113 3HE LYS 113 -11.147 -3.366 -10.930 736 HZ1 LYS 113 HZ1 LYS 113 -11.144 -5.440 -9.734 737 HZ2 LYS 113 HZ2 LYS 113 -12.678 -5.148 -10.196 738 HZ3 LYS 113 HZ3 LYS 113 -12.240 -4.906 -8.628 739 H ASN 114 H ASN 114 -8.566 1.160 -8.392 740 HA ASN 114 HA ASN 114 -10.166 2.221 -6.107 741 HB2 ASN 114 2HB ASN 114 -7.958 0.166 -5.854 742 HB3 ASN 114 3HB ASN 114 -8.976 0.855 -4.579 743 HD21 ASN 114 1HD2 ASN 114 -11.526 0.577 -6.153 744 HD22 ASN 114 2HD2 ASN 114 -11.848 -1.148 -6.078 745 H ILE 115 H ILE 115 -9.420 4.312 -6.788 746 HA ILE 115 HA ILE 115 -6.527 4.857 -6.349 747 HB ILE 115 HB ILE 115 -6.783 6.931 -7.519 748 HG12 ILE 115 2HG1 ILE 115 -9.246 7.223 -7.131 749 HG13 ILE 115 3HG1 ILE 115 -8.629 7.656 -8.676 750 HG21 ILE 115 1HG2 ILE 115 -5.854 5.074 -8.696 751 HG22 ILE 115 2HG2 ILE 115 -7.445 4.435 -9.102 752 HG23 ILE 115 3HG2 ILE 115 -6.905 5.972 -9.817 753 HD11 ILE 115 1HD1 ILE 115 -10.222 5.162 -8.061 754 HD12 ILE 115 2HD1 ILE 115 -10.729 6.586 -8.996 755 HD13 ILE 115 3HD1 ILE 115 -9.475 5.525 -9.627 756 H ASN 116 H ASN 116 -5.843 6.528 -5.089 757 HA ASN 116 HA ASN 116 -7.913 7.888 -3.434 758 HB2 ASN 116 2HB ASN 116 -5.045 8.435 -2.872 759 HB3 ASN 116 3HB ASN 116 -6.446 8.370 -1.812 760 HD21 ASN 116 1HD2 ASN 116 -7.363 5.712 -2.055 761 HD22 ASN 116 2HD2 ASN 116 -6.077 4.669 -1.516 762 H LEU 117 H LEU 117 -8.438 9.913 -3.972 763 HA LEU 117 HA LEU 117 -6.645 11.561 -5.717 764 HB2 LEU 117 2HB LEU 117 -9.484 12.124 -4.768 765 HB3 LEU 117 3HB LEU 117 -8.511 13.121 -5.852 766 HG LEU 117 HG LEU 117 -9.639 10.332 -6.399 767 HD11 LEU 117 1HD1 LEU 117 -10.965 11.496 -8.119 768 HD12 LEU 117 2HD1 LEU 117 -10.209 13.044 -7.673 769 HD13 LEU 117 3HD1 LEU 117 -11.254 12.185 -6.516 770 HD21 LEU 117 1HD2 LEU 117 -7.739 12.008 -8.076 771 HD22 LEU 117 2HD2 LEU 117 -8.752 10.718 -8.758 772 HD23 LEU 117 3HD2 LEU 117 -7.530 10.328 -7.543 773 H THR 118 H THR 118 -5.203 12.696 -4.613 774 HA THR 118 HA THR 118 -5.874 13.797 -1.941 775 HB THR 118 HB THR 118 -3.330 12.292 -2.650 776 HG1 THR 118 HG1 THR 118 -4.143 10.848 -1.131 777 HG21 THR 118 1HG2 THR 118 -4.215 13.784 -0.141 778 HG22 THR 118 2HG2 THR 118 -2.756 14.084 -1.103 779 HG23 THR 118 3HG2 THR 118 -2.889 12.593 -0.153 780 H VAL 119 H VAL 119 -5.391 15.843 -1.746 781 HA VAL 119 HA VAL 119 -3.607 17.213 -3.707 782 HB VAL 119 HB VAL 119 -5.247 18.807 -4.237 783 HG11 VAL 119 1HG1 VAL 119 -6.735 16.156 -4.384 784 HG12 VAL 119 2HG1 VAL 119 -6.961 17.565 -5.427 785 HG13 VAL 119 3HG1 VAL 119 -5.443 16.652 -5.511 786 HG21 VAL 119 1HG2 VAL 119 -7.571 18.797 -3.405 787 HG22 VAL 119 2HG2 VAL 119 -7.116 17.540 -2.227 788 HG23 VAL 119 3HG2 VAL 119 -6.407 19.170 -2.148 789 H ALA 120 H ALA 120 -3.006 19.363 -3.135 790 HA ALA 120 HA ALA 120 -3.372 20.556 -0.537 791 HB1 ALA 120 1HB ALA 120 -1.944 18.614 0.111 792 HB2 ALA 120 2HB ALA 120 -0.775 19.031 -1.151 793 HB3 ALA 120 3HB ALA 120 -1.003 20.102 0.239 794 HA PRO 121 HA PRO 121 -1.893 23.951 -2.940 795 HB2 PRO 121 2HB PRO 121 -0.800 25.708 -1.178 796 HB3 PRO 121 3HB PRO 121 -2.534 25.274 -1.141 797 HG2 PRO 121 2HG PRO 121 -0.296 24.086 0.530 798 HG3 PRO 121 3HG PRO 121 -1.859 24.749 1.096 799 HD2 PRO 121 2HD PRO 121 -1.527 22.094 0.686 800 HD3 PRO 121 3HD PRO 121 -3.058 22.906 0.258 801 H GLU 122 H GLU 122 -0.032 25.195 -3.723 802 HA GLU 122 HA GLU 122 2.684 24.359 -3.114 803 HB2 GLU 122 2HB GLU 122 1.696 22.506 -4.584 804 HB3 GLU 122 3HB GLU 122 1.571 23.685 -5.874 805 HG2 GLU 122 2HG GLU 122 4.165 22.926 -4.436 806 HG3 GLU 122 3HG GLU 122 3.598 22.169 -5.917 Start of MODEL 5 1 H1 ALA 22 H ALA 22 14.596 5.055 -17.652 2 HA ALA 22 HA ALA 22 16.733 3.267 -18.740 3 HB1 ALA 22 1HB ALA 22 18.251 4.960 -17.809 4 HB2 ALA 22 2HB ALA 22 17.081 5.702 -18.910 5 HB3 ALA 22 3HB ALA 22 16.867 5.861 -17.144 6 H ALA 23 H ALA 23 14.571 3.283 -16.193 7 HA ALA 23 HA ALA 23 16.468 2.052 -14.232 8 HB1 ALA 23 1HB ALA 23 14.381 4.261 -13.807 9 HB2 ALA 23 2HB ALA 23 15.326 3.471 -12.527 10 HB3 ALA 23 3HB ALA 23 16.141 4.445 -13.755 11 H ARG 24 H ARG 24 12.965 2.793 -14.298 12 HA ARG 24 HA ARG 24 11.126 1.608 -14.095 13 HB2 ARG 24 2HB ARG 24 12.689 -0.818 -15.027 14 HB3 ARG 24 3HB ARG 24 10.933 -0.646 -14.987 15 HG2 ARG 24 2HG ARG 24 11.080 1.303 -16.515 16 HG3 ARG 24 3HG ARG 24 12.830 1.043 -16.684 17 HD2 ARG 24 2HD ARG 24 10.653 -0.911 -17.472 18 HD3 ARG 24 3HD ARG 24 11.566 0.111 -18.569 19 HE ARG 24 HE ARG 24 13.565 -1.107 -18.170 20 HH11 ARG 24 1HH1 ARG 24 10.792 -2.719 -16.660 21 HH12 ARG 24 2HH1 ARG 24 11.635 -4.232 -16.538 22 HH21 ARG 24 1HH2 ARG 24 14.584 -3.095 -17.976 23 HH22 ARG 24 2HH2 ARG 24 13.741 -4.442 -17.281 24 H GLN 25 H GLN 25 13.150 1.608 -11.783 25 HA GLN 25 HA GLN 25 12.259 -0.798 -10.278 26 HB2 GLN 25 2HB GLN 25 14.263 1.299 -9.410 27 HB3 GLN 25 3HB GLN 25 13.994 -0.282 -8.695 28 HG2 GLN 25 2HG GLN 25 15.181 0.321 -11.428 29 HG3 GLN 25 3HG GLN 25 16.045 -0.272 -10.023 30 HE21 GLN 25 1HE2 GLN 25 14.588 -1.240 -12.926 31 HE22 GLN 25 2HE2 GLN 25 14.411 -2.948 -12.533 32 H GLN 26 H GLN 26 11.594 2.537 -10.462 33 HA GLN 26 HA GLN 26 10.033 2.579 -7.916 34 HB2 GLN 26 2HB GLN 26 11.071 4.621 -7.286 35 HB3 GLN 26 3HB GLN 26 12.317 3.406 -7.540 36 HG2 GLN 26 2HG GLN 26 11.570 5.610 -9.514 37 HG3 GLN 26 3HG GLN 26 12.931 5.660 -8.391 38 HE21 GLN 26 1HE2 GLN 26 14.699 4.006 -8.708 39 HE22 GLN 26 2HE2 GLN 26 14.957 3.422 -10.340 40 H PHE 27 H PHE 27 10.354 3.715 -11.210 41 HA PHE 27 HA PHE 27 8.895 6.054 -11.097 42 HB2 PHE 27 2HB PHE 27 9.281 6.153 -13.324 43 HB3 PHE 27 3HB PHE 27 10.415 4.852 -12.950 44 HD1 PHE 27 HD1 PHE 27 7.675 5.848 -14.986 45 HD2 PHE 27 HD2 PHE 27 9.382 2.412 -13.037 46 HE1 PHE 27 HE1 PHE 27 6.334 4.352 -16.447 47 HE2 PHE 27 HE2 PHE 27 8.130 0.908 -14.566 48 HZ PHE 27 HZ PHE 27 6.598 1.883 -16.279 49 H VAL 28 H VAL 28 7.507 3.007 -10.715 50 HA VAL 28 HA VAL 28 4.887 3.271 -11.800 51 HB VAL 28 HB VAL 28 4.184 1.825 -9.832 52 HG11 VAL 28 1HG1 VAL 28 6.538 0.837 -11.525 53 HG12 VAL 28 2HG1 VAL 28 5.342 -0.193 -10.699 54 HG13 VAL 28 3HG1 VAL 28 4.830 0.873 -12.017 55 HG21 VAL 28 1HG2 VAL 28 5.860 0.746 -8.448 56 HG22 VAL 28 2HG2 VAL 28 7.160 1.712 -9.164 57 HG23 VAL 28 3HG2 VAL 28 5.897 2.485 -8.168 58 H THR 29 H THR 29 6.335 4.790 -8.988 59 HA THR 29 HA THR 29 3.975 5.872 -7.789 60 HB THR 29 HB THR 29 6.264 5.702 -6.850 61 HG1 THR 29 HG1 THR 29 5.943 7.583 -5.621 62 HG21 THR 29 1HG2 THR 29 7.865 7.497 -7.176 63 HG22 THR 29 2HG2 THR 29 6.762 8.379 -8.244 64 HG23 THR 29 3HG2 THR 29 7.472 6.844 -8.778 65 H SER 30 H SER 30 5.659 6.798 -10.726 66 HA SER 30 HA SER 30 4.009 9.251 -10.977 67 HB2 SER 30 2HB SER 30 6.397 9.129 -11.807 68 HB3 SER 30 3HB SER 30 5.864 7.947 -13.017 69 HG SER 30 HG SER 30 5.065 10.677 -12.765 70 H GLU 31 H GLU 31 3.981 5.877 -12.180 71 HA GLU 31 HA GLU 31 1.759 6.399 -13.935 72 HB2 GLU 31 2HB GLU 31 2.567 3.803 -12.566 73 HB3 GLU 31 3HB GLU 31 1.219 3.966 -13.698 74 HG2 GLU 31 2HG GLU 31 2.948 4.951 -15.353 75 HG3 GLU 31 3HG GLU 31 4.177 4.290 -14.272 76 H VAL 32 H VAL 32 1.893 5.747 -10.390 77 HA VAL 32 HA VAL 32 -0.994 5.421 -10.298 78 HB VAL 32 HB VAL 32 0.629 4.554 -8.576 79 HG11 VAL 32 1HG1 VAL 32 0.332 7.308 -7.315 80 HG12 VAL 32 2HG1 VAL 32 1.049 5.870 -6.570 81 HG13 VAL 32 3HG1 VAL 32 1.813 6.596 -7.980 82 HG21 VAL 32 1HG2 VAL 32 -1.057 4.586 -6.821 83 HG22 VAL 32 2HG2 VAL 32 -1.853 5.983 -7.572 84 HG23 VAL 32 3HG2 VAL 32 -1.836 4.416 -8.411 85 H GLY 33 H GLY 33 1.103 8.113 -10.276 86 HA2 GLY 33 HA2 GLY 33 -0.731 10.230 -9.511 87 HA3 GLY 33 HA3 GLY 33 0.837 10.383 -10.343 88 H ARG 34 H ARG 34 -0.562 8.316 -12.331 89 HA ARG 34 HA ARG 34 -1.980 10.354 -14.035 90 HB2 ARG 34 2HB ARG 34 -0.641 7.728 -14.785 91 HB3 ARG 34 3HB ARG 34 -1.436 8.849 -15.906 92 HG2 ARG 34 2HG ARG 34 0.241 10.532 -15.595 93 HG3 ARG 34 3HG ARG 34 0.856 9.749 -14.150 94 HD2 ARG 34 2HD ARG 34 1.499 7.763 -15.654 95 HD3 ARG 34 3HD ARG 34 1.234 8.867 -17.012 96 HE ARG 34 HE ARG 34 3.172 9.279 -14.738 97 HH11 ARG 34 1HH1 ARG 34 2.392 9.978 -18.130 98 HH12 ARG 34 2HH1 ARG 34 3.951 10.723 -18.388 99 HH21 ARG 34 1HH2 ARG 34 5.115 10.191 -15.183 100 HH22 ARG 34 2HH2 ARG 34 5.474 10.783 -16.793 101 H TYR 35 H TYR 35 -1.990 6.950 -13.072 102 HA TYR 35 HA TYR 35 -4.482 6.043 -13.965 103 HB2 TYR 35 2HB TYR 35 -2.678 5.359 -11.634 104 HB3 TYR 35 3HB TYR 35 -4.274 4.644 -11.705 105 HD1 TYR 35 HD1 TYR 35 -1.621 5.317 -14.336 106 HD2 TYR 35 HD2 TYR 35 -4.181 2.469 -12.386 107 HE1 TYR 35 HE1 TYR 35 -0.961 3.602 -16.000 108 HE2 TYR 35 HE2 TYR 35 -3.671 0.796 -14.127 109 HH TYR 35 HH TYR 35 -2.336 0.307 -15.958 110 H GLY 36 H GLY 36 -3.887 7.704 -10.866 111 HA2 GLY 36 HA2 GLY 36 -6.740 7.869 -10.209 112 HA3 GLY 36 HA3 GLY 36 -5.378 8.601 -9.318 113 H ALA 37 H ALA 37 -4.597 9.804 -12.166 114 HA ALA 37 HA ALA 37 -5.972 12.281 -11.715 115 HB1 ALA 37 1HB ALA 37 -3.580 12.263 -12.223 116 HB2 ALA 37 2HB ALA 37 -3.917 11.546 -13.825 117 HB3 ALA 37 3HB ALA 37 -4.483 13.176 -13.435 118 H ILE 38 H ILE 38 -6.217 9.597 -14.053 119 HA ILE 38 HA ILE 38 -7.839 10.911 -15.997 120 HB ILE 38 HB ILE 38 -8.458 8.767 -16.764 121 HG12 ILE 38 2HG1 ILE 38 -7.970 7.808 -13.940 122 HG13 ILE 38 3HG1 ILE 38 -9.455 7.765 -14.872 123 HG21 ILE 38 1HG2 ILE 38 -6.395 7.700 -17.114 124 HG22 ILE 38 2HG2 ILE 38 -5.921 9.364 -16.753 125 HG23 ILE 38 3HG2 ILE 38 -5.772 8.112 -15.507 126 HD11 ILE 38 1HD1 ILE 38 -7.022 6.003 -15.176 127 HD12 ILE 38 2HD1 ILE 38 -8.689 5.544 -14.767 128 HD13 ILE 38 3HD1 ILE 38 -8.325 6.090 -16.406 129 H TYR 39 H TYR 39 -8.572 9.785 -12.819 130 HA TYR 39 HA TYR 39 -11.477 10.051 -13.048 131 HB2 TYR 39 2HB TYR 39 -9.695 9.677 -10.623 132 HB3 TYR 39 3HB TYR 39 -11.441 9.581 -10.632 133 HD1 TYR 39 HD1 TYR 39 -12.624 7.744 -11.718 134 HD2 TYR 39 HD2 TYR 39 -8.347 7.759 -11.476 135 HE1 TYR 39 HE1 TYR 39 -12.539 5.433 -12.630 136 HE2 TYR 39 HE2 TYR 39 -8.258 5.325 -12.222 137 HH TYR 39 HH TYR 39 -9.587 3.591 -13.014 138 H THR 40 H THR 40 -8.903 11.816 -11.250 139 HA THR 40 HA THR 40 -10.613 13.848 -10.243 140 HB THR 40 HB THR 40 -8.233 13.083 -9.523 141 HG1 THR 40 HG1 THR 40 -9.383 14.671 -8.451 142 HG21 THR 40 1HG2 THR 40 -7.330 15.480 -11.113 143 HG22 THR 40 2HG2 THR 40 -7.231 13.846 -11.782 144 HG23 THR 40 3HG2 THR 40 -6.361 14.224 -10.288 145 H GLN 41 H GLN 41 -8.858 13.708 -13.286 146 HA GLN 41 HA GLN 41 -9.354 16.446 -14.071 147 HB2 GLN 41 2HB GLN 41 -8.506 13.948 -15.574 148 HB3 GLN 41 3HB GLN 41 -8.699 15.527 -16.349 149 HG2 GLN 41 2HG GLN 41 -6.735 14.867 -14.118 150 HG3 GLN 41 3HG GLN 41 -6.335 15.107 -15.805 151 HE21 GLN 41 1HE2 GLN 41 -5.194 16.588 -13.582 152 HE22 GLN 41 2HE2 GLN 41 -5.728 18.251 -13.767 153 H LEU 42 H LEU 42 -11.127 13.375 -14.515 154 HA LEU 42 HA LEU 42 -13.064 14.567 -16.315 155 HB2 LEU 42 2HB LEU 42 -12.619 12.113 -16.173 156 HB3 LEU 42 3HB LEU 42 -13.353 12.117 -14.566 157 HG LEU 42 HG LEU 42 -15.498 12.912 -15.524 158 HD11 LEU 42 1HD1 LEU 42 -14.093 12.555 -18.222 159 HD12 LEU 42 2HD1 LEU 42 -14.753 14.077 -17.575 160 HD13 LEU 42 3HD1 LEU 42 -15.840 12.766 -18.008 161 HD21 LEU 42 1HD2 LEU 42 -14.358 10.367 -16.696 162 HD22 LEU 42 2HD2 LEU 42 -16.092 10.814 -16.711 163 HD23 LEU 42 3HD2 LEU 42 -15.257 10.586 -15.178 164 H ILE 43 H ILE 43 -12.855 14.124 -12.786 165 HA ILE 43 HA ILE 43 -15.479 15.012 -12.135 166 HB ILE 43 HB ILE 43 -12.857 14.626 -10.691 167 HG12 ILE 43 2HG1 ILE 43 -14.368 13.329 -9.186 168 HG13 ILE 43 3HG1 ILE 43 -15.748 13.829 -10.193 169 HG21 ILE 43 1HG2 ILE 43 -15.176 16.179 -9.478 170 HG22 ILE 43 2HG2 ILE 43 -13.819 15.472 -8.573 171 HG23 ILE 43 3HG2 ILE 43 -13.503 16.769 -9.710 172 HD11 ILE 43 1HD1 ILE 43 -13.462 11.964 -10.901 173 HD12 ILE 43 2HD1 ILE 43 -15.188 11.589 -10.771 174 HD13 ILE 43 3HD1 ILE 43 -14.614 12.580 -12.116 175 H ARG 44 H ARG 44 -12.525 16.856 -12.540 176 HA ARG 44 HA ARG 44 -13.781 19.376 -11.740 177 HB2 ARG 44 2HB ARG 44 -11.665 20.400 -12.074 178 HB3 ARG 44 3HB ARG 44 -11.495 18.839 -11.280 179 HG2 ARG 44 2HG ARG 44 -9.700 18.744 -12.657 180 HG3 ARG 44 3HG ARG 44 -10.932 17.867 -13.547 181 HD2 ARG 44 2HD ARG 44 -9.906 19.230 -15.159 182 HD3 ARG 44 3HD ARG 44 -11.421 20.050 -14.779 183 HE ARG 44 HE ARG 44 -10.172 21.661 -13.384 184 HH11 ARG 44 1HH1 ARG 44 -8.640 23.067 -13.387 185 HH12 ARG 44 2HH1 ARG 44 -7.129 22.864 -14.270 186 HH21 ARG 44 1HH2 ARG 44 -7.949 19.631 -15.316 187 HH22 ARG 44 2HH2 ARG 44 -6.800 20.935 -15.425 188 H GLN 45 H GLN 45 -13.712 17.660 -14.646 189 HA GLN 45 HA GLN 45 -14.334 19.814 -16.536 190 HB2 GLN 45 2HB GLN 45 -15.650 17.085 -16.367 191 HB3 GLN 45 3HB GLN 45 -15.725 18.177 -17.737 192 HG2 GLN 45 2HG GLN 45 -13.361 16.608 -16.760 193 HG3 GLN 45 3HG GLN 45 -14.280 16.328 -18.222 194 HE21 GLN 45 1HE2 GLN 45 -11.481 16.550 -18.217 195 HE22 GLN 45 2HE2 GLN 45 -11.078 17.985 -19.157 196 H ASN 46 H ASN 46 -16.182 18.120 -13.963 197 HA ASN 46 HA ASN 46 -18.639 19.656 -14.593 198 HB2 ASN 46 2HB ASN 46 -18.049 18.052 -12.090 199 HB3 ASN 46 3HB ASN 46 -19.619 18.557 -12.717 200 HD21 ASN 46 1HD2 ASN 46 -17.186 16.126 -12.779 201 HD22 ASN 46 2HD2 ASN 46 -18.114 15.064 -13.852 202 H LEU 47 H LEU 47 -16.180 19.455 -12.017 203 HA LEU 47 HA LEU 47 -17.148 21.868 -10.692 204 HB2 LEU 47 2HB LEU 47 -14.713 20.223 -10.029 205 HB3 LEU 47 3HB LEU 47 -15.652 21.304 -9.020 206 HG LEU 47 HG LEU 47 -16.584 18.666 -10.015 207 HD11 LEU 47 1HD1 LEU 47 -14.671 18.699 -8.518 208 HD12 LEU 47 2HD1 LEU 47 -16.114 18.055 -7.685 209 HD13 LEU 47 3HD1 LEU 47 -15.565 19.735 -7.394 210 HD21 LEU 47 1HD2 LEU 47 -17.901 20.663 -8.137 211 HD22 LEU 47 2HD2 LEU 47 -18.371 18.955 -8.237 212 HD23 LEU 47 3HD2 LEU 47 -18.567 20.026 -9.645 213 H LEU 48 H LEU 48 -16.726 23.147 -12.483 214 HA LEU 48 HA LEU 48 -14.043 23.767 -13.386 215 HB2 LEU 48 2HB LEU 48 -15.179 25.512 -14.776 216 HB3 LEU 48 3HB LEU 48 -15.721 23.862 -14.986 217 HG LEU 48 HG LEU 48 -17.759 24.273 -13.720 218 HD11 LEU 48 1HD1 LEU 48 -18.454 26.577 -13.091 219 HD12 LEU 48 2HD1 LEU 48 -16.826 27.168 -13.464 220 HD13 LEU 48 3HD1 LEU 48 -17.088 26.017 -12.118 221 HD21 LEU 48 1HD2 LEU 48 -18.850 25.745 -15.359 222 HD22 LEU 48 2HD2 LEU 48 -17.701 24.657 -16.152 223 HD23 LEU 48 3HD2 LEU 48 -17.260 26.361 -15.881 224 H VAL 49 H VAL 49 -14.250 24.143 -10.606 225 HA VAL 49 HA VAL 49 -14.621 27.049 -10.204 226 HB VAL 49 HB VAL 49 -14.368 25.012 -7.996 227 HG11 VAL 49 1HG1 VAL 49 -14.031 27.352 -7.279 228 HG12 VAL 49 2HG1 VAL 49 -15.490 27.854 -8.146 229 HG13 VAL 49 3HG1 VAL 49 -15.611 26.789 -6.721 230 HG21 VAL 49 1HG2 VAL 49 -16.859 25.092 -7.890 231 HG22 VAL 49 2HG2 VAL 49 -16.873 26.023 -9.401 232 HG23 VAL 49 3HG2 VAL 49 -16.272 24.348 -9.378 233 H GLU 50 H GLU 50 -12.280 24.704 -8.862 234 HA GLU 50 HA GLU 50 -10.053 24.717 -8.543 235 HB2 GLU 50 2HB GLU 50 -9.842 27.364 -10.019 236 HB3 GLU 50 3HB GLU 50 -8.560 26.246 -9.655 237 HG2 GLU 50 2HG GLU 50 -10.922 25.657 -11.504 238 HG3 GLU 50 3HG GLU 50 -9.308 26.121 -12.014 239 H ASP 51 H ASP 51 -11.343 28.029 -7.993 240 HA ASP 51 HA ASP 51 -9.452 28.863 -6.077 241 HB2 ASP 51 2HB ASP 51 -11.080 30.293 -7.304 242 HB3 ASP 51 3HB ASP 51 -12.392 29.616 -6.342 243 H SER 52 H SER 52 -12.261 26.807 -5.651 244 HA SER 52 HA SER 52 -12.078 26.757 -2.695 245 HB2 SER 52 2HB SER 52 -14.058 25.255 -2.950 246 HB3 SER 52 3HB SER 52 -14.285 26.859 -3.685 247 HG SER 52 HG SER 52 -14.985 25.070 -5.027 248 H PHE 53 H PHE 53 -10.384 25.182 -5.156 249 HA PHE 53 HA PHE 53 -10.236 22.566 -3.702 250 HB2 PHE 53 2HB PHE 53 -9.720 23.195 -6.610 251 HB3 PHE 53 3HB PHE 53 -9.734 21.604 -5.864 252 HD1 PHE 53 HD1 PHE 53 -12.285 22.041 -4.097 253 HD2 PHE 53 HD2 PHE 53 -11.394 22.851 -8.248 254 HE1 PHE 53 HE1 PHE 53 -14.667 21.766 -4.656 255 HE2 PHE 53 HE2 PHE 53 -13.785 22.559 -8.784 256 HZ PHE 53 HZ PHE 53 -15.418 21.994 -7.008 257 H ARG 54 H ARG 54 -8.325 25.183 -5.085 258 HA ARG 54 HA ARG 54 -5.781 23.729 -4.721 259 HB2 ARG 54 2HB ARG 54 -6.360 26.506 -5.804 260 HB3 ARG 54 3HB ARG 54 -4.813 25.659 -5.895 261 HG2 ARG 54 2HG ARG 54 -7.386 24.777 -7.260 262 HG3 ARG 54 3HG ARG 54 -6.055 25.624 -8.025 263 HD2 ARG 54 2HD ARG 54 -4.601 23.707 -7.761 264 HD3 ARG 54 3HD ARG 54 -5.809 22.876 -6.737 265 HE ARG 54 HE ARG 54 -7.134 23.500 -9.128 266 HH11 ARG 54 1HH1 ARG 54 -4.424 21.359 -8.288 267 HH12 ARG 54 2HH1 ARG 54 -4.807 20.274 -9.588 268 HH21 ARG 54 1HH2 ARG 54 -7.542 22.181 -10.678 269 HH22 ARG 54 2HH2 ARG 54 -6.596 20.716 -10.975 270 H GLY 55 H GLY 55 -3.957 24.887 -3.782 271 HA2 GLY 55 HA2 GLY 55 -2.827 26.113 -2.148 272 HA3 GLY 55 HA3 GLY 55 -4.348 26.949 -1.742 273 H LYS 56 H LYS 56 -5.922 24.767 -1.023 274 HA LYS 56 HA LYS 56 -4.715 23.768 1.520 275 HB2 LYS 56 2HB LYS 56 -7.035 23.046 2.043 276 HB3 LYS 56 3HB LYS 56 -6.848 24.771 1.801 277 HG2 LYS 56 2HG LYS 56 -8.896 24.102 0.834 278 HG3 LYS 56 3HG LYS 56 -7.835 24.569 -0.477 279 HD2 LYS 56 2HD LYS 56 -7.455 22.255 -1.097 280 HD3 LYS 56 3HD LYS 56 -8.287 21.651 0.344 281 HE2 LYS 56 2HE LYS 56 -9.515 23.326 -1.878 282 HE3 LYS 56 3HE LYS 56 -9.590 21.556 -1.802 283 HZ1 LYS 56 HZ1 LYS 56 -11.011 21.714 0.112 284 HZ2 LYS 56 HZ2 LYS 56 -11.569 22.810 -1.001 285 HZ3 LYS 56 HZ3 LYS 56 -10.751 23.324 0.297 286 H GLN 57 H GLN 57 -5.799 21.388 1.932 287 HA GLN 57 HA GLN 57 -4.936 19.692 -0.379 288 HB2 GLN 57 2HB GLN 57 -3.464 18.522 0.888 289 HB3 GLN 57 3HB GLN 57 -3.366 20.034 1.727 290 HG2 GLN 57 2HG GLN 57 -3.624 18.705 3.522 291 HG3 GLN 57 3HG GLN 57 -5.330 18.998 3.206 292 HE21 GLN 57 1HE2 GLN 57 -3.722 16.728 1.089 293 HE22 GLN 57 2HE2 GLN 57 -4.586 15.349 1.761 294 H CYS 58 H CYS 58 -5.821 17.547 -0.422 295 HA CYS 58 HA CYS 58 -7.860 16.752 1.460 296 HB2 CYS 58 2HB CYS 58 -9.241 18.224 0.060 297 HB3 CYS 58 3HB CYS 58 -8.607 17.450 -1.400 298 HG CYS 58 HG CYS 58 -10.293 15.895 1.001 299 H ARG 59 H ARG 59 -8.179 14.577 1.464 300 HA ARG 59 HA ARG 59 -7.153 12.974 -0.780 301 HB2 ARG 59 2HB ARG 59 -6.422 11.210 0.685 302 HB3 ARG 59 3HB ARG 59 -5.435 12.635 0.851 303 HG2 ARG 59 2HG ARG 59 -7.639 12.262 2.860 304 HG3 ARG 59 3HG ARG 59 -6.286 11.161 2.908 305 HD2 ARG 59 2HD ARG 59 -4.856 13.375 2.951 306 HD3 ARG 59 3HD ARG 59 -6.418 14.125 3.395 307 HE ARG 59 HE ARG 59 -5.794 11.756 4.960 308 HH11 ARG 59 1HH1 ARG 59 -5.200 15.257 4.900 309 HH12 ARG 59 2HH1 ARG 59 -4.667 15.263 6.557 310 HH21 ARG 59 1HH2 ARG 59 -5.213 11.881 7.095 311 HH22 ARG 59 2HH2 ARG 59 -4.718 13.394 7.787 312 H VAL 60 H VAL 60 -8.653 11.545 -1.548 313 HA VAL 60 HA VAL 60 -10.678 10.403 0.275 314 HB VAL 60 HB VAL 60 -12.583 10.834 -1.166 315 HG11 VAL 60 1HG1 VAL 60 -11.244 13.484 -0.515 316 HG12 VAL 60 2HG1 VAL 60 -12.978 13.173 -0.669 317 HG13 VAL 60 3HG1 VAL 60 -12.047 12.471 0.673 318 HG21 VAL 60 1HG2 VAL 60 -12.541 12.410 -3.022 319 HG22 VAL 60 2HG2 VAL 60 -10.800 12.642 -2.835 320 HG23 VAL 60 3HG2 VAL 60 -11.433 11.051 -3.347 321 H ASN 61 H ASN 61 -11.903 8.587 -1.055 322 HA ASN 61 HA ASN 61 -10.049 7.442 -3.046 323 HB2 ASN 61 2HB ASN 61 -9.491 6.509 -0.879 324 HB3 ASN 61 3HB ASN 61 -11.174 6.158 -0.531 325 HD21 ASN 61 1HD2 ASN 61 -12.264 4.497 -1.929 326 HD22 ASN 61 2HD2 ASN 61 -11.262 3.230 -2.624 327 H LEU 62 H LEU 62 -10.864 6.474 -4.740 328 HA LEU 62 HA LEU 62 -13.876 6.248 -4.962 329 HB2 LEU 62 2HB LEU 62 -11.663 7.030 -6.849 330 HB3 LEU 62 3HB LEU 62 -13.041 6.180 -7.499 331 HG LEU 62 HG LEU 62 -14.569 7.934 -6.780 332 HD11 LEU 62 1HD1 LEU 62 -13.650 10.118 -5.885 333 HD12 LEU 62 2HD1 LEU 62 -12.114 9.287 -5.591 334 HD13 LEU 62 3HD1 LEU 62 -13.574 8.781 -4.727 335 HD21 LEU 62 1HD2 LEU 62 -13.469 8.108 -8.966 336 HD22 LEU 62 2HD2 LEU 62 -12.086 8.956 -8.229 337 HD23 LEU 62 3HD2 LEU 62 -13.676 9.729 -8.287 338 H LYS 63 H LYS 63 -14.707 4.294 -5.157 339 HA LYS 63 HA LYS 63 -13.011 2.052 -6.187 340 HB2 LYS 63 2HB LYS 63 -15.439 1.927 -4.358 341 HB3 LYS 63 3HB LYS 63 -14.588 0.543 -5.069 342 HG2 LYS 63 2HG LYS 63 -12.475 1.353 -3.905 343 HG3 LYS 63 3HG LYS 63 -13.475 2.536 -3.048 344 HD2 LYS 63 2HD LYS 63 -13.777 -0.491 -2.938 345 HD3 LYS 63 3HD LYS 63 -13.017 0.523 -1.709 346 HE2 LYS 63 2HE LYS 63 -15.179 1.728 -1.373 347 HE3 LYS 63 3HE LYS 63 -15.944 0.662 -2.562 348 HZ1 LYS 63 HZ1 LYS 63 -14.723 -0.227 -0.003 349 HZ2 LYS 63 HZ2 LYS 63 -15.436 -1.217 -1.088 350 HZ3 LYS 63 HZ3 LYS 63 -16.327 -0.100 -0.300 351 H LEU 64 H LEU 64 -13.415 1.824 -8.357 352 HA LEU 64 HA LEU 64 -16.162 2.339 -9.335 353 HB2 LEU 64 2HB LEU 64 -13.594 1.973 -10.908 354 HB3 LEU 64 3HB LEU 64 -15.146 2.512 -11.514 355 HG LEU 64 HG LEU 64 -14.019 4.416 -11.519 356 HD11 LEU 64 1HD1 LEU 64 -15.195 4.615 -8.730 357 HD12 LEU 64 2HD1 LEU 64 -16.018 4.848 -10.295 358 HD13 LEU 64 3HD1 LEU 64 -14.740 5.960 -9.796 359 HD21 LEU 64 1HD2 LEU 64 -12.681 3.838 -8.858 360 HD22 LEU 64 2HD2 LEU 64 -12.410 5.235 -9.896 361 HD23 LEU 64 3HD2 LEU 64 -11.970 3.620 -10.489 362 H ILE 65 H ILE 65 -17.017 0.979 -10.922 363 HA ILE 65 HA ILE 65 -16.262 -1.916 -10.798 364 HB ILE 65 HB ILE 65 -18.417 -2.387 -11.801 365 HG12 ILE 65 2HG1 ILE 65 -18.941 0.603 -11.678 366 HG13 ILE 65 3HG1 ILE 65 -18.768 -0.371 -13.150 367 HG21 ILE 65 1HG2 ILE 65 -18.777 -0.608 -9.365 368 HG22 ILE 65 2HG2 ILE 65 -19.774 -1.994 -9.845 369 HG23 ILE 65 3HG2 ILE 65 -18.101 -2.242 -9.313 370 HD11 ILE 65 1HD1 ILE 65 -21.007 -0.475 -11.132 371 HD12 ILE 65 2HD1 ILE 65 -21.058 0.092 -12.813 372 HD13 ILE 65 3HD1 ILE 65 -20.804 -1.638 -12.476 373 HA PRO 66 HA PRO 66 -14.682 -1.478 -14.991 374 HB2 PRO 66 2HB PRO 66 -14.810 -4.032 -15.933 375 HB3 PRO 66 3HB PRO 66 -13.649 -3.514 -14.680 376 HG2 PRO 66 2HG PRO 66 -16.324 -4.897 -14.281 377 HG3 PRO 66 3HG PRO 66 -14.752 -5.329 -13.558 378 HD2 PRO 66 2HD PRO 66 -16.612 -3.812 -12.242 379 HD3 PRO 66 3HD PRO 66 -14.861 -3.531 -12.030 380 H THR 67 H THR 67 -15.530 -1.153 -17.036 381 HA THR 67 HA THR 67 -18.081 -2.082 -18.027 382 HB THR 67 HB THR 67 -17.892 0.625 -16.703 383 HG1 THR 67 HG1 THR 67 -18.933 -1.358 -15.902 384 HG21 THR 67 1HG2 THR 67 -19.955 1.334 -17.879 385 HG22 THR 67 2HG2 THR 67 -19.809 -0.055 -18.979 386 HG23 THR 67 3HG2 THR 67 -18.590 1.240 -18.986 387 H GLY 68 H GLY 68 -18.318 -1.574 -20.224 388 HA2 GLY 68 HA2 GLY 68 -15.841 -1.598 -21.589 389 HA3 GLY 68 HA3 GLY 68 -17.448 -1.510 -22.349 390 H THR 69 H THR 69 -17.772 1.194 -20.844 391 HA THR 69 HA THR 69 -16.415 2.943 -22.833 392 HB THR 69 HB THR 69 -17.989 4.674 -21.945 393 HG1 THR 69 HG1 THR 69 -19.607 3.967 -20.555 394 HG21 THR 69 1HG2 THR 69 -19.406 2.133 -22.840 395 HG22 THR 69 2HG2 THR 69 -18.597 3.288 -23.918 396 HG23 THR 69 3HG2 THR 69 -20.002 3.800 -22.967 397 H GLY 70 H GLY 70 -15.540 1.719 -19.941 398 HA2 GLY 70 HA2 GLY 70 -13.511 2.689 -18.805 399 HA3 GLY 70 HA3 GLY 70 -14.379 4.247 -18.817 400 H ALA 71 H ALA 71 -13.522 3.265 -16.360 401 HA ALA 71 HA ALA 71 -15.327 1.436 -15.135 402 HB1 ALA 71 1HB ALA 71 -14.038 1.814 -13.196 403 HB2 ALA 71 2HB ALA 71 -12.908 1.992 -14.514 404 HB3 ALA 71 3HB ALA 71 -13.547 3.445 -13.706 405 H LEU 72 H LEU 72 -16.808 1.897 -13.352 406 HA LEU 72 HA LEU 72 -18.218 4.542 -13.532 407 HB2 LEU 72 2HB LEU 72 -19.138 1.833 -14.172 408 HB3 LEU 72 3HB LEU 72 -20.061 2.481 -12.822 409 HG LEU 72 HG LEU 72 -20.753 4.421 -14.125 410 HD11 LEU 72 1HD1 LEU 72 -18.895 4.900 -15.505 411 HD12 LEU 72 2HD1 LEU 72 -20.202 4.438 -16.608 412 HD13 LEU 72 3HD1 LEU 72 -18.910 3.279 -16.250 413 HD21 LEU 72 1HD2 LEU 72 -21.113 1.810 -15.663 414 HD22 LEU 72 2HD2 LEU 72 -22.149 3.245 -15.774 415 HD23 LEU 72 3HD2 LEU 72 -22.067 2.334 -14.263 416 H LEU 73 H LEU 73 -18.983 5.440 -11.642 417 HA LEU 73 HA LEU 73 -17.739 4.705 -9.223 418 HB2 LEU 73 2HB LEU 73 -18.614 6.932 -9.895 419 HB3 LEU 73 3HB LEU 73 -20.242 6.397 -9.530 420 HG LEU 73 HG LEU 73 -19.081 7.838 -7.809 421 HD11 LEU 73 1HD1 LEU 73 -19.922 6.721 -5.860 422 HD12 LEU 73 2HD1 LEU 73 -19.958 5.159 -6.675 423 HD13 LEU 73 3HD1 LEU 73 -21.039 6.467 -7.201 424 HD21 LEU 73 1HD2 LEU 73 -17.504 5.338 -7.056 425 HD22 LEU 73 2HD2 LEU 73 -17.392 6.964 -6.356 426 HD23 LEU 73 3HD2 LEU 73 -16.829 6.671 -8.009 427 H GLY 74 H GLY 74 -17.891 2.999 -8.075 428 HA2 GLY 74 HA2 GLY 74 -20.488 1.598 -7.576 429 HA3 GLY 74 HA3 GLY 74 -18.837 0.995 -7.245 430 H SER 75 H SER 75 -17.686 3.123 -5.866 431 HA SER 75 HA SER 75 -19.500 4.062 -3.738 432 HB2 SER 75 2HB SER 75 -17.025 2.521 -2.895 433 HB3 SER 75 3HB SER 75 -18.334 3.114 -1.888 434 HG SER 75 HG SER 75 -19.697 1.507 -3.018 435 H LEU 76 H LEU 76 -18.636 5.796 -2.530 436 HA LEU 76 HA LEU 76 -15.881 6.700 -3.192 437 HB2 LEU 76 2HB LEU 76 -17.616 8.034 -4.394 438 HB3 LEU 76 3HB LEU 76 -18.318 8.513 -2.864 439 HG LEU 76 HG LEU 76 -15.363 9.011 -3.207 440 HD11 LEU 76 1HD1 LEU 76 -15.817 11.102 -4.513 441 HD12 LEU 76 2HD1 LEU 76 -17.500 10.548 -4.735 442 HD13 LEU 76 3HD1 LEU 76 -16.153 9.619 -5.415 443 HD21 LEU 76 1HD2 LEU 76 -15.898 11.132 -2.064 444 HD22 LEU 76 2HD2 LEU 76 -16.530 9.766 -1.144 445 HD23 LEU 76 3HD2 LEU 76 -17.633 10.745 -2.129 446 H THR 77 H THR 77 -14.662 7.025 -1.492 447 HA THR 77 HA THR 77 -15.826 7.106 1.284 448 HB THR 77 HB THR 77 -13.232 5.914 0.205 449 HG1 THR 77 HG1 THR 77 -15.531 4.723 1.392 450 HG21 THR 77 1HG2 THR 77 -12.798 6.749 2.449 451 HG22 THR 77 2HG2 THR 77 -12.930 4.991 2.496 452 HG23 THR 77 3HG2 THR 77 -14.295 5.997 3.058 453 H VAL 78 H VAL 78 -15.489 9.093 2.221 454 HA VAL 78 HA VAL 78 -13.284 10.821 1.281 455 HB VAL 78 HB VAL 78 -14.032 12.470 2.911 456 HG11 VAL 78 1HG1 VAL 78 -16.099 13.111 1.744 457 HG12 VAL 78 2HG1 VAL 78 -14.891 12.520 0.601 458 HG13 VAL 78 3HG1 VAL 78 -16.252 11.481 1.063 459 HG21 VAL 78 1HG2 VAL 78 -15.062 11.068 4.642 460 HG22 VAL 78 2HG2 VAL 78 -16.224 12.241 4.035 461 HG23 VAL 78 3HG2 VAL 78 -16.321 10.552 3.504 462 H LEU 79 H LEU 79 -11.361 11.180 2.365 463 HA LEU 79 HA LEU 79 -10.887 9.515 4.821 464 HB2 LEU 79 2HB LEU 79 -8.914 10.448 2.720 465 HB3 LEU 79 3HB LEU 79 -8.528 9.488 4.134 466 HG LEU 79 HG LEU 79 -10.349 8.576 1.856 467 HD11 LEU 79 1HD1 LEU 79 -8.430 7.167 1.167 468 HD12 LEU 79 2HD1 LEU 79 -7.431 7.925 2.418 469 HD13 LEU 79 3HD1 LEU 79 -8.066 8.895 1.070 470 HD21 LEU 79 1HD2 LEU 79 -10.052 6.316 2.838 471 HD22 LEU 79 2HD2 LEU 79 -10.853 7.408 3.982 472 HD23 LEU 79 3HD2 LEU 79 -9.129 7.018 4.183 473 H ASP 80 H ASP 80 -9.946 12.638 3.266 474 HA ASP 80 HA ASP 80 -10.745 14.185 5.482 475 HB2 ASP 80 2HB ASP 80 -8.286 13.051 6.116 476 HB3 ASP 80 3HB ASP 80 -7.790 14.524 5.325 477 H GLY 81 H GLY 81 -9.987 16.506 5.256 478 HA2 GLY 81 HA2 GLY 81 -8.436 17.743 3.463 479 HA3 GLY 81 HA3 GLY 81 -9.820 17.378 2.446 480 H ASP 82 H ASP 82 -9.490 19.844 2.406 481 HA ASP 82 HA ASP 82 -11.084 21.221 4.493 482 HB2 ASP 82 2HB ASP 82 -9.200 22.441 3.574 483 HB3 ASP 82 3HB ASP 82 -9.756 22.142 1.946 484 H SER 83 H SER 83 -13.174 20.902 4.399 485 HA SER 83 HA SER 83 -14.235 18.952 2.920 486 HB2 SER 83 2HB SER 83 -15.869 21.143 4.259 487 HB3 SER 83 3HB SER 83 -16.372 19.466 3.967 488 HG SER 83 HG SER 83 -15.607 19.773 6.131 489 H ARG 84 H ARG 84 -14.258 22.252 1.822 490 HA ARG 84 HA ARG 84 -16.374 22.371 -0.018 491 HB2 ARG 84 2HB ARG 84 -13.505 23.354 -0.368 492 HB3 ARG 84 3HB ARG 84 -14.906 23.895 -1.306 493 HG2 ARG 84 2HG ARG 84 -15.922 24.858 0.716 494 HG3 ARG 84 3HG ARG 84 -14.558 24.303 1.701 495 HD2 ARG 84 2HD ARG 84 -13.009 25.675 0.321 496 HD3 ARG 84 3HD ARG 84 -14.372 26.232 -0.648 497 HE ARG 84 HE ARG 84 -15.054 27.646 1.063 498 HH11 ARG 84 1HH1 ARG 84 -12.451 25.592 2.373 499 HH12 ARG 84 2HH1 ARG 84 -12.304 26.575 3.793 500 HH21 ARG 84 1HH2 ARG 84 -14.759 28.872 2.900 501 HH22 ARG 84 2HH2 ARG 84 -13.569 28.413 4.078 502 H LEU 85 H LEU 85 -13.235 20.566 -0.380 503 HA LEU 85 HA LEU 85 -13.884 19.959 -3.198 504 HB2 LEU 85 2HB LEU 85 -11.608 20.400 -2.565 505 HB3 LEU 85 3HB LEU 85 -11.617 19.084 -1.390 506 HG LEU 85 HG LEU 85 -11.602 17.422 -3.049 507 HD11 LEU 85 1HD1 LEU 85 -12.062 19.506 -5.235 508 HD12 LEU 85 2HD1 LEU 85 -13.245 18.283 -4.729 509 HD13 LEU 85 3HD1 LEU 85 -11.738 17.785 -5.486 510 HD21 LEU 85 1HD2 LEU 85 -9.886 19.664 -4.213 511 HD22 LEU 85 2HD2 LEU 85 -9.558 17.916 -4.241 512 HD23 LEU 85 3HD2 LEU 85 -9.488 18.829 -2.719 513 H CYS 86 H CYS 86 -13.531 17.941 -0.192 514 HA CYS 86 HA CYS 86 -14.581 15.559 -0.985 515 HB2 CYS 86 2HB CYS 86 -15.347 17.012 1.588 516 HB3 CYS 86 3HB CYS 86 -15.403 15.266 1.290 517 HG CYS 86 HG CYS 86 -13.367 15.774 2.859 518 H ALA 87 H ALA 87 -16.625 18.392 -0.074 519 HA ALA 87 HA ALA 87 -19.121 17.043 -0.454 520 HB1 ALA 87 1HB ALA 87 -20.047 19.346 -0.322 521 HB2 ALA 87 2HB ALA 87 -18.820 19.078 0.932 522 HB3 ALA 87 3HB ALA 87 -18.406 20.021 -0.512 523 H ALA 88 H ALA 88 -17.192 19.059 -2.698 524 HA ALA 88 HA ALA 88 -19.205 19.086 -4.772 525 HB1 ALA 88 1HB ALA 88 -16.240 19.845 -4.793 526 HB2 ALA 88 2HB ALA 88 -17.450 20.321 -5.990 527 HB3 ALA 88 3HB ALA 88 -17.588 20.916 -4.335 528 H THR 89 H THR 89 -16.074 17.330 -4.434 529 HA THR 89 HA THR 89 -16.172 15.982 -6.958 530 HB THR 89 HB THR 89 -14.162 16.142 -5.516 531 HG1 THR 89 HG1 THR 89 -13.510 14.049 -6.116 532 HG21 THR 89 1HG2 THR 89 -15.180 13.703 -4.021 533 HG22 THR 89 2HG2 THR 89 -15.328 15.328 -3.356 534 HG23 THR 89 3HG2 THR 89 -13.717 14.683 -3.712 535 H LYS 90 H LYS 90 -17.417 15.025 -3.815 536 HA LYS 90 HA LYS 90 -18.372 12.450 -4.279 537 HB2 LYS 90 2HB LYS 90 -18.184 13.531 -2.129 538 HB3 LYS 90 3HB LYS 90 -19.338 14.780 -2.601 539 HG2 LYS 90 2HG LYS 90 -20.917 12.544 -2.821 540 HG3 LYS 90 3HG LYS 90 -19.772 12.022 -1.579 541 HD2 LYS 90 2HD LYS 90 -21.332 14.637 -1.557 542 HD3 LYS 90 3HD LYS 90 -21.862 13.189 -0.713 543 HE2 LYS 90 2HE LYS 90 -19.198 14.606 -0.177 544 HE3 LYS 90 3HE LYS 90 -20.693 14.937 0.714 545 HZ1 LYS 90 HZ1 LYS 90 -19.326 13.358 1.906 546 HZ2 LYS 90 HZ2 LYS 90 -19.311 12.320 0.632 547 HZ3 LYS 90 HZ3 LYS 90 -20.701 12.622 1.444 548 H ARG 91 H ARG 91 -19.981 15.552 -4.989 549 HA ARG 91 HA ARG 91 -22.338 14.288 -6.137 550 HB2 ARG 91 2HB ARG 91 -21.341 17.126 -6.630 551 HB3 ARG 91 3HB ARG 91 -22.941 16.497 -6.997 552 HG2 ARG 91 2HG ARG 91 -21.760 17.221 -4.334 553 HG3 ARG 91 3HG ARG 91 -23.243 17.784 -5.095 554 HD2 ARG 91 2HD ARG 91 -24.103 15.372 -4.830 555 HD3 ARG 91 3HD ARG 91 -22.740 15.114 -3.732 556 HE ARG 91 HE ARG 91 -25.208 16.378 -3.140 557 HH11 ARG 91 1HH1 ARG 91 -21.794 17.074 -2.376 558 HH12 ARG 91 2HH1 ARG 91 -22.236 17.754 -0.837 559 HH21 ARG 91 1HH2 ARG 91 -25.644 17.317 -1.205 560 HH22 ARG 91 2HH2 ARG 91 -24.360 17.933 -0.206 561 H ALA 92 H ALA 92 -19.413 15.717 -7.616 562 HA ALA 92 HA ALA 92 -20.181 15.393 -10.331 563 HB1 ALA 92 1HB ALA 92 -17.764 15.695 -10.783 564 HB2 ALA 92 2HB ALA 92 -18.389 16.859 -9.603 565 HB3 ALA 92 3HB ALA 92 -17.425 15.485 -9.049 566 H VAL 93 H VAL 93 -18.183 13.213 -8.275 567 HA VAL 93 HA VAL 93 -17.830 11.224 -10.248 568 HB VAL 93 HB VAL 93 -17.980 10.411 -7.344 569 HG11 VAL 93 1HG1 VAL 93 -16.200 8.934 -7.941 570 HG12 VAL 93 2HG1 VAL 93 -17.401 8.798 -9.229 571 HG13 VAL 93 3HG1 VAL 93 -15.941 9.758 -9.497 572 HG21 VAL 93 1HG2 VAL 93 -16.251 12.526 -8.424 573 HG22 VAL 93 2HG2 VAL 93 -16.583 12.043 -6.750 574 HG23 VAL 93 3HG2 VAL 93 -15.324 11.227 -7.681 575 H ALA 94 H ALA 94 -20.577 11.889 -8.244 576 HA ALA 94 HA ALA 94 -21.873 9.275 -8.601 577 HB1 ALA 94 1HB ALA 94 -23.718 10.292 -7.340 578 HB2 ALA 94 2HB ALA 94 -22.171 10.575 -6.525 579 HB3 ALA 94 3HB ALA 94 -22.949 11.883 -7.440 580 H GLN 95 H GLN 95 -21.395 11.946 -10.634 581 HA GLN 95 HA GLN 95 -23.797 11.241 -12.286 582 HB2 GLN 95 2HB GLN 95 -24.263 13.570 -12.647 583 HB3 GLN 95 3HB GLN 95 -24.236 13.207 -10.924 584 HG2 GLN 95 2HG GLN 95 -23.039 15.232 -10.982 585 HG3 GLN 95 3HG GLN 95 -21.815 14.058 -10.935 586 HE21 GLN 95 1HE2 GLN 95 -20.232 14.196 -12.551 587 HE22 GLN 95 2HE2 GLN 95 -20.413 15.258 -13.956 588 H VAL 96 H VAL 96 -20.363 11.713 -12.321 589 HA VAL 96 HA VAL 96 -19.930 12.366 -15.035 590 HB VAL 96 HB VAL 96 -17.825 10.997 -14.812 591 HG11 VAL 96 1HG1 VAL 96 -16.687 12.535 -13.395 592 HG12 VAL 96 2HG1 VAL 96 -17.938 13.419 -14.281 593 HG13 VAL 96 3HG1 VAL 96 -18.160 12.984 -12.560 594 HG21 VAL 96 1HG2 VAL 96 -18.945 10.444 -12.058 595 HG22 VAL 96 2HG2 VAL 96 -18.316 9.298 -13.251 596 HG23 VAL 96 3HG2 VAL 96 -17.236 10.437 -12.406 597 H ASN 97 H ASN 97 -19.549 11.170 -16.910 598 HA ASN 97 HA ASN 97 -21.435 9.106 -17.387 599 HB2 ASN 97 2HB ASN 97 -20.652 10.868 -18.992 600 HB3 ASN 97 3HB ASN 97 -19.118 10.018 -19.142 601 HD21 ASN 97 1HD2 ASN 97 -19.201 7.749 -20.116 602 HD22 ASN 97 2HD2 ASN 97 -20.544 7.388 -21.183 603 H SER 98 H SER 98 -17.859 8.947 -17.265 604 HA SER 98 HA SER 98 -17.439 6.366 -16.309 605 HB2 SER 98 2HB SER 98 -16.707 5.230 -18.445 606 HB3 SER 98 3HB SER 98 -18.458 5.329 -18.235 607 HG SER 98 HG SER 98 -17.110 6.092 -20.312 608 H PHE 99 H PHE 99 -15.261 5.917 -16.132 609 HA PHE 99 HA PHE 99 -13.480 8.197 -16.702 610 HB2 PHE 99 2HB PHE 99 -12.982 5.734 -15.023 611 HB3 PHE 99 3HB PHE 99 -12.075 7.245 -15.017 612 HD1 PHE 99 HD1 PHE 99 -14.841 5.424 -13.565 613 HD2 PHE 99 HD2 PHE 99 -13.340 9.410 -14.296 614 HE1 PHE 99 HE1 PHE 99 -16.418 6.331 -11.904 615 HE2 PHE 99 HE2 PHE 99 -14.896 10.301 -12.599 616 HZ PHE 99 HZ PHE 99 -16.424 8.726 -11.382 617 HA PRO 100 HA PRO 100 -12.038 5.497 -20.059 618 HB2 PRO 100 2HB PRO 100 -10.608 7.284 -21.553 619 HB3 PRO 100 3HB PRO 100 -12.394 7.253 -21.517 620 HG2 PRO 100 2HG PRO 100 -10.529 9.040 -19.926 621 HG3 PRO 100 3HG PRO 100 -11.987 9.520 -20.853 622 HD2 PRO 100 2HD PRO 100 -12.060 9.102 -18.159 623 HD3 PRO 100 3HD PRO 100 -13.437 8.681 -19.224 624 H LEU 101 H LEU 101 -10.208 4.215 -20.171 625 HA LEU 101 HA LEU 101 -8.274 4.605 -18.059 626 HB2 LEU 101 2HB LEU 101 -8.202 2.346 -20.065 627 HB3 LEU 101 3HB LEU 101 -7.672 2.351 -18.396 628 HG LEU 101 HG LEU 101 -10.515 2.356 -19.429 629 HD11 LEU 101 1HD1 LEU 101 -8.897 0.267 -17.946 630 HD12 LEU 101 2HD1 LEU 101 -9.386 0.220 -19.652 631 HD13 LEU 101 3HD1 LEU 101 -10.621 0.118 -18.394 632 HD21 LEU 101 1HD2 LEU 101 -9.608 2.287 -16.529 633 HD22 LEU 101 2HD2 LEU 101 -11.276 2.113 -17.088 634 HD23 LEU 101 3HD2 LEU 101 -10.431 3.650 -17.288 635 HA PRO 102 HA PRO 102 -4.747 5.757 -20.683 636 HB2 PRO 102 2HB PRO 102 -2.648 5.042 -19.115 637 HB3 PRO 102 3HB PRO 102 -3.706 6.437 -18.738 638 HG2 PRO 102 2HG PRO 102 -3.805 3.655 -17.557 639 HG3 PRO 102 3HG PRO 102 -3.905 5.222 -16.711 640 HD2 PRO 102 2HD PRO 102 -6.110 3.716 -17.426 641 HD3 PRO 102 3HD PRO 102 -6.150 5.496 -17.302 642 H LYS 103 H LYS 103 -4.911 2.554 -19.095 643 HA LYS 103 HA LYS 103 -4.092 1.143 -21.568 644 HB2 LYS 103 2HB LYS 103 -2.841 0.818 -18.816 645 HB3 LYS 103 3HB LYS 103 -2.923 -0.511 -19.960 646 HG2 LYS 103 2HG LYS 103 -0.808 0.258 -20.332 647 HG3 LYS 103 3HG LYS 103 -1.725 0.963 -21.650 648 HD2 LYS 103 2HD LYS 103 -0.193 2.631 -20.848 649 HD3 LYS 103 3HD LYS 103 -1.811 3.117 -20.389 650 HE2 LYS 103 2HE LYS 103 -0.352 3.623 -18.567 651 HE3 LYS 103 3HE LYS 103 -1.412 2.301 -18.071 652 HZ1 LYS 103 HZ1 LYS 103 1.009 2.065 -17.488 653 HZ2 LYS 103 HZ2 LYS 103 1.349 1.874 -19.064 654 HZ3 LYS 103 HZ3 LYS 103 0.392 0.778 -18.302 655 H ASP 104 H ASP 104 -5.010 -0.932 -21.748 656 HA ASP 104 HA ASP 104 -7.591 -1.140 -20.331 657 HB2 ASP 104 2HB ASP 104 -8.489 -1.793 -22.387 658 HB3 ASP 104 3HB ASP 104 -7.384 -0.487 -22.789 659 H GLN 105 H GLN 105 -4.906 -2.786 -19.702 660 HA GLN 105 HA GLN 105 -5.670 -5.448 -20.578 661 HB2 GLN 105 2HB GLN 105 -3.327 -4.582 -18.842 662 HB3 GLN 105 3HB GLN 105 -3.642 -6.203 -19.405 663 HG2 GLN 105 2HG GLN 105 -2.119 -5.554 -20.994 664 HG3 GLN 105 3HG GLN 105 -3.611 -5.129 -21.820 665 HE21 GLN 105 1HE2 GLN 105 -3.923 -2.845 -22.363 666 HE22 GLN 105 2HE2 GLN 105 -2.714 -1.663 -21.886 667 HA PRO 106 HA PRO 106 -7.951 -6.412 -16.878 668 HB2 PRO 106 2HB PRO 106 -7.723 -9.155 -16.721 669 HB3 PRO 106 3HB PRO 106 -8.713 -8.316 -17.948 670 HG2 PRO 106 2HG PRO 106 -5.869 -9.341 -18.247 671 HG3 PRO 106 3HG PRO 106 -7.271 -9.617 -19.336 672 HD2 PRO 106 2HD PRO 106 -5.468 -7.671 -19.856 673 HD3 PRO 106 3HD PRO 106 -7.220 -7.371 -20.120 674 H ASP 107 H ASP 107 -4.594 -6.580 -16.990 675 HA ASP 107 HA ASP 107 -4.257 -7.361 -14.137 676 HB2 ASP 107 2HB ASP 107 -2.580 -8.041 -15.875 677 HB3 ASP 107 3HB ASP 107 -2.241 -6.330 -16.165 678 H VAL 108 H VAL 108 -4.408 -4.477 -16.209 679 HA VAL 108 HA VAL 108 -3.608 -2.718 -13.947 680 HB VAL 108 HB VAL 108 -3.354 -0.947 -15.491 681 HG11 VAL 108 1HG1 VAL 108 -1.490 -1.751 -16.850 682 HG12 VAL 108 2HG1 VAL 108 -1.455 -2.531 -15.264 683 HG13 VAL 108 3HG1 VAL 108 -2.041 -3.428 -16.685 684 HG21 VAL 108 1HG2 VAL 108 -5.177 -1.370 -17.083 685 HG22 VAL 108 2HG2 VAL 108 -3.630 -1.109 -17.886 686 HG23 VAL 108 3HG2 VAL 108 -4.260 -2.751 -17.737 687 H VAL 109 H VAL 109 -6.425 -3.515 -15.965 688 HA VAL 109 HA VAL 109 -8.189 -1.463 -15.153 689 HB VAL 109 HB VAL 109 -8.646 -4.414 -15.740 690 HG11 VAL 109 1HG1 VAL 109 -10.604 -3.739 -14.450 691 HG12 VAL 109 2HG1 VAL 109 -10.775 -2.255 -15.411 692 HG13 VAL 109 3HG1 VAL 109 -11.054 -3.850 -16.144 693 HG21 VAL 109 1HG2 VAL 109 -9.327 -1.954 -17.430 694 HG22 VAL 109 2HG2 VAL 109 -7.812 -2.843 -17.619 695 HG23 VAL 109 3HG2 VAL 109 -9.362 -3.640 -17.940 696 H GLU 110 H GLU 110 -6.848 -4.116 -13.324 697 HA GLU 110 HA GLU 110 -8.730 -3.968 -11.093 698 HB2 GLU 110 2HB GLU 110 -6.109 -5.421 -11.465 699 HB3 GLU 110 3HB GLU 110 -7.175 -5.628 -10.073 700 HG2 GLU 110 2HG GLU 110 -7.919 -6.213 -12.975 701 HG3 GLU 110 3HG GLU 110 -7.513 -7.378 -11.733 702 H LYS 111 H LYS 111 -6.080 -2.033 -11.971 703 HA LYS 111 HA LYS 111 -5.307 -1.385 -9.156 704 HB2 LYS 111 2HB LYS 111 -3.976 -1.028 -11.851 705 HB3 LYS 111 3HB LYS 111 -3.522 0.010 -10.506 706 HG2 LYS 111 2HG LYS 111 -2.055 -1.966 -10.812 707 HG3 LYS 111 3HG LYS 111 -2.717 -1.788 -9.192 708 HD2 LYS 111 2HD LYS 111 -4.236 -3.578 -9.452 709 HD3 LYS 111 3HD LYS 111 -4.032 -3.646 -11.203 710 HE2 LYS 111 2HE LYS 111 -1.796 -4.224 -9.216 711 HE3 LYS 111 3HE LYS 111 -2.919 -5.459 -9.787 712 HZ1 LYS 111 HZ1 LYS 111 -0.950 -5.483 -11.161 713 HZ2 LYS 111 HZ2 LYS 111 -1.110 -3.892 -11.543 714 HZ3 LYS 111 HZ3 LYS 111 -2.212 -4.971 -12.074 715 H LEU 112 H LEU 112 -6.509 0.113 -12.108 716 HA LEU 112 HA LEU 112 -6.727 2.762 -10.939 717 HB2 LEU 112 2HB LEU 112 -7.702 3.408 -13.138 718 HB3 LEU 112 3HB LEU 112 -6.162 2.641 -13.182 719 HG LEU 112 HG LEU 112 -7.208 0.549 -13.703 720 HD11 LEU 112 1HD1 LEU 112 -9.733 2.031 -14.271 721 HD12 LEU 112 2HD1 LEU 112 -9.458 0.700 -13.119 722 HD13 LEU 112 3HD1 LEU 112 -9.373 0.397 -14.843 723 HD21 LEU 112 1HD2 LEU 112 -6.019 1.757 -15.379 724 HD22 LEU 112 2HD2 LEU 112 -7.470 2.712 -15.769 725 HD23 LEU 112 3HD2 LEU 112 -7.404 0.963 -16.118 726 H LYS 113 H LYS 113 -8.837 0.022 -10.962 727 HA LYS 113 HA LYS 113 -11.318 1.396 -10.588 728 HB2 LYS 113 2HB LYS 113 -12.047 -0.766 -9.558 729 HB3 LYS 113 3HB LYS 113 -11.318 -0.947 -11.155 730 HG2 LYS 113 2HG LYS 113 -9.306 -1.803 -10.273 731 HG3 LYS 113 3HG LYS 113 -9.651 -1.264 -8.628 732 HD2 LYS 113 2HD LYS 113 -9.810 -3.739 -9.055 733 HD3 LYS 113 3HD LYS 113 -11.166 -2.983 -8.214 734 HE2 LYS 113 2HE LYS 113 -12.537 -2.972 -10.193 735 HE3 LYS 113 3HE LYS 113 -11.174 -3.492 -11.204 736 HZ1 LYS 113 HZ1 LYS 113 -12.412 -5.140 -9.054 737 HZ2 LYS 113 HZ2 LYS 113 -11.167 -5.602 -10.021 738 HZ3 LYS 113 HZ3 LYS 113 -12.634 -5.355 -10.663 739 H ASN 114 H ASN 114 -8.686 0.847 -8.354 740 HA ASN 114 HA ASN 114 -10.341 1.977 -6.137 741 HB2 ASN 114 2HB ASN 114 -8.223 -0.136 -5.728 742 HB3 ASN 114 3HB ASN 114 -9.367 0.541 -4.563 743 HD21 ASN 114 1HD2 ASN 114 -11.772 0.298 -6.271 744 HD22 ASN 114 2HD2 ASN 114 -12.082 -1.429 -6.353 745 H ILE 115 H ILE 115 -9.528 4.055 -6.661 746 HA ILE 115 HA ILE 115 -6.615 4.473 -6.182 747 HB ILE 115 HB ILE 115 -6.780 6.576 -7.344 748 HG12 ILE 115 2HG1 ILE 115 -9.228 6.971 -6.978 749 HG13 ILE 115 3HG1 ILE 115 -8.585 7.371 -8.527 750 HG21 ILE 115 1HG2 ILE 115 -7.494 4.106 -8.937 751 HG22 ILE 115 2HG2 ILE 115 -6.901 5.625 -9.648 752 HG23 ILE 115 3HG2 ILE 115 -5.888 4.708 -8.515 753 HD11 ILE 115 1HD1 ILE 115 -10.268 4.932 -7.959 754 HD12 ILE 115 2HD1 ILE 115 -10.729 6.400 -8.854 755 HD13 ILE 115 3HD1 ILE 115 -9.502 5.313 -9.498 756 H ASN 116 H ASN 116 -5.901 6.105 -4.893 757 HA ASN 116 HA ASN 116 -7.960 7.603 -3.348 758 HB2 ASN 116 2HB ASN 116 -5.035 8.095 -2.954 759 HB3 ASN 116 3HB ASN 116 -6.422 8.344 -1.871 760 HD21 ASN 116 1HD2 ASN 116 -7.524 5.648 -1.855 761 HD22 ASN 116 2HD2 ASN 116 -6.327 4.657 -1.085 762 H LEU 117 H LEU 117 -8.482 9.573 -3.982 763 HA LEU 117 HA LEU 117 -6.804 11.080 -5.960 764 HB2 LEU 117 2HB LEU 117 -9.375 11.971 -4.610 765 HB3 LEU 117 3HB LEU 117 -8.540 12.757 -5.944 766 HG LEU 117 HG LEU 117 -10.068 10.111 -5.971 767 HD11 LEU 117 1HD1 LEU 117 -10.558 12.747 -7.432 768 HD12 LEU 117 2HD1 LEU 117 -11.444 12.168 -6.006 769 HD13 LEU 117 3HD1 LEU 117 -11.558 11.289 -7.539 770 HD21 LEU 117 1HD2 LEU 117 -9.650 9.996 -8.406 771 HD22 LEU 117 2HD2 LEU 117 -8.168 9.801 -7.468 772 HD23 LEU 117 3HD2 LEU 117 -8.507 11.348 -8.266 773 H THR 118 H THR 118 -5.320 12.481 -5.121 774 HA THR 118 HA THR 118 -5.683 13.565 -2.400 775 HB THR 118 HB THR 118 -3.176 12.036 -3.176 776 HG1 THR 118 HG1 THR 118 -5.538 11.354 -1.971 777 HG21 THR 118 1HG2 THR 118 -4.040 13.515 -0.655 778 HG22 THR 118 2HG2 THR 118 -2.615 13.860 -1.659 779 HG23 THR 118 3HG2 THR 118 -2.679 12.367 -0.711 780 H VAL 119 H VAL 119 -5.178 15.612 -2.345 781 HA VAL 119 HA VAL 119 -3.483 16.827 -4.486 782 HB VAL 119 HB VAL 119 -5.086 18.530 -4.860 783 HG11 VAL 119 1HG1 VAL 119 -6.689 15.951 -4.838 784 HG12 VAL 119 2HG1 VAL 119 -6.939 17.371 -5.889 785 HG13 VAL 119 3HG1 VAL 119 -5.481 16.380 -6.085 786 HG21 VAL 119 1HG2 VAL 119 -7.269 18.706 -3.828 787 HG22 VAL 119 2HG2 VAL 119 -6.925 17.322 -2.782 788 HG23 VAL 119 3HG2 VAL 119 -6.022 18.849 -2.594 789 H ALA 120 H ALA 120 -2.712 18.933 -4.012 790 HA ALA 120 HA ALA 120 -2.843 20.214 -1.463 791 HB1 ALA 120 1HB ALA 120 -1.539 18.418 -0.569 792 HB2 ALA 120 2HB ALA 120 -0.416 18.431 -1.931 793 HB3 ALA 120 3HB ALA 120 -0.435 19.777 -0.774 794 HA PRO 121 HA PRO 121 -0.829 18.802 -4.556 795 HB2 PRO 121 2HB PRO 121 0.903 19.405 -6.512 796 HB3 PRO 121 3HB PRO 121 -0.836 19.830 -6.652 797 HG2 PRO 121 2HG PRO 121 1.473 21.606 -5.761 798 HG3 PRO 121 3HG PRO 121 0.221 21.965 -6.993 799 HD2 PRO 121 2HD PRO 121 0.037 22.792 -4.382 800 HD3 PRO 121 3HD PRO 121 -1.402 22.392 -5.351 801 H GLU 122 H GLU 122 1.182 17.496 -4.785 802 HA GLU 122 HA GLU 122 2.913 17.824 -2.488 803 HB2 GLU 122 2HB GLU 122 2.101 15.643 -3.331 804 HB3 GLU 122 3HB GLU 122 3.073 15.846 -4.790 805 HG2 GLU 122 2HG GLU 122 5.138 15.883 -3.371 806 HG3 GLU 122 3HG GLU 122 4.136 15.749 -1.916 Start of MODEL 6 1 H1 ALA 22 H ALA 22 16.775 4.601 -13.619 2 HA ALA 22 HA ALA 22 14.262 3.708 -14.772 3 HB1 ALA 22 1HB ALA 22 15.213 1.510 -15.508 4 HB2 ALA 22 2HB ALA 22 15.727 2.876 -16.520 5 HB3 ALA 22 3HB ALA 22 16.845 2.187 -15.325 6 H ALA 23 H ALA 23 13.152 2.531 -13.311 7 HA ALA 23 HA ALA 23 14.294 1.320 -10.957 8 HB1 ALA 23 1HB ALA 23 14.777 3.767 -10.573 9 HB2 ALA 23 2HB ALA 23 13.041 4.080 -10.630 10 HB3 ALA 23 3HB ALA 23 13.722 3.045 -9.355 11 H ARG 24 H ARG 24 12.707 0.959 -9.295 12 HA ARG 24 HA ARG 24 9.882 0.750 -10.001 13 HB2 ARG 24 2HB ARG 24 9.755 -1.638 -9.987 14 HB3 ARG 24 3HB ARG 24 10.812 -1.098 -11.270 15 HG2 ARG 24 2HG ARG 24 11.687 -2.351 -8.631 16 HG3 ARG 24 3HG ARG 24 11.549 -3.172 -10.169 17 HD2 ARG 24 2HD ARG 24 13.271 -1.679 -11.152 18 HD3 ARG 24 3HD ARG 24 13.506 -0.921 -9.563 19 HE ARG 24 HE ARG 24 13.842 -3.595 -9.049 20 HH11 ARG 24 1HH1 ARG 24 15.413 -1.371 -11.330 21 HH12 ARG 24 2HH1 ARG 24 16.912 -2.253 -11.257 22 HH21 ARG 24 1HH2 ARG 24 15.864 -4.632 -9.001 23 HH22 ARG 24 2HH2 ARG 24 17.166 -3.990 -9.968 24 H GLN 25 H GLN 25 11.677 1.801 -7.779 25 HA GLN 25 HA GLN 25 10.691 0.268 -5.395 26 HB2 GLN 25 2HB GLN 25 12.700 2.516 -5.438 27 HB3 GLN 25 3HB GLN 25 12.388 1.375 -4.157 28 HG2 GLN 25 2HG GLN 25 13.676 0.700 -6.846 29 HG3 GLN 25 3HG GLN 25 14.525 0.965 -5.341 30 HE21 GLN 25 1HE2 GLN 25 12.744 -1.342 -7.275 31 HE22 GLN 25 2HE2 GLN 25 12.843 -2.665 -6.122 32 H GLN 26 H GLN 26 10.190 3.122 -7.190 33 HA GLN 26 HA GLN 26 8.542 4.473 -5.122 34 HB2 GLN 26 2HB GLN 26 9.741 6.494 -5.438 35 HB3 GLN 26 3HB GLN 26 10.872 5.233 -4.973 36 HG2 GLN 26 2HG GLN 26 10.456 6.255 -7.819 37 HG3 GLN 26 3HG GLN 26 11.752 6.754 -6.747 38 HE21 GLN 26 1HE2 GLN 26 13.433 5.108 -6.156 39 HE22 GLN 26 2HE2 GLN 26 13.684 3.769 -7.245 40 H PHE 27 H PHE 27 9.142 3.848 -8.520 41 HA PHE 27 HA PHE 27 8.034 6.070 -9.675 42 HB2 PHE 27 2HB PHE 27 8.458 5.102 -11.632 43 HB3 PHE 27 3HB PHE 27 9.497 4.128 -10.609 44 HD1 PHE 27 HD1 PHE 27 7.270 4.006 -13.268 45 HD2 PHE 27 HD2 PHE 27 8.023 1.994 -9.543 46 HE1 PHE 27 HE1 PHE 27 5.922 2.075 -14.037 47 HE2 PHE 27 HE2 PHE 27 6.739 0.036 -10.328 48 HZ PHE 27 HZ PHE 27 5.690 0.056 -12.599 49 H VAL 28 H VAL 28 6.131 3.935 -8.007 50 HA VAL 28 HA VAL 28 3.677 3.835 -9.462 51 HB VAL 28 HB VAL 28 2.569 3.834 -7.195 52 HG11 VAL 28 1HG1 VAL 28 3.366 1.565 -6.623 53 HG12 VAL 28 2HG1 VAL 28 3.189 1.756 -8.368 54 HG13 VAL 28 3HG1 VAL 28 4.811 1.807 -7.629 55 HG21 VAL 28 1HG2 VAL 28 3.900 3.527 -5.182 56 HG22 VAL 28 2HG2 VAL 28 5.409 3.786 -6.076 57 HG23 VAL 28 3HG2 VAL 28 4.232 5.109 -5.887 58 H THR 29 H THR 29 5.181 6.466 -7.636 59 HA THR 29 HA THR 29 3.005 8.322 -7.752 60 HB THR 29 HB THR 29 4.975 8.547 -6.317 61 HG1 THR 29 HG1 THR 29 5.038 10.784 -6.577 62 HG21 THR 29 1HG2 THR 29 6.740 8.005 -8.102 63 HG22 THR 29 2HG2 THR 29 7.076 9.410 -7.074 64 HG23 THR 29 3HG2 THR 29 6.475 9.644 -8.731 65 H SER 30 H SER 30 5.731 7.820 -10.060 66 HA SER 30 HA SER 30 4.879 9.697 -11.978 67 HB2 SER 30 2HB SER 30 6.317 7.091 -12.598 68 HB3 SER 30 3HB SER 30 6.461 8.651 -13.433 69 HG SER 30 HG SER 30 8.243 8.343 -12.067 70 H GLU 31 H GLU 31 3.834 6.310 -11.500 71 HA GLU 31 HA GLU 31 2.178 6.241 -13.883 72 HB2 GLU 31 2HB GLU 31 2.032 4.617 -11.317 73 HB3 GLU 31 3HB GLU 31 1.064 4.327 -12.768 74 HG2 GLU 31 2HG GLU 31 3.245 4.142 -14.056 75 HG3 GLU 31 3HG GLU 31 4.081 4.097 -12.516 76 H VAL 32 H VAL 32 1.651 7.710 -10.672 77 HA VAL 32 HA VAL 32 -1.218 7.514 -10.824 78 HB VAL 32 HB VAL 32 0.390 8.054 -8.741 79 HG11 VAL 32 1HG1 VAL 32 0.212 10.286 -7.884 80 HG12 VAL 32 2HG1 VAL 32 0.872 10.458 -9.520 81 HG13 VAL 32 3HG1 VAL 32 -0.838 10.808 -9.220 82 HG21 VAL 32 1HG2 VAL 32 -1.680 8.633 -7.525 83 HG22 VAL 32 2HG2 VAL 32 -2.481 8.984 -9.077 84 HG23 VAL 32 3HG2 VAL 32 -1.946 7.336 -8.699 85 H GLY 33 H GLY 33 1.032 9.681 -12.162 86 HA2 GLY 33 HA2 GLY 33 -0.687 11.885 -12.930 87 HA3 GLY 33 HA3 GLY 33 0.892 11.462 -13.636 88 H ARG 34 H ARG 34 -0.568 8.635 -13.996 89 HA ARG 34 HA ARG 34 -2.393 9.302 -16.274 90 HB2 ARG 34 2HB ARG 34 -0.985 6.690 -15.628 91 HB3 ARG 34 3HB ARG 34 -2.015 7.020 -17.016 92 HG2 ARG 34 2HG ARG 34 0.697 8.352 -16.449 93 HG3 ARG 34 3HG ARG 34 0.476 6.919 -17.436 94 HD2 ARG 34 2HD ARG 34 0.647 8.709 -18.957 95 HD3 ARG 34 3HD ARG 34 -1.053 8.185 -18.942 96 HE ARG 34 HE ARG 34 -0.675 10.313 -17.067 97 HH11 ARG 34 1HH1 ARG 34 -0.851 9.914 -20.579 98 HH12 ARG 34 2HH1 ARG 34 -1.433 11.539 -20.801 99 HH21 ARG 34 1HH2 ARG 34 -1.446 12.289 -17.381 100 HH22 ARG 34 2HH2 ARG 34 -1.773 12.890 -18.991 101 H TYR 35 H TYR 35 -1.944 6.685 -13.910 102 HA TYR 35 HA TYR 35 -4.414 5.528 -14.215 103 HB2 TYR 35 2HB TYR 35 -2.269 5.378 -12.086 104 HB3 TYR 35 3HB TYR 35 -3.781 4.515 -11.858 105 HD1 TYR 35 HD1 TYR 35 -0.925 4.902 -14.265 106 HD2 TYR 35 HD2 TYR 35 -4.253 2.517 -12.969 107 HE1 TYR 35 HE1 TYR 35 -0.456 3.290 -16.088 108 HE2 TYR 35 HE2 TYR 35 -3.870 0.935 -14.817 109 HH TYR 35 HH TYR 35 -1.099 1.351 -17.122 110 H GLY 36 H GLY 36 -3.587 7.640 -11.497 111 HA2 GLY 36 HA2 GLY 36 -6.382 7.938 -10.649 112 HA3 GLY 36 HA3 GLY 36 -4.951 8.697 -9.926 113 H ALA 37 H ALA 37 -4.353 9.537 -12.975 114 HA ALA 37 HA ALA 37 -5.444 12.180 -12.598 115 HB1 ALA 37 1HB ALA 37 -4.106 12.768 -14.541 116 HB2 ALA 37 2HB ALA 37 -3.145 11.819 -13.401 117 HB3 ALA 37 3HB ALA 37 -3.788 11.067 -14.886 118 H ILE 38 H ILE 38 -6.186 9.343 -14.623 119 HA ILE 38 HA ILE 38 -7.972 10.672 -16.443 120 HB ILE 38 HB ILE 38 -8.763 8.485 -17.009 121 HG12 ILE 38 2HG1 ILE 38 -7.830 7.640 -14.255 122 HG13 ILE 38 3HG1 ILE 38 -9.449 7.552 -14.941 123 HG21 ILE 38 1HG2 ILE 38 -6.192 9.059 -17.349 124 HG22 ILE 38 2HG2 ILE 38 -5.943 7.763 -16.164 125 HG23 ILE 38 3HG2 ILE 38 -6.780 7.426 -17.669 126 HD11 ILE 38 1HD1 ILE 38 -7.084 5.763 -15.510 127 HD12 ILE 38 2HD1 ILE 38 -8.663 5.352 -14.838 128 HD13 ILE 38 3HD1 ILE 38 -8.549 5.796 -16.547 129 H TYR 39 H TYR 39 -8.392 9.673 -13.161 130 HA TYR 39 HA TYR 39 -11.296 10.052 -13.115 131 HB2 TYR 39 2HB TYR 39 -9.323 9.662 -10.824 132 HB3 TYR 39 3HB TYR 39 -11.075 9.627 -10.706 133 HD1 TYR 39 HD1 TYR 39 -12.405 7.827 -11.719 134 HD2 TYR 39 HD2 TYR 39 -8.111 7.686 -11.668 135 HE1 TYR 39 HE1 TYR 39 -12.433 5.483 -12.546 136 HE2 TYR 39 HE2 TYR 39 -8.138 5.251 -12.338 137 HH TYR 39 HH TYR 39 -9.573 3.528 -13.014 138 H THR 40 H THR 40 -8.491 11.726 -11.611 139 HA THR 40 HA THR 40 -9.943 13.881 -10.504 140 HB THR 40 HB THR 40 -7.524 13.073 -10.086 141 HG1 THR 40 HG1 THR 40 -7.103 15.136 -9.233 142 HG21 THR 40 1HG2 THR 40 -5.739 14.121 -11.154 143 HG22 THR 40 2HG2 THR 40 -6.785 15.347 -11.935 144 HG23 THR 40 3HG2 THR 40 -6.811 13.670 -12.485 145 H GLN 41 H GLN 41 -8.652 13.530 -13.769 146 HA GLN 41 HA GLN 41 -9.079 16.248 -14.657 147 HB2 GLN 41 2HB GLN 41 -8.737 13.589 -16.064 148 HB3 GLN 41 3HB GLN 41 -9.039 15.093 -16.946 149 HG2 GLN 41 2HG GLN 41 -7.026 16.134 -15.992 150 HG3 GLN 41 3HG GLN 41 -6.715 14.665 -15.045 151 HE21 GLN 41 1HE2 GLN 41 -6.597 12.645 -16.309 152 HE22 GLN 41 2HE2 GLN 41 -5.700 12.677 -17.848 153 H LEU 42 H LEU 42 -11.101 13.283 -14.660 154 HA LEU 42 HA LEU 42 -13.228 14.596 -16.181 155 HB2 LEU 42 2HB LEU 42 -12.686 12.077 -16.117 156 HB3 LEU 42 3HB LEU 42 -13.396 12.112 -14.493 157 HG LEU 42 HG LEU 42 -15.558 12.846 -15.446 158 HD11 LEU 42 1HD1 LEU 42 -15.938 12.745 -17.921 159 HD12 LEU 42 2HD1 LEU 42 -14.180 12.593 -18.165 160 HD13 LEU 42 3HD1 LEU 42 -14.879 14.074 -17.466 161 HD21 LEU 42 1HD2 LEU 42 -14.381 10.360 -16.698 162 HD22 LEU 42 2HD2 LEU 42 -16.114 10.756 -16.690 163 HD23 LEU 42 3HD2 LEU 42 -15.260 10.503 -15.161 164 H ILE 43 H ILE 43 -12.498 14.178 -12.755 165 HA ILE 43 HA ILE 43 -15.097 15.119 -11.829 166 HB ILE 43 HB ILE 43 -12.447 14.413 -10.535 167 HG12 ILE 43 2HG1 ILE 43 -14.034 13.040 -9.150 168 HG13 ILE 43 3HG1 ILE 43 -15.375 13.664 -10.137 169 HG21 ILE 43 1HG2 ILE 43 -13.094 16.487 -9.336 170 HG22 ILE 43 2HG2 ILE 43 -14.761 15.887 -9.191 171 HG23 ILE 43 3HG2 ILE 43 -13.416 15.076 -8.340 172 HD11 ILE 43 1HD1 ILE 43 -14.818 11.440 -10.800 173 HD12 ILE 43 2HD1 ILE 43 -14.358 12.527 -12.124 174 HD13 ILE 43 3HD1 ILE 43 -13.118 11.850 -11.009 175 H ARG 44 H ARG 44 -11.865 16.649 -11.965 176 HA ARG 44 HA ARG 44 -12.780 19.180 -10.976 177 HB2 ARG 44 2HB ARG 44 -10.628 20.016 -11.537 178 HB3 ARG 44 3HB ARG 44 -10.444 18.340 -11.036 179 HG2 ARG 44 2HG ARG 44 -9.047 18.312 -12.823 180 HG3 ARG 44 3HG ARG 44 -10.542 17.820 -13.615 181 HD2 ARG 44 2HD ARG 44 -10.876 20.189 -14.374 182 HD3 ARG 44 3HD ARG 44 -9.352 20.634 -13.625 183 HE ARG 44 HE ARG 44 -9.799 19.166 -16.123 184 HH11 ARG 44 1HH1 ARG 44 -8.077 18.705 -17.458 185 HH12 ARG 44 2HH1 ARG 44 -6.448 18.856 -16.887 186 HH21 ARG 44 1HH2 ARG 44 -7.330 19.883 -13.688 187 HH22 ARG 44 2HH2 ARG 44 -6.028 19.493 -14.771 188 H GLN 45 H GLN 45 -12.988 17.754 -14.191 189 HA GLN 45 HA GLN 45 -13.446 20.324 -15.499 190 HB2 GLN 45 2HB GLN 45 -13.549 19.304 -17.452 191 HB3 GLN 45 3HB GLN 45 -12.486 18.268 -16.500 192 HG2 GLN 45 2HG GLN 45 -14.366 16.673 -16.209 193 HG3 GLN 45 3HG GLN 45 -15.420 17.712 -17.186 194 HE21 GLN 45 1HE2 GLN 45 -12.064 16.352 -17.350 195 HE22 GLN 45 2HE2 GLN 45 -12.115 16.102 -19.085 196 H ASN 46 H ASN 46 -15.540 18.303 -13.531 197 HA ASN 46 HA ASN 46 -17.987 19.630 -14.562 198 HB2 ASN 46 2HB ASN 46 -17.470 18.122 -11.973 199 HB3 ASN 46 3HB ASN 46 -19.033 18.669 -12.544 200 HD21 ASN 46 1HD2 ASN 46 -16.833 16.110 -12.546 201 HD22 ASN 46 2HD2 ASN 46 -17.760 15.104 -13.649 202 H LEU 47 H LEU 47 -15.513 20.209 -12.071 203 HA LEU 47 HA LEU 47 -17.317 21.907 -10.492 204 HB2 LEU 47 2HB LEU 47 -14.629 20.628 -9.908 205 HB3 LEU 47 3HB LEU 47 -15.663 21.483 -8.773 206 HG LEU 47 HG LEU 47 -16.413 18.933 -10.102 207 HD11 LEU 47 1HD1 LEU 47 -15.369 19.567 -7.354 208 HD12 LEU 47 2HD1 LEU 47 -14.517 18.724 -8.666 209 HD13 LEU 47 3HD1 LEU 47 -15.932 17.956 -7.897 210 HD21 LEU 47 1HD2 LEU 47 -18.465 20.066 -9.521 211 HD22 LEU 47 2HD2 LEU 47 -17.792 20.612 -7.975 212 HD23 LEU 47 3HD2 LEU 47 -18.167 18.894 -8.234 213 H LEU 48 H LEU 48 -17.267 23.884 -10.942 214 HA LEU 48 HA LEU 48 -14.813 25.257 -11.820 215 HB2 LEU 48 2HB LEU 48 -16.422 27.026 -12.639 216 HB3 LEU 48 3HB LEU 48 -16.511 25.442 -13.387 217 HG LEU 48 HG LEU 48 -18.548 24.897 -12.148 218 HD11 LEU 48 1HD1 LEU 48 -19.778 26.614 -10.868 219 HD12 LEU 48 2HD1 LEU 48 -18.398 27.721 -10.989 220 HD13 LEU 48 3HD1 LEU 48 -18.274 26.195 -10.071 221 HD21 LEU 48 1HD2 LEU 48 -18.672 27.594 -13.554 222 HD22 LEU 48 2HD2 LEU 48 -20.029 26.467 -13.336 223 HD23 LEU 48 3HD2 LEU 48 -18.652 26.007 -14.354 224 H VAL 49 H VAL 49 -15.161 24.675 -9.052 225 HA VAL 49 HA VAL 49 -16.149 27.069 -7.730 226 HB VAL 49 HB VAL 49 -14.741 24.763 -6.380 227 HG11 VAL 49 1HG1 VAL 49 -16.058 25.453 -4.405 228 HG12 VAL 49 2HG1 VAL 49 -14.964 26.747 -4.936 229 HG13 VAL 49 3HG1 VAL 49 -16.691 26.849 -5.316 230 HG21 VAL 49 1HG2 VAL 49 -16.660 23.846 -7.626 231 HG22 VAL 49 2HG2 VAL 49 -17.023 23.869 -5.909 232 HG23 VAL 49 3HG2 VAL 49 -17.725 25.105 -6.965 233 H GLU 50 H GLU 50 -12.934 25.537 -7.587 234 HA GLU 50 HA GLU 50 -10.827 26.296 -7.586 235 HB2 GLU 50 2HB GLU 50 -11.892 29.041 -8.339 236 HB3 GLU 50 3HB GLU 50 -10.245 28.443 -8.505 237 HG2 GLU 50 2HG GLU 50 -11.123 26.665 -10.073 238 HG3 GLU 50 3HG GLU 50 -12.702 27.451 -10.008 239 H ASP 51 H ASP 51 -12.620 29.091 -6.158 240 HA ASP 51 HA ASP 51 -10.504 29.852 -4.415 241 HB2 ASP 51 2HB ASP 51 -12.345 31.308 -5.234 242 HB3 ASP 51 3HB ASP 51 -13.503 30.417 -4.259 243 H SER 52 H SER 52 -13.256 27.701 -3.876 244 HA SER 52 HA SER 52 -12.426 27.147 -1.062 245 HB2 SER 52 2HB SER 52 -14.827 26.204 -2.648 246 HB3 SER 52 3HB SER 52 -14.456 25.728 -0.993 247 HG SER 52 HG SER 52 -14.867 28.428 -1.879 248 H PHE 53 H PHE 53 -11.240 26.115 -3.952 249 HA PHE 53 HA PHE 53 -10.627 23.359 -2.971 250 HB2 PHE 53 2HB PHE 53 -10.267 24.631 -5.706 251 HB3 PHE 53 3HB PHE 53 -9.815 22.989 -5.271 252 HD1 PHE 53 HD1 PHE 53 -12.686 22.961 -3.498 253 HD2 PHE 53 HD2 PHE 53 -11.463 23.460 -7.600 254 HE1 PHE 53 HE1 PHE 53 -14.818 22.052 -4.220 255 HE2 PHE 53 HE2 PHE 53 -13.570 22.443 -8.338 256 HZ PHE 53 HZ PHE 53 -15.264 21.693 -6.660 257 H ARG 54 H ARG 54 -9.382 26.514 -3.048 258 HA ARG 54 HA ARG 54 -6.546 25.580 -2.766 259 HB2 ARG 54 2HB ARG 54 -7.654 28.263 -3.679 260 HB3 ARG 54 3HB ARG 54 -5.944 27.910 -3.458 261 HG2 ARG 54 2HG ARG 54 -7.746 26.494 -5.476 262 HG3 ARG 54 3HG ARG 54 -6.734 27.874 -5.823 263 HD2 ARG 54 2HD ARG 54 -5.544 25.988 -6.604 264 HD3 ARG 54 3HD ARG 54 -4.717 26.495 -5.119 265 HE ARG 54 HE ARG 54 -6.786 24.479 -4.702 266 HH11 ARG 54 1HH1 ARG 54 -3.354 24.718 -5.558 267 HH12 ARG 54 2HH1 ARG 54 -2.995 23.219 -4.724 268 HH21 ARG 54 1HH2 ARG 54 -6.230 22.659 -3.649 269 HH22 ARG 54 2HH2 ARG 54 -4.577 22.069 -3.734 270 H GLY 55 H GLY 55 -5.186 26.804 -1.415 271 HA2 GLY 55 HA2 GLY 55 -4.576 27.742 0.637 272 HA3 GLY 55 HA3 GLY 55 -6.268 28.169 0.947 273 H LYS 56 H LYS 56 -6.211 24.906 0.175 274 HA LYS 56 HA LYS 56 -5.673 23.841 2.874 275 HB2 LYS 56 2HB LYS 56 -7.989 22.967 3.028 276 HB3 LYS 56 3HB LYS 56 -7.895 24.712 3.071 277 HG2 LYS 56 2HG LYS 56 -9.768 24.160 1.775 278 HG3 LYS 56 3HG LYS 56 -8.602 24.826 0.678 279 HD2 LYS 56 2HD LYS 56 -8.110 22.725 -0.312 280 HD3 LYS 56 3HD LYS 56 -8.883 21.801 0.988 281 HE2 LYS 56 2HE LYS 56 -10.243 23.624 -1.008 282 HE3 LYS 56 3HE LYS 56 -10.169 21.853 -1.126 283 HZ1 LYS 56 HZ1 LYS 56 -12.262 22.818 -0.237 284 HZ2 LYS 56 HZ2 LYS 56 -11.509 23.292 1.111 285 HZ3 LYS 56 HZ3 LYS 56 -11.608 21.686 0.783 286 H GLN 57 H GLN 57 -6.469 21.366 2.829 287 HA GLN 57 HA GLN 57 -5.560 20.122 0.273 288 HB2 GLN 57 2HB GLN 57 -3.996 18.832 1.305 289 HB3 GLN 57 3HB GLN 57 -3.913 20.235 2.312 290 HG2 GLN 57 2HG GLN 57 -3.999 18.699 3.945 291 HG3 GLN 57 3HG GLN 57 -5.729 18.948 3.766 292 HE21 GLN 57 1HE2 GLN 57 -4.263 17.026 1.262 293 HE22 GLN 57 2HE2 GLN 57 -4.938 15.521 1.880 294 H CYS 58 H CYS 58 -6.372 17.884 -0.025 295 HA CYS 58 HA CYS 58 -8.394 16.875 1.818 296 HB2 CYS 58 2HB CYS 58 -9.725 18.415 0.423 297 HB3 CYS 58 3HB CYS 58 -9.060 17.672 -1.048 298 HG CYS 58 HG CYS 58 -10.735 16.034 1.319 299 H ARG 59 H ARG 59 -8.540 14.641 1.734 300 HA ARG 59 HA ARG 59 -7.530 13.277 -0.667 301 HB2 ARG 59 2HB ARG 59 -6.625 11.462 0.613 302 HB3 ARG 59 3HB ARG 59 -5.722 12.930 0.879 303 HG2 ARG 59 2HG ARG 59 -7.838 12.269 2.916 304 HG3 ARG 59 3HG ARG 59 -6.473 11.183 2.804 305 HD2 ARG 59 2HD ARG 59 -5.043 13.370 3.032 306 HD3 ARG 59 3HD ARG 59 -6.586 14.092 3.551 307 HE ARG 59 HE ARG 59 -5.943 11.598 4.921 308 HH11 ARG 59 1HH1 ARG 59 -5.355 15.105 5.137 309 HH12 ARG 59 2HH1 ARG 59 -4.863 14.977 6.803 310 HH21 ARG 59 1HH2 ARG 59 -5.349 11.561 7.069 311 HH22 ARG 59 2HH2 ARG 59 -4.906 13.029 7.881 312 H VAL 60 H VAL 60 -9.020 11.940 -1.513 313 HA VAL 60 HA VAL 60 -10.908 10.526 0.290 314 HB VAL 60 HB VAL 60 -12.855 10.961 -1.054 315 HG11 VAL 60 1HG1 VAL 60 -11.553 13.629 -0.351 316 HG12 VAL 60 2HG1 VAL 60 -13.284 13.306 -0.465 317 HG13 VAL 60 3HG1 VAL 60 -12.309 12.550 0.818 318 HG21 VAL 60 1HG2 VAL 60 -12.958 12.575 -2.867 319 HG22 VAL 60 2HG2 VAL 60 -11.225 12.872 -2.743 320 HG23 VAL 60 3HG2 VAL 60 -11.816 11.273 -3.264 321 H ASN 61 H ASN 61 -12.053 8.751 -1.136 322 HA ASN 61 HA ASN 61 -10.122 7.762 -3.121 323 HB2 ASN 61 2HB ASN 61 -9.463 6.912 -0.983 324 HB3 ASN 61 3HB ASN 61 -11.093 6.426 -0.564 325 HD21 ASN 61 1HD2 ASN 61 -12.084 4.686 -1.954 326 HD22 ASN 61 2HD2 ASN 61 -11.005 3.462 -2.605 327 H LEU 62 H LEU 62 -10.861 6.745 -4.825 328 HA LEU 62 HA LEU 62 -13.840 6.322 -5.046 329 HB2 LEU 62 2HB LEU 62 -11.613 7.109 -6.928 330 HB3 LEU 62 3HB LEU 62 -13.001 6.238 -7.569 331 HG LEU 62 HG LEU 62 -14.519 7.977 -6.873 332 HD11 LEU 62 1HD1 LEU 62 -13.545 8.877 -4.839 333 HD12 LEU 62 2HD1 LEU 62 -13.647 10.185 -6.020 334 HD13 LEU 62 3HD1 LEU 62 -12.088 9.396 -5.702 335 HD21 LEU 62 1HD2 LEU 62 -13.410 8.133 -9.061 336 HD22 LEU 62 2HD2 LEU 62 -12.045 9.008 -8.335 337 HD23 LEU 62 3HD2 LEU 62 -13.647 9.755 -8.417 338 H LYS 63 H LYS 63 -14.614 4.364 -5.215 339 HA LYS 63 HA LYS 63 -12.858 2.091 -6.074 340 HB2 LYS 63 2HB LYS 63 -15.211 2.176 -4.151 341 HB3 LYS 63 3HB LYS 63 -14.536 0.677 -4.808 342 HG2 LYS 63 2HG LYS 63 -12.341 1.174 -3.839 343 HG3 LYS 63 3HG LYS 63 -12.917 2.729 -3.249 344 HD2 LYS 63 2HD LYS 63 -14.059 0.063 -2.328 345 HD3 LYS 63 3HD LYS 63 -12.756 0.941 -1.516 346 HE2 LYS 63 2HE LYS 63 -14.278 2.945 -1.308 347 HE3 LYS 63 3HE LYS 63 -15.594 1.975 -1.979 348 HZ1 LYS 63 HZ1 LYS 63 -15.619 1.993 0.446 349 HZ2 LYS 63 HZ2 LYS 63 -14.125 1.341 0.523 350 HZ3 LYS 63 HZ3 LYS 63 -15.374 0.473 -0.090 351 H LEU 64 H LEU 64 -13.223 1.900 -8.272 352 HA LEU 64 HA LEU 64 -15.981 2.292 -9.261 353 HB2 LEU 64 2HB LEU 64 -13.412 1.981 -10.840 354 HB3 LEU 64 3HB LEU 64 -14.988 2.470 -11.438 355 HG LEU 64 HG LEU 64 -13.916 4.415 -11.455 356 HD11 LEU 64 1HD1 LEU 64 -14.631 5.926 -9.692 357 HD12 LEU 64 2HD1 LEU 64 -15.083 4.557 -8.663 358 HD13 LEU 64 3HD1 LEU 64 -15.905 4.829 -10.214 359 HD21 LEU 64 1HD2 LEU 64 -11.843 3.662 -10.449 360 HD22 LEU 64 2HD2 LEU 64 -12.535 3.898 -8.809 361 HD23 LEU 64 3HD2 LEU 64 -12.325 5.273 -9.885 362 H ILE 65 H ILE 65 -16.844 0.944 -10.842 363 HA ILE 65 HA ILE 65 -16.084 -1.951 -10.678 364 HB ILE 65 HB ILE 65 -18.348 -2.310 -11.737 365 HG12 ILE 65 2HG1 ILE 65 -19.023 0.493 -10.776 366 HG13 ILE 65 3HG1 ILE 65 -18.569 0.163 -12.447 367 HG21 ILE 65 1HG2 ILE 65 -18.340 -1.033 -8.964 368 HG22 ILE 65 2HG2 ILE 65 -19.532 -2.189 -9.586 369 HG23 ILE 65 3HG2 ILE 65 -17.859 -2.700 -9.327 370 HD11 ILE 65 1HD1 ILE 65 -20.438 -1.426 -12.651 371 HD12 ILE 65 2HD1 ILE 65 -20.947 -1.009 -10.991 372 HD13 ILE 65 3HD1 ILE 65 -20.950 0.230 -12.272 373 HA PRO 66 HA PRO 66 -14.748 -1.613 -14.928 374 HB2 PRO 66 2HB PRO 66 -14.980 -4.164 -15.847 375 HB3 PRO 66 3HB PRO 66 -13.750 -3.677 -14.634 376 HG2 PRO 66 2HG PRO 66 -16.455 -4.964 -14.144 377 HG3 PRO 66 3HG PRO 66 -14.860 -5.440 -13.470 378 HD2 PRO 66 2HD PRO 66 -16.626 -3.865 -12.094 379 HD3 PRO 66 3HD PRO 66 -14.866 -3.622 -11.953 380 H THR 67 H THR 67 -15.589 -1.343 -16.968 381 HA THR 67 HA THR 67 -18.150 -2.240 -17.933 382 HB THR 67 HB THR 67 -17.923 0.494 -16.683 383 HG1 THR 67 HG1 THR 67 -19.022 -1.447 -15.858 384 HG21 THR 67 1HG2 THR 67 -18.558 1.106 -18.959 385 HG22 THR 67 2HG2 THR 67 -19.964 1.221 -17.901 386 HG23 THR 67 3HG2 THR 67 -19.808 -0.173 -18.995 387 H GLY 68 H GLY 68 -18.405 -1.702 -20.148 388 HA2 GLY 68 HA2 GLY 68 -15.930 -1.939 -21.504 389 HA3 GLY 68 HA3 GLY 68 -17.522 -1.776 -22.263 390 H THR 69 H THR 69 -17.620 0.994 -20.817 391 HA THR 69 HA THR 69 -16.160 2.592 -22.858 392 HB THR 69 HB THR 69 -17.528 4.473 -21.933 393 HG1 THR 69 HG1 THR 69 -19.189 3.930 -20.512 394 HG21 THR 69 1HG2 THR 69 -18.305 3.175 -23.905 395 HG22 THR 69 2HG2 THR 69 -19.654 3.757 -22.910 396 HG23 THR 69 3HG2 THR 69 -19.166 2.051 -22.822 397 H GLY 70 H GLY 70 -15.498 1.438 -19.791 398 HA2 GLY 70 HA2 GLY 70 -13.326 2.370 -18.767 399 HA3 GLY 70 HA3 GLY 70 -14.185 3.917 -18.809 400 H ALA 71 H ALA 71 -13.380 3.144 -16.312 401 HA ALA 71 HA ALA 71 -15.149 1.306 -15.017 402 HB1 ALA 71 1HB ALA 71 -12.743 1.944 -14.409 403 HB2 ALA 71 2HB ALA 71 -13.427 3.379 -13.626 404 HB3 ALA 71 3HB ALA 71 -13.886 1.735 -13.104 405 H LEU 72 H LEU 72 -16.655 1.829 -13.266 406 HA LEU 72 HA LEU 72 -18.057 4.460 -13.536 407 HB2 LEU 72 2HB LEU 72 -18.988 1.759 -14.173 408 HB3 LEU 72 3HB LEU 72 -19.898 2.371 -12.801 409 HG LEU 72 HG LEU 72 -20.614 4.330 -14.067 410 HD11 LEU 72 1HD1 LEU 72 -18.778 4.795 -15.518 411 HD12 LEU 72 2HD1 LEU 72 -20.134 4.377 -16.566 412 HD13 LEU 72 3HD1 LEU 72 -18.850 3.182 -16.275 413 HD21 LEU 72 1HD2 LEU 72 -22.047 3.155 -15.694 414 HD22 LEU 72 2HD2 LEU 72 -21.941 2.251 -14.176 415 HD23 LEU 72 3HD2 LEU 72 -21.011 1.712 -15.592 416 H LEU 73 H LEU 73 -18.910 5.372 -11.669 417 HA LEU 73 HA LEU 73 -17.660 4.724 -9.219 418 HB2 LEU 73 2HB LEU 73 -18.574 6.940 -9.942 419 HB3 LEU 73 3HB LEU 73 -20.189 6.371 -9.594 420 HG LEU 73 HG LEU 73 -19.066 7.870 -7.879 421 HD11 LEU 73 1HD1 LEU 73 -19.934 5.200 -6.727 422 HD12 LEU 73 2HD1 LEU 73 -21.018 6.501 -7.262 423 HD13 LEU 73 3HD1 LEU 73 -19.902 6.770 -5.910 424 HD21 LEU 73 1HD2 LEU 73 -16.798 6.733 -8.042 425 HD22 LEU 73 2HD2 LEU 73 -17.466 5.405 -7.065 426 HD23 LEU 73 3HD2 LEU 73 -17.372 7.054 -6.408 427 H GLY 74 H GLY 74 -17.792 2.943 -8.179 428 HA2 GLY 74 HA2 GLY 74 -20.346 1.534 -7.666 429 HA3 GLY 74 HA3 GLY 74 -18.705 0.999 -7.235 430 H SER 75 H SER 75 -17.644 3.139 -5.879 431 HA SER 75 HA SER 75 -19.492 4.096 -3.804 432 HB2 SER 75 2HB SER 75 -17.305 2.078 -3.198 433 HB3 SER 75 3HB SER 75 -17.993 3.169 -1.980 434 HG SER 75 HG SER 75 -19.012 1.107 -1.974 435 H LEU 76 H LEU 76 -18.622 5.793 -2.577 436 HA LEU 76 HA LEU 76 -15.848 6.675 -3.214 437 HB2 LEU 76 2HB LEU 76 -17.607 7.986 -4.408 438 HB3 LEU 76 3HB LEU 76 -18.288 8.488 -2.873 439 HG LEU 76 HG LEU 76 -15.331 8.949 -3.274 440 HD11 LEU 76 1HD1 LEU 76 -16.123 9.579 -5.459 441 HD12 LEU 76 2HD1 LEU 76 -15.814 11.070 -4.546 442 HD13 LEU 76 3HD1 LEU 76 -17.481 10.474 -4.785 443 HD21 LEU 76 1HD2 LEU 76 -15.820 11.064 -2.090 444 HD22 LEU 76 2HD2 LEU 76 -16.486 9.702 -1.182 445 HD23 LEU 76 3HD2 LEU 76 -17.557 10.727 -2.156 446 H THR 77 H THR 77 -14.643 6.946 -1.523 447 HA THR 77 HA THR 77 -15.778 6.907 1.263 448 HB THR 77 HB THR 77 -13.146 5.884 0.091 449 HG1 THR 77 HG1 THR 77 -15.404 4.581 1.241 450 HG21 THR 77 1HG2 THR 77 -12.765 4.898 2.338 451 HG22 THR 77 2HG2 THR 77 -14.169 5.802 2.963 452 HG23 THR 77 3HG2 THR 77 -12.734 6.661 2.358 453 H VAL 78 H VAL 78 -15.532 8.881 2.262 454 HA VAL 78 HA VAL 78 -13.394 10.733 1.376 455 HB VAL 78 HB VAL 78 -14.201 12.305 3.063 456 HG11 VAL 78 1HG1 VAL 78 -16.258 12.941 1.891 457 HG12 VAL 78 2HG1 VAL 78 -15.019 12.424 0.741 458 HG13 VAL 78 3HG1 VAL 78 -16.363 11.333 1.148 459 HG21 VAL 78 1HG2 VAL 78 -15.207 10.807 4.713 460 HG22 VAL 78 2HG2 VAL 78 -16.377 12.010 4.150 461 HG23 VAL 78 3HG2 VAL 78 -16.470 10.341 3.552 462 H LEU 79 H LEU 79 -11.463 11.042 2.424 463 HA LEU 79 HA LEU 79 -10.946 9.315 4.827 464 HB2 LEU 79 2HB LEU 79 -9.024 10.402 2.742 465 HB3 LEU 79 3HB LEU 79 -8.591 9.417 4.123 466 HG LEU 79 HG LEU 79 -10.384 8.523 1.815 467 HD11 LEU 79 1HD1 LEU 79 -8.401 7.170 1.145 468 HD12 LEU 79 2HD1 LEU 79 -7.435 7.981 2.394 469 HD13 LEU 79 3HD1 LEU 79 -8.114 8.914 1.036 470 HD21 LEU 79 1HD2 LEU 79 -10.867 7.276 3.886 471 HD22 LEU 79 2HD2 LEU 79 -9.140 6.948 4.114 472 HD23 LEU 79 3HD2 LEU 79 -10.012 6.242 2.735 473 H ASP 80 H ASP 80 -10.131 12.533 3.418 474 HA ASP 80 HA ASP 80 -10.931 13.914 5.768 475 HB2 ASP 80 2HB ASP 80 -8.419 12.894 6.233 476 HB3 ASP 80 3HB ASP 80 -7.999 14.395 5.451 477 H GLY 81 H GLY 81 -10.328 16.288 5.624 478 HA2 GLY 81 HA2 GLY 81 -8.974 17.736 3.868 479 HA3 GLY 81 HA3 GLY 81 -10.341 17.307 2.843 480 H ASP 82 H ASP 82 -10.155 19.766 2.930 481 HA ASP 82 HA ASP 82 -11.844 20.938 5.075 482 HB2 ASP 82 2HB ASP 82 -9.964 22.274 4.361 483 HB3 ASP 82 3HB ASP 82 -10.396 22.116 2.688 484 H SER 83 H SER 83 -13.941 20.679 4.892 485 HA SER 83 HA SER 83 -14.732 18.648 3.218 486 HB2 SER 83 2HB SER 83 -16.967 18.910 4.270 487 HB3 SER 83 3HB SER 83 -15.620 18.928 5.417 488 HG SER 83 HG SER 83 -17.136 20.585 5.878 489 H ARG 84 H ARG 84 -15.083 21.993 2.403 490 HA ARG 84 HA ARG 84 -17.258 21.880 0.579 491 HB2 ARG 84 2HB ARG 84 -14.696 23.524 0.457 492 HB3 ARG 84 3HB ARG 84 -16.124 23.789 -0.558 493 HG2 ARG 84 2HG ARG 84 -17.493 24.143 1.520 494 HG3 ARG 84 3HG ARG 84 -16.008 24.032 2.482 495 HD2 ARG 84 2HD ARG 84 -15.050 25.946 1.259 496 HD3 ARG 84 3HD ARG 84 -16.520 26.048 0.262 497 HE ARG 84 HE ARG 84 -17.204 26.189 3.037 498 HH11 ARG 84 1HH1 ARG 84 -15.796 28.201 0.470 499 HH12 ARG 84 2HH1 ARG 84 -16.257 29.682 1.269 500 HH21 ARG 84 1HH2 ARG 84 -17.792 28.140 3.983 501 HH22 ARG 84 2HH2 ARG 84 -17.380 29.652 3.219 502 H LEU 85 H LEU 85 -13.894 20.656 0.194 503 HA LEU 85 HA LEU 85 -14.319 20.176 -2.702 504 HB2 LEU 85 2HB LEU 85 -12.167 20.884 -1.933 505 HB3 LEU 85 3HB LEU 85 -12.041 19.523 -0.808 506 HG LEU 85 HG LEU 85 -11.775 17.950 -2.580 507 HD11 LEU 85 1HD1 LEU 85 -11.718 18.537 -4.975 508 HD12 LEU 85 2HD1 LEU 85 -12.242 20.193 -4.607 509 HD13 LEU 85 3HD1 LEU 85 -13.333 18.816 -4.329 510 HD21 LEU 85 1HD2 LEU 85 -10.155 20.414 -3.364 511 HD22 LEU 85 2HD2 LEU 85 -9.680 18.705 -3.484 512 HD23 LEU 85 3HD2 LEU 85 -9.848 19.490 -1.899 513 H CYS 86 H CYS 86 -13.990 18.007 0.224 514 HA CYS 86 HA CYS 86 -14.793 15.603 -0.825 515 HB2 CYS 86 2HB CYS 86 -15.907 16.803 1.752 516 HB3 CYS 86 3HB CYS 86 -15.715 15.095 1.363 517 HG CYS 86 HG CYS 86 -13.064 15.188 1.110 518 H ALA 87 H ALA 87 -17.075 18.250 0.092 519 HA ALA 87 HA ALA 87 -19.460 16.857 -0.671 520 HB1 ALA 87 1HB ALA 87 -20.456 19.134 -0.554 521 HB2 ALA 87 2HB ALA 87 -19.403 18.807 0.835 522 HB3 ALA 87 3HB ALA 87 -18.829 19.838 -0.488 523 H ALA 88 H ALA 88 -17.391 19.126 -2.553 524 HA ALA 88 HA ALA 88 -19.079 19.179 -4.861 525 HB1 ALA 88 1HB ALA 88 -17.135 20.325 -5.867 526 HB2 ALA 88 2HB ALA 88 -17.447 20.947 -4.239 527 HB3 ALA 88 3HB ALA 88 -16.099 19.813 -4.517 528 H THR 89 H THR 89 -16.004 17.365 -4.292 529 HA THR 89 HA THR 89 -15.974 16.010 -6.797 530 HB THR 89 HB THR 89 -14.048 16.192 -5.277 531 HG1 THR 89 HG1 THR 89 -13.340 14.105 -5.794 532 HG21 THR 89 1HG2 THR 89 -13.698 14.791 -3.411 533 HG22 THR 89 2HG2 THR 89 -15.130 13.781 -3.778 534 HG23 THR 89 3HG2 THR 89 -15.322 15.430 -3.157 535 H LYS 90 H LYS 90 -17.396 14.996 -3.702 536 HA LYS 90 HA LYS 90 -18.253 12.396 -4.315 537 HB2 LYS 90 2HB LYS 90 -18.248 13.374 -2.116 538 HB3 LYS 90 3HB LYS 90 -19.385 14.631 -2.617 539 HG2 LYS 90 2HG LYS 90 -20.945 12.459 -3.029 540 HG3 LYS 90 3HG LYS 90 -19.867 11.782 -1.814 541 HD2 LYS 90 2HD LYS 90 -21.374 14.408 -1.578 542 HD3 LYS 90 3HD LYS 90 -21.965 12.897 -0.905 543 HE2 LYS 90 2HE LYS 90 -19.300 14.213 -0.136 544 HE3 LYS 90 3HE LYS 90 -20.808 14.477 0.734 545 HZ1 LYS 90 HZ1 LYS 90 -20.903 12.097 1.221 546 HZ2 LYS 90 HZ2 LYS 90 -19.529 12.748 1.802 547 HZ3 LYS 90 HZ3 LYS 90 -19.483 11.841 0.441 548 H ARG 91 H ARG 91 -19.928 15.458 -4.898 549 HA ARG 91 HA ARG 91 -22.215 14.247 -6.164 550 HB2 ARG 91 2HB ARG 91 -21.163 17.096 -6.148 551 HB3 ARG 91 3HB ARG 91 -22.685 16.633 -6.918 552 HG2 ARG 91 2HG ARG 91 -23.650 15.905 -4.827 553 HG3 ARG 91 3HG ARG 91 -22.113 16.112 -3.972 554 HD2 ARG 91 2HD ARG 91 -23.517 18.010 -3.451 555 HD3 ARG 91 3HD ARG 91 -22.163 18.540 -4.431 556 HE ARG 91 HE ARG 91 -23.591 19.170 -6.121 557 HH11 ARG 91 1HH1 ARG 91 -25.480 17.106 -3.956 558 HH12 ARG 91 2HH1 ARG 91 -26.980 17.506 -4.743 559 HH21 ARG 91 1HH2 ARG 91 -25.539 19.605 -7.110 560 HH22 ARG 91 2HH2 ARG 91 -26.999 18.857 -6.533 561 H ALA 92 H ALA 92 -19.289 15.813 -7.532 562 HA ALA 92 HA ALA 92 -19.941 15.557 -10.291 563 HB1 ALA 92 1HB ALA 92 -18.130 16.959 -9.528 564 HB2 ALA 92 2HB ALA 92 -17.247 15.548 -8.878 565 HB3 ALA 92 3HB ALA 92 -17.485 15.731 -10.618 566 H VAL 93 H VAL 93 -18.074 13.290 -8.229 567 HA VAL 93 HA VAL 93 -17.746 11.327 -10.239 568 HB VAL 93 HB VAL 93 -17.858 10.548 -7.329 569 HG11 VAL 93 1HG1 VAL 93 -16.091 9.054 -7.935 570 HG12 VAL 93 2HG1 VAL 93 -17.357 8.870 -9.154 571 HG13 VAL 93 3HG1 VAL 93 -15.917 9.806 -9.541 572 HG21 VAL 93 1HG2 VAL 93 -15.179 11.334 -7.888 573 HG22 VAL 93 2HG2 VAL 93 -16.174 12.695 -8.373 574 HG23 VAL 93 3HG2 VAL 93 -16.322 12.049 -6.739 575 H ALA 94 H ALA 94 -20.492 12.009 -8.260 576 HA ALA 94 HA ALA 94 -21.838 9.426 -8.693 577 HB1 ALA 94 1HB ALA 94 -23.684 10.467 -7.465 578 HB2 ALA 94 2HB ALA 94 -22.156 10.688 -6.600 579 HB3 ALA 94 3HB ALA 94 -22.866 12.043 -7.504 580 H GLN 95 H GLN 95 -21.262 12.148 -10.641 581 HA GLN 95 HA GLN 95 -23.657 11.546 -12.336 582 HB2 GLN 95 2HB GLN 95 -24.035 13.886 -12.706 583 HB3 GLN 95 3HB GLN 95 -24.041 13.533 -10.986 584 HG2 GLN 95 2HG GLN 95 -22.772 15.511 -11.029 585 HG3 GLN 95 3HG GLN 95 -21.592 14.287 -10.974 586 HE21 GLN 95 1HE2 GLN 95 -20.003 14.357 -12.587 587 HE22 GLN 95 2HE2 GLN 95 -20.116 15.440 -13.984 588 H VAL 96 H VAL 96 -20.215 11.905 -12.318 589 HA VAL 96 HA VAL 96 -19.730 12.455 -15.058 590 HB VAL 96 HB VAL 96 -17.691 11.040 -14.798 591 HG11 VAL 96 1HG1 VAL 96 -17.738 13.470 -14.188 592 HG12 VAL 96 2HG1 VAL 96 -17.945 12.980 -12.491 593 HG13 VAL 96 3HG1 VAL 96 -16.497 12.521 -13.347 594 HG21 VAL 96 1HG2 VAL 96 -18.239 9.324 -13.263 595 HG22 VAL 96 2HG2 VAL 96 -17.124 10.411 -12.400 596 HG23 VAL 96 3HG2 VAL 96 -18.833 10.480 -12.056 597 H ASN 97 H ASN 97 -19.460 11.190 -16.902 598 HA ASN 97 HA ASN 97 -21.390 9.105 -17.226 599 HB2 ASN 97 2HB ASN 97 -19.172 10.097 -19.089 600 HB3 ASN 97 3HB ASN 97 -20.471 9.016 -19.561 601 HD21 ASN 97 1HD2 ASN 97 -22.759 9.850 -19.307 602 HD22 ASN 97 2HD2 ASN 97 -22.998 11.574 -19.534 603 H SER 98 H SER 98 -17.806 8.946 -17.229 604 HA SER 98 HA SER 98 -17.396 6.325 -16.297 605 HB2 SER 98 2HB SER 98 -16.757 5.217 -18.500 606 HB3 SER 98 3HB SER 98 -18.488 5.345 -18.179 607 HG SER 98 HG SER 98 -16.996 7.139 -19.844 608 H PHE 99 H PHE 99 -15.228 5.868 -16.100 609 HA PHE 99 HA PHE 99 -13.435 8.111 -16.717 610 HB2 PHE 99 2HB PHE 99 -12.931 5.628 -15.055 611 HB3 PHE 99 3HB PHE 99 -12.005 7.124 -15.057 612 HD1 PHE 99 HD1 PHE 99 -13.239 9.316 -14.338 613 HD2 PHE 99 HD2 PHE 99 -14.767 5.353 -13.571 614 HE1 PHE 99 HE1 PHE 99 -14.760 10.218 -12.615 615 HE2 PHE 99 HE2 PHE 99 -16.321 6.275 -11.888 616 HZ PHE 99 HZ PHE 99 -16.292 8.667 -11.373 617 HA PRO 100 HA PRO 100 -12.160 5.496 -20.178 618 HB2 PRO 100 2HB PRO 100 -10.643 7.269 -21.619 619 HB3 PRO 100 3HB PRO 100 -12.434 7.339 -21.549 620 HG2 PRO 100 2HG PRO 100 -10.441 8.934 -19.917 621 HG3 PRO 100 3HG PRO 100 -11.882 9.531 -20.805 622 HD2 PRO 100 2HD PRO 100 -11.929 9.008 -18.125 623 HD3 PRO 100 3HD PRO 100 -13.353 8.696 -19.173 624 H LEU 101 H LEU 101 -10.519 4.043 -20.245 625 HA LEU 101 HA LEU 101 -8.500 4.225 -18.211 626 HB2 LEU 101 2HB LEU 101 -8.647 2.058 -20.324 627 HB3 LEU 101 3HB LEU 101 -8.039 1.956 -18.680 628 HG LEU 101 HG LEU 101 -10.943 2.210 -19.508 629 HD11 LEU 101 1HD1 LEU 101 -9.388 -0.139 -18.379 630 HD12 LEU 101 2HD1 LEU 101 -9.979 0.028 -20.044 631 HD13 LEU 101 3HD1 LEU 101 -11.138 -0.120 -18.717 632 HD21 LEU 101 1HD2 LEU 101 -11.547 1.834 -17.177 633 HD22 LEU 101 2HD2 LEU 101 -10.524 3.276 -17.267 634 HD23 LEU 101 3HD2 LEU 101 -9.843 1.733 -16.723 635 HA PRO 102 HA PRO 102 -5.007 5.310 -20.938 636 HB2 PRO 102 2HB PRO 102 -2.896 4.564 -19.391 637 HB3 PRO 102 3HB PRO 102 -3.907 5.977 -18.994 638 HG2 PRO 102 2HG PRO 102 -4.094 3.186 -17.815 639 HG3 PRO 102 3HG PRO 102 -4.084 4.762 -16.959 640 HD2 PRO 102 2HD PRO 102 -6.392 3.400 -17.584 641 HD3 PRO 102 3HD PRO 102 -6.314 5.183 -17.534 642 H LYS 103 H LYS 103 -5.368 2.125 -19.389 643 HA LYS 103 HA LYS 103 -4.804 0.710 -21.880 644 HB2 LYS 103 2HB LYS 103 -3.140 0.317 -19.372 645 HB3 LYS 103 3HB LYS 103 -3.428 -0.990 -20.505 646 HG2 LYS 103 2HG LYS 103 -1.481 -0.253 -21.394 647 HG3 LYS 103 3HG LYS 103 -2.577 0.805 -22.304 648 HD2 LYS 103 2HD LYS 103 -2.244 2.356 -20.167 649 HD3 LYS 103 3HD LYS 103 -0.770 1.422 -19.954 650 HE2 LYS 103 2HE LYS 103 -1.600 2.984 -22.444 651 HE3 LYS 103 3HE LYS 103 -0.471 3.570 -21.213 652 HZ1 LYS 103 HZ1 LYS 103 1.019 1.730 -21.771 653 HZ2 LYS 103 HZ2 LYS 103 0.718 2.636 -23.104 654 HZ3 LYS 103 HZ3 LYS 103 -0.013 1.186 -22.921 655 H ASP 104 H ASP 104 -5.720 -1.454 -21.853 656 HA ASP 104 HA ASP 104 -8.111 -1.546 -20.120 657 HB2 ASP 104 2HB ASP 104 -9.250 -2.312 -22.017 658 HB3 ASP 104 3HB ASP 104 -8.200 -1.034 -22.602 659 H GLN 105 H GLN 105 -5.380 -3.177 -19.733 660 HA GLN 105 HA GLN 105 -6.262 -5.894 -20.296 661 HB2 GLN 105 2HB GLN 105 -3.712 -4.915 -18.915 662 HB3 GLN 105 3HB GLN 105 -4.079 -6.578 -19.316 663 HG2 GLN 105 2HG GLN 105 -2.789 -6.053 -21.116 664 HG3 GLN 105 3HG GLN 105 -4.357 -5.664 -21.788 665 HE21 GLN 105 1HE2 GLN 105 -4.715 -3.449 -22.464 666 HE22 GLN 105 2HE2 GLN 105 -3.469 -2.232 -22.190 667 HA PRO 106 HA PRO 106 -8.087 -6.544 -16.298 668 HB2 PRO 106 2HB PRO 106 -7.808 -9.258 -15.925 669 HB3 PRO 106 3HB PRO 106 -8.961 -8.509 -17.074 670 HG2 PRO 106 2HG PRO 106 -6.169 -9.580 -17.641 671 HG3 PRO 106 3HG PRO 106 -7.685 -9.935 -18.528 672 HD2 PRO 106 2HD PRO 106 -5.958 -8.058 -19.415 673 HD3 PRO 106 3HD PRO 106 -7.722 -7.770 -19.504 674 H ASP 107 H ASP 107 -4.740 -6.761 -16.762 675 HA ASP 107 HA ASP 107 -4.084 -7.254 -13.909 676 HB2 ASP 107 2HB ASP 107 -2.552 -8.082 -15.637 677 HB3 ASP 107 3HB ASP 107 -2.401 -6.447 -16.300 678 H VAL 108 H VAL 108 -4.405 -4.551 -16.221 679 HA VAL 108 HA VAL 108 -3.480 -2.608 -14.166 680 HB VAL 108 HB VAL 108 -3.465 -0.941 -15.858 681 HG11 VAL 108 1HG1 VAL 108 -2.185 -3.448 -17.016 682 HG12 VAL 108 2HG1 VAL 108 -1.714 -1.770 -17.328 683 HG13 VAL 108 3HG1 VAL 108 -1.492 -2.467 -15.704 684 HG21 VAL 108 1HG2 VAL 108 -4.009 -1.297 -18.176 685 HG22 VAL 108 2HG2 VAL 108 -4.514 -2.948 -17.854 686 HG23 VAL 108 3HG2 VAL 108 -5.437 -1.575 -17.187 687 H VAL 109 H VAL 109 -6.466 -3.606 -15.812 688 HA VAL 109 HA VAL 109 -8.186 -1.520 -14.984 689 HB VAL 109 HB VAL 109 -8.631 -4.502 -15.344 690 HG11 VAL 109 1HG1 VAL 109 -10.462 -3.810 -13.888 691 HG12 VAL 109 2HG1 VAL 109 -10.781 -2.383 -14.898 692 HG13 VAL 109 3HG1 VAL 109 -11.084 -4.018 -15.521 693 HG21 VAL 109 1HG2 VAL 109 -9.509 -2.119 -17.052 694 HG22 VAL 109 2HG2 VAL 109 -8.043 -3.047 -17.374 695 HG23 VAL 109 3HG2 VAL 109 -9.626 -3.828 -17.494 696 H GLU 110 H GLU 110 -6.644 -4.023 -13.123 697 HA GLU 110 HA GLU 110 -8.328 -3.842 -10.760 698 HB2 GLU 110 2HB GLU 110 -5.668 -5.115 -11.311 699 HB3 GLU 110 3HB GLU 110 -6.523 -5.263 -9.771 700 HG2 GLU 110 2HG GLU 110 -7.781 -6.074 -12.430 701 HG3 GLU 110 3HG GLU 110 -6.829 -7.156 -11.416 702 H LYS 111 H LYS 111 -5.808 -1.836 -11.996 703 HA LYS 111 HA LYS 111 -4.890 -0.973 -9.298 704 HB2 LYS 111 2HB LYS 111 -3.753 -0.666 -12.086 705 HB3 LYS 111 3HB LYS 111 -3.303 0.461 -10.817 706 HG2 LYS 111 2HG LYS 111 -1.686 -1.328 -11.011 707 HG3 LYS 111 3HG LYS 111 -2.406 -1.281 -9.398 708 HD2 LYS 111 2HD LYS 111 -3.755 -3.218 -9.816 709 HD3 LYS 111 3HD LYS 111 -3.471 -3.096 -11.560 710 HE2 LYS 111 2HE LYS 111 -1.011 -3.514 -11.069 711 HE3 LYS 111 3HE LYS 111 -1.469 -3.805 -9.390 712 HZ1 LYS 111 HZ1 LYS 111 -2.526 -5.341 -11.720 713 HZ2 LYS 111 HZ2 LYS 111 -2.808 -5.688 -10.146 714 HZ3 LYS 111 HZ3 LYS 111 -1.303 -5.868 -10.788 715 H LEU 112 H LEU 112 -6.403 0.238 -12.215 716 HA LEU 112 HA LEU 112 -6.605 2.975 -11.233 717 HB2 LEU 112 2HB LEU 112 -7.818 3.415 -13.384 718 HB3 LEU 112 3HB LEU 112 -6.244 2.710 -13.511 719 HG LEU 112 HG LEU 112 -7.278 0.529 -13.761 720 HD11 LEU 112 1HD1 LEU 112 -9.504 0.246 -14.665 721 HD12 LEU 112 2HD1 LEU 112 -9.850 1.958 -14.357 722 HD13 LEU 112 3HD1 LEU 112 -9.516 0.822 -13.012 723 HD21 LEU 112 1HD2 LEU 112 -6.234 1.657 -15.604 724 HD22 LEU 112 2HD2 LEU 112 -7.754 2.517 -15.961 725 HD23 LEU 112 3HD2 LEU 112 -7.637 0.748 -16.166 726 H LYS 113 H LYS 113 -8.631 0.184 -10.903 727 HA LYS 113 HA LYS 113 -11.100 1.536 -10.491 728 HB2 LYS 113 2HB LYS 113 -11.807 -0.592 -9.402 729 HB3 LYS 113 3HB LYS 113 -11.069 -0.806 -11.006 730 HG2 LYS 113 2HG LYS 113 -9.047 -1.651 -10.080 731 HG3 LYS 113 3HG LYS 113 -9.409 -1.070 -8.463 732 HD2 LYS 113 2HD LYS 113 -9.592 -3.579 -8.957 733 HD3 LYS 113 3HD LYS 113 -10.834 -2.806 -7.983 734 HE2 LYS 113 2HE LYS 113 -12.380 -2.709 -9.818 735 HE3 LYS 113 3HE LYS 113 -11.145 -3.242 -10.978 736 HZ1 LYS 113 HZ1 LYS 113 -12.091 -4.934 -8.730 737 HZ2 LYS 113 HZ2 LYS 113 -11.108 -5.380 -9.982 738 HZ3 LYS 113 HZ3 LYS 113 -12.674 -5.032 -10.259 739 H ASN 114 H ASN 114 -8.434 1.147 -8.345 740 HA ASN 114 HA ASN 114 -10.052 2.248 -6.078 741 HB2 ASN 114 2HB ASN 114 -7.811 0.253 -5.748 742 HB3 ASN 114 3HB ASN 114 -8.879 0.916 -4.509 743 HD21 ASN 114 1HD2 ASN 114 -11.375 0.560 -6.141 744 HD22 ASN 114 2HD2 ASN 114 -11.669 -1.164 -6.033 745 H ILE 115 H ILE 115 -9.382 4.358 -6.665 746 HA ILE 115 HA ILE 115 -6.499 4.983 -6.217 747 HB ILE 115 HB ILE 115 -6.800 7.011 -7.471 748 HG12 ILE 115 2HG1 ILE 115 -9.268 7.271 -7.112 749 HG13 ILE 115 3HG1 ILE 115 -8.661 7.657 -8.672 750 HG21 ILE 115 1HG2 ILE 115 -6.877 5.956 -9.733 751 HG22 ILE 115 2HG2 ILE 115 -5.806 5.141 -8.570 752 HG23 ILE 115 3HG2 ILE 115 -7.378 4.440 -8.968 753 HD11 ILE 115 1HD1 ILE 115 -10.181 5.150 -7.969 754 HD12 ILE 115 2HD1 ILE 115 -10.713 6.522 -8.962 755 HD13 ILE 115 3HD1 ILE 115 -9.434 5.463 -9.541 756 H ASN 116 H ASN 116 -5.934 6.861 -5.097 757 HA ASN 116 HA ASN 116 -8.089 8.118 -3.495 758 HB2 ASN 116 2HB ASN 116 -5.191 8.900 -3.293 759 HB3 ASN 116 3HB ASN 116 -6.542 9.176 -2.185 760 HD21 ASN 116 1HD2 ASN 116 -7.499 6.350 -2.028 761 HD22 ASN 116 2HD2 ASN 116 -6.240 5.550 -1.120 762 H LEU 117 H LEU 117 -8.807 10.101 -4.053 763 HA LEU 117 HA LEU 117 -7.326 11.792 -6.046 764 HB2 LEU 117 2HB LEU 117 -10.055 12.202 -4.757 765 HB3 LEU 117 3HB LEU 117 -9.269 13.326 -5.846 766 HG LEU 117 HG LEU 117 -10.207 10.505 -6.562 767 HD11 LEU 117 1HD1 LEU 117 -11.327 13.240 -7.320 768 HD12 LEU 117 2HD1 LEU 117 -12.039 12.109 -6.141 769 HD13 LEU 117 3HD1 LEU 117 -11.956 11.672 -7.869 770 HD21 LEU 117 1HD2 LEU 117 -8.310 11.050 -7.978 771 HD22 LEU 117 2HD2 LEU 117 -8.968 12.672 -8.302 772 HD23 LEU 117 3HD2 LEU 117 -9.797 11.231 -8.926 773 H THR 118 H THR 118 -5.831 13.028 -5.108 774 HA THR 118 HA THR 118 -6.204 13.989 -2.319 775 HB THR 118 HB THR 118 -3.690 12.650 -3.381 776 HG1 THR 118 HG1 THR 118 -4.251 11.116 -1.808 777 HG21 THR 118 1HG2 THR 118 -3.003 12.866 -0.948 778 HG22 THR 118 2HG2 THR 118 -4.410 13.913 -0.705 779 HG23 THR 118 3HG2 THR 118 -3.097 14.415 -1.792 780 H VAL 119 H VAL 119 -5.777 16.021 -2.053 781 HA VAL 119 HA VAL 119 -4.524 17.680 -4.177 782 HB VAL 119 HB VAL 119 -7.197 17.712 -2.703 783 HG11 VAL 119 1HG1 VAL 119 -5.872 20.005 -4.147 784 HG12 VAL 119 2HG1 VAL 119 -7.610 19.938 -3.766 785 HG13 VAL 119 3HG1 VAL 119 -6.442 19.919 -2.445 786 HG21 VAL 119 1HG2 VAL 119 -6.473 17.819 -5.657 787 HG22 VAL 119 2HG2 VAL 119 -7.200 16.453 -4.769 788 HG23 VAL 119 3HG2 VAL 119 -8.123 17.940 -4.990 789 H ALA 120 H ALA 120 -3.453 19.534 -3.381 790 HA ALA 120 HA ALA 120 -3.531 20.310 -0.546 791 HB1 ALA 120 1HB ALA 120 -1.042 19.101 -1.853 792 HB2 ALA 120 2HB ALA 120 -1.073 19.903 -0.269 793 HB3 ALA 120 3HB ALA 120 -1.990 18.418 -0.505 794 HA PRO 121 HA PRO 121 -2.778 24.209 -2.324 795 HB2 PRO 121 2HB PRO 121 -1.820 25.746 -0.311 796 HB3 PRO 121 3HB PRO 121 -3.413 24.943 -0.208 797 HG2 PRO 121 2HG PRO 121 -0.766 24.012 0.942 798 HG3 PRO 121 3HG PRO 121 -2.354 24.114 1.766 799 HD2 PRO 121 2HD PRO 121 -1.353 21.817 0.634 800 HD3 PRO 121 3HD PRO 121 -3.096 22.136 0.759 801 H GLU 122 H GLU 122 -1.179 25.985 -2.811 802 HA GLU 122 HA GLU 122 1.659 25.542 -2.563 803 HB2 GLU 122 2HB GLU 122 2.194 25.301 -4.923 804 HB3 GLU 122 3HB GLU 122 1.284 23.909 -4.351 805 HG2 GLU 122 2HG GLU 122 -0.781 24.796 -5.390 806 HG3 GLU 122 3HG GLU 122 0.103 26.213 -5.958 Start of MODEL 7 1 H1 ALA 22 H ALA 22 13.590 1.955 -22.198 2 HA ALA 22 HA ALA 22 16.308 0.705 -22.397 3 HB1 ALA 22 1HB ALA 22 15.475 3.498 -21.475 4 HB2 ALA 22 2HB ALA 22 17.138 2.857 -21.550 5 HB3 ALA 22 3HB ALA 22 16.221 3.112 -23.047 6 H ALA 23 H ALA 23 13.476 0.830 -20.559 7 HA ALA 23 HA ALA 23 14.731 -0.156 -18.089 8 HB1 ALA 23 1HB ALA 23 14.779 2.314 -17.914 9 HB2 ALA 23 2HB ALA 23 13.061 2.397 -18.337 10 HB3 ALA 23 3HB ALA 23 13.566 1.665 -16.782 11 H ARG 24 H ARG 24 12.708 0.009 -16.516 12 HA ARG 24 HA ARG 24 10.231 -0.475 -16.484 13 HB2 ARG 24 2HB ARG 24 9.569 -2.806 -16.996 14 HB3 ARG 24 3HB ARG 24 10.033 -1.866 -18.384 15 HG2 ARG 24 2HG ARG 24 12.429 -3.088 -17.913 16 HG3 ARG 24 3HG ARG 24 11.375 -4.263 -17.120 17 HD2 ARG 24 2HD ARG 24 10.106 -4.595 -19.146 18 HD3 ARG 24 3HD ARG 24 10.846 -3.191 -19.913 19 HE ARG 24 HE ARG 24 12.018 -5.870 -19.636 20 HH11 ARG 24 1HH1 ARG 24 12.693 -2.467 -20.417 21 HH12 ARG 24 2HH1 ARG 24 13.999 -2.894 -21.491 22 HH21 ARG 24 1HH2 ARG 24 13.816 -6.308 -20.905 23 HH22 ARG 24 2HH2 ARG 24 14.689 -5.015 -21.671 24 H GLN 25 H GLN 25 12.599 -0.244 -14.854 25 HA GLN 25 HA GLN 25 12.602 -2.601 -13.026 26 HB2 GLN 25 2HB GLN 25 14.507 -0.240 -13.140 27 HB3 GLN 25 3HB GLN 25 14.745 -1.781 -12.320 28 HG2 GLN 25 2HG GLN 25 14.623 -1.393 -15.349 29 HG3 GLN 25 3HG GLN 25 16.074 -1.566 -14.394 30 HE21 GLN 25 1HE2 GLN 25 13.472 -3.310 -16.008 31 HE22 GLN 25 2HE2 GLN 25 14.029 -4.897 -15.524 32 H GLN 26 H GLN 26 11.542 0.669 -13.194 33 HA GLN 26 HA GLN 26 10.794 0.746 -10.307 34 HB2 GLN 26 2HB GLN 26 11.691 2.932 -10.086 35 HB3 GLN 26 3HB GLN 26 12.969 1.853 -10.640 36 HG2 GLN 26 2HG GLN 26 11.407 3.812 -12.383 37 HG3 GLN 26 3HG GLN 26 13.032 4.066 -11.755 38 HE21 GLN 26 1HE2 GLN 26 14.788 2.549 -12.545 39 HE22 GLN 26 2HE2 GLN 26 14.602 1.918 -14.162 40 H PHE 27 H PHE 27 10.097 1.860 -13.579 41 HA PHE 27 HA PHE 27 8.481 3.935 -13.134 42 HB2 PHE 27 2HB PHE 27 8.171 3.938 -15.331 43 HB3 PHE 27 3HB PHE 27 9.516 2.793 -15.278 44 HD1 PHE 27 HD1 PHE 27 8.648 0.221 -14.903 45 HD2 PHE 27 HD2 PHE 27 6.342 3.406 -16.649 46 HE1 PHE 27 HE1 PHE 27 7.236 -1.444 -16.076 47 HE2 PHE 27 HE2 PHE 27 4.900 1.756 -17.780 48 HZ PHE 27 HZ PHE 27 5.339 -0.691 -17.510 49 H VAL 28 H VAL 28 7.345 1.121 -11.871 50 HA VAL 28 HA VAL 28 4.542 1.151 -12.580 51 HB VAL 28 HB VAL 28 4.182 0.184 -10.268 52 HG11 VAL 28 1HG1 VAL 28 6.201 -1.227 -12.077 53 HG12 VAL 28 2HG1 VAL 28 5.127 -2.004 -10.896 54 HG13 VAL 28 3HG1 VAL 28 4.448 -1.189 -12.319 55 HG21 VAL 28 1HG2 VAL 28 6.070 -0.663 -8.989 56 HG22 VAL 28 2HG2 VAL 28 7.232 0.041 -10.116 57 HG23 VAL 28 3HG2 VAL 28 6.196 1.099 -9.129 58 H THR 29 H THR 29 6.476 3.088 -10.347 59 HA THR 29 HA THR 29 4.307 4.613 -9.201 60 HB THR 29 HB THR 29 6.475 4.366 -8.193 61 HG1 THR 29 HG1 THR 29 6.604 6.533 -7.549 62 HG21 THR 29 1HG2 THR 29 7.592 6.371 -10.214 63 HG22 THR 29 2HG2 THR 29 7.890 4.627 -10.331 64 HG23 THR 29 3HG2 THR 29 8.460 5.525 -8.911 65 H SER 30 H SER 30 6.445 5.242 -12.027 66 HA SER 30 HA SER 30 5.494 7.788 -12.679 67 HB2 SER 30 2HB SER 30 6.356 5.694 -14.701 68 HB3 SER 30 3HB SER 30 6.505 7.449 -14.814 69 HG SER 30 HG SER 30 8.498 6.670 -14.201 70 H GLU 31 H GLU 31 4.015 4.642 -13.427 71 HA GLU 31 HA GLU 31 1.967 5.704 -15.176 72 HB2 GLU 31 2HB GLU 31 2.019 3.140 -13.536 73 HB3 GLU 31 3HB GLU 31 0.758 3.589 -14.696 74 HG2 GLU 31 2HG GLU 31 2.697 3.881 -16.410 75 HG3 GLU 31 3HG GLU 31 3.676 2.968 -15.267 76 H VAL 32 H VAL 32 2.267 5.833 -11.626 77 HA VAL 32 HA VAL 32 -0.572 6.015 -11.089 78 HB VAL 32 HB VAL 32 1.722 7.206 -9.483 79 HG11 VAL 32 1HG1 VAL 32 -1.173 6.663 -8.722 80 HG12 VAL 32 2HG1 VAL 32 0.132 7.000 -7.559 81 HG13 VAL 32 3HG1 VAL 32 -0.322 8.226 -8.733 82 HG21 VAL 32 1HG2 VAL 32 0.269 4.526 -9.171 83 HG22 VAL 32 2HG2 VAL 32 1.941 4.720 -9.747 84 HG23 VAL 32 3HG2 VAL 32 1.530 5.161 -8.094 85 H GLY 33 H GLY 33 1.739 8.321 -12.359 86 HA2 GLY 33 HA2 GLY 33 0.171 10.745 -12.081 87 HA3 GLY 33 HA3 GLY 33 1.542 10.464 -13.189 88 H ARG 34 H ARG 34 -0.404 8.002 -13.978 89 HA ARG 34 HA ARG 34 -2.361 9.513 -15.676 90 HB2 ARG 34 2HB ARG 34 -1.301 6.686 -16.004 91 HB3 ARG 34 3HB ARG 34 -2.430 7.495 -17.078 92 HG2 ARG 34 2HG ARG 34 0.487 8.319 -16.643 93 HG3 ARG 34 3HG ARG 34 -0.090 7.237 -17.905 94 HD2 ARG 34 2HD ARG 34 0.095 9.320 -18.930 95 HD3 ARG 34 3HD ARG 34 -1.640 9.023 -18.693 96 HE ARG 34 HE ARG 34 -0.604 10.476 -16.456 97 HH11 ARG 34 1HH1 ARG 34 -1.248 11.184 -19.868 98 HH12 ARG 34 2HH1 ARG 34 -1.561 12.863 -19.539 99 HH21 ARG 34 1HH2 ARG 34 -1.002 12.586 -16.100 100 HH22 ARG 34 2HH2 ARG 34 -1.388 13.661 -17.422 101 H TYR 35 H TYR 35 -1.938 6.497 -13.858 102 HA TYR 35 HA TYR 35 -4.522 5.524 -14.127 103 HB2 TYR 35 2HB TYR 35 -2.170 4.926 -12.331 104 HB3 TYR 35 3HB TYR 35 -3.703 4.131 -11.981 105 HD1 TYR 35 HD1 TYR 35 -1.646 4.931 -15.014 106 HD2 TYR 35 HD2 TYR 35 -4.114 2.085 -12.983 107 HE1 TYR 35 HE1 TYR 35 -1.601 3.536 -17.039 108 HE2 TYR 35 HE2 TYR 35 -4.094 0.655 -14.978 109 HH TYR 35 HH TYR 35 -3.420 0.409 -17.153 110 H GLY 36 H GLY 36 -3.580 7.809 -11.814 111 HA2 GLY 36 HA2 GLY 36 -6.308 7.818 -10.560 112 HA3 GLY 36 HA3 GLY 36 -4.870 8.478 -9.802 113 H ALA 37 H ALA 37 -4.315 9.476 -12.806 114 HA ALA 37 HA ALA 37 -5.304 12.157 -12.288 115 HB1 ALA 37 1HB ALA 37 -2.979 11.789 -13.011 116 HB2 ALA 37 2HB ALA 37 -3.567 11.093 -14.537 117 HB3 ALA 37 3HB ALA 37 -3.876 12.793 -14.160 118 H ILE 38 H ILE 38 -5.995 9.423 -14.489 119 HA ILE 38 HA ILE 38 -7.706 10.881 -16.301 120 HB ILE 38 HB ILE 38 -8.555 8.694 -16.938 121 HG12 ILE 38 2HG1 ILE 38 -7.319 7.650 -14.344 122 HG13 ILE 38 3HG1 ILE 38 -9.038 7.736 -14.734 123 HG21 ILE 38 1HG2 ILE 38 -5.655 8.076 -16.251 124 HG22 ILE 38 2HG2 ILE 38 -6.570 7.689 -17.712 125 HG23 ILE 38 3HG2 ILE 38 -6.065 9.354 -17.407 126 HD11 ILE 38 1HD1 ILE 38 -7.021 5.927 -16.086 127 HD12 ILE 38 2HD1 ILE 38 -8.290 5.473 -14.941 128 HD13 ILE 38 3HD1 ILE 38 -8.747 6.097 -16.527 129 H TYR 39 H TYR 39 -8.250 9.702 -13.090 130 HA TYR 39 HA TYR 39 -11.139 10.117 -13.094 131 HB2 TYR 39 2HB TYR 39 -9.172 9.634 -10.811 132 HB3 TYR 39 3HB TYR 39 -10.921 9.622 -10.679 133 HD1 TYR 39 HD1 TYR 39 -7.989 7.669 -11.780 134 HD2 TYR 39 HD2 TYR 39 -12.288 7.867 -11.690 135 HE1 TYR 39 HE1 TYR 39 -8.098 5.258 -12.483 136 HE2 TYR 39 HE2 TYR 39 -12.389 5.544 -12.545 137 HH TYR 39 HH TYR 39 -9.562 3.565 -13.193 138 H THR 40 H THR 40 -8.365 11.725 -11.471 139 HA THR 40 HA THR 40 -9.835 13.832 -10.305 140 HB THR 40 HB THR 40 -7.424 12.998 -9.874 141 HG1 THR 40 HG1 THR 40 -8.051 15.784 -9.864 142 HG21 THR 40 1HG2 THR 40 -6.668 13.673 -12.225 143 HG22 THR 40 2HG2 THR 40 -5.608 14.064 -10.870 144 HG23 THR 40 3HG2 THR 40 -6.616 15.330 -11.629 145 H GLN 41 H GLN 41 -8.476 13.612 -13.562 146 HA GLN 41 HA GLN 41 -8.852 16.358 -14.346 147 HB2 GLN 41 2HB GLN 41 -8.520 13.754 -15.843 148 HB3 GLN 41 3HB GLN 41 -8.819 15.286 -16.680 149 HG2 GLN 41 2HG GLN 41 -6.831 16.308 -15.694 150 HG3 GLN 41 3HG GLN 41 -6.510 14.831 -14.767 151 HE21 GLN 41 1HE2 GLN 41 -6.320 12.819 -16.056 152 HE22 GLN 41 2HE2 GLN 41 -5.462 12.902 -17.612 153 H LEU 42 H LEU 42 -10.898 13.414 -14.527 154 HA LEU 42 HA LEU 42 -13.003 14.771 -16.007 155 HB2 LEU 42 2HB LEU 42 -12.479 12.267 -16.015 156 HB3 LEU 42 3HB LEU 42 -13.178 12.241 -14.386 157 HG LEU 42 HG LEU 42 -15.349 12.973 -15.307 158 HD11 LEU 42 1HD1 LEU 42 -15.722 12.985 -17.787 159 HD12 LEU 42 2HD1 LEU 42 -13.965 12.882 -18.022 160 HD13 LEU 42 3HD1 LEU 42 -14.695 14.305 -17.245 161 HD21 LEU 42 1HD2 LEU 42 -15.000 10.600 -15.148 162 HD22 LEU 42 2HD2 LEU 42 -14.154 10.565 -16.713 163 HD23 LEU 42 3HD2 LEU 42 -15.901 10.928 -16.625 164 H ILE 43 H ILE 43 -12.341 14.257 -12.592 165 HA ILE 43 HA ILE 43 -14.947 15.167 -11.679 166 HB ILE 43 HB ILE 43 -12.304 14.467 -10.356 167 HG12 ILE 43 2HG1 ILE 43 -13.923 13.069 -8.999 168 HG13 ILE 43 3HG1 ILE 43 -15.232 13.688 -10.020 169 HG21 ILE 43 1HG2 ILE 43 -14.664 15.871 -9.025 170 HG22 ILE 43 2HG2 ILE 43 -13.303 15.083 -8.174 171 HG23 ILE 43 3HG2 ILE 43 -13.001 16.513 -9.145 172 HD11 ILE 43 1HD1 ILE 43 -12.935 11.911 -10.869 173 HD12 ILE 43 2HD1 ILE 43 -14.631 11.465 -10.676 174 HD13 ILE 43 3HD1 ILE 43 -14.180 12.584 -11.982 175 H ARG 44 H ARG 44 -11.718 16.730 -11.734 176 HA ARG 44 HA ARG 44 -12.677 19.216 -10.713 177 HB2 ARG 44 2HB ARG 44 -10.526 20.077 -11.105 178 HB3 ARG 44 3HB ARG 44 -10.347 18.380 -10.693 179 HG2 ARG 44 2HG ARG 44 -8.803 18.643 -12.342 180 HG3 ARG 44 3HG ARG 44 -10.169 17.965 -13.239 181 HD2 ARG 44 2HD ARG 44 -10.631 20.069 -14.285 182 HD3 ARG 44 3HD ARG 44 -9.683 20.949 -13.093 183 HE ARG 44 HE ARG 44 -7.759 20.526 -14.237 184 HH11 ARG 44 1HH1 ARG 44 -10.127 18.269 -15.642 185 HH12 ARG 44 2HH1 ARG 44 -9.175 18.089 -17.087 186 HH21 ARG 44 1HH2 ARG 44 -6.563 20.098 -16.043 187 HH22 ARG 44 2HH2 ARG 44 -7.150 19.001 -17.248 188 H GLN 45 H GLN 45 -12.804 17.885 -13.937 189 HA GLN 45 HA GLN 45 -13.264 20.472 -15.222 190 HB2 GLN 45 2HB GLN 45 -13.337 19.486 -17.186 191 HB3 GLN 45 3HB GLN 45 -12.283 18.428 -16.239 192 HG2 GLN 45 2HG GLN 45 -14.203 16.838 -16.005 193 HG3 GLN 45 3HG GLN 45 -15.200 17.904 -17.003 194 HE21 GLN 45 1HE2 GLN 45 -11.891 16.445 -17.049 195 HE22 GLN 45 2HE2 GLN 45 -11.869 16.235 -18.794 196 H ASN 46 H ASN 46 -15.391 18.357 -13.338 197 HA ASN 46 HA ASN 46 -17.803 19.759 -14.331 198 HB2 ASN 46 2HB ASN 46 -17.326 18.178 -11.778 199 HB3 ASN 46 3HB ASN 46 -18.882 18.760 -12.364 200 HD21 ASN 46 1HD2 ASN 46 -16.701 16.168 -12.380 201 HD22 ASN 46 2HD2 ASN 46 -17.652 15.193 -13.497 202 H LEU 47 H LEU 47 -15.425 19.989 -11.694 203 HA LEU 47 HA LEU 47 -17.094 21.817 -10.150 204 HB2 LEU 47 2HB LEU 47 -14.460 20.425 -9.582 205 HB3 LEU 47 3HB LEU 47 -15.442 21.344 -8.445 206 HG LEU 47 HG LEU 47 -16.348 18.830 -9.747 207 HD11 LEU 47 1HD1 LEU 47 -15.318 19.526 -7.007 208 HD12 LEU 47 2HD1 LEU 47 -14.438 18.632 -8.273 209 HD13 LEU 47 3HD1 LEU 47 -15.895 17.910 -7.517 210 HD21 LEU 47 1HD2 LEU 47 -18.101 18.931 -7.866 211 HD22 LEU 47 2HD2 LEU 47 -18.331 20.082 -9.185 212 HD23 LEU 47 3HD2 LEU 47 -17.630 20.619 -7.645 213 H LEU 48 H LEU 48 -16.934 23.553 -11.397 214 HA LEU 48 HA LEU 48 -14.456 24.973 -11.897 215 HB2 LEU 48 2HB LEU 48 -15.981 26.720 -12.895 216 HB3 LEU 48 3HB LEU 48 -16.026 25.118 -13.591 217 HG LEU 48 HG LEU 48 -18.150 24.614 -12.523 218 HD11 LEU 48 1HD1 LEU 48 -19.481 26.356 -11.356 219 HD12 LEU 48 2HD1 LEU 48 -18.072 27.433 -11.354 220 HD13 LEU 48 3HD1 LEU 48 -18.045 25.896 -10.432 221 HD21 LEU 48 1HD2 LEU 48 -18.091 25.742 -14.728 222 HD22 LEU 48 2HD2 LEU 48 -18.176 27.318 -13.927 223 HD23 LEU 48 3HD2 LEU 48 -19.542 26.185 -13.803 224 H VAL 49 H VAL 49 -14.791 24.534 -9.159 225 HA VAL 49 HA VAL 49 -16.020 26.894 -7.964 226 HB VAL 49 HB VAL 49 -14.655 24.652 -6.489 227 HG11 VAL 49 1HG1 VAL 49 -14.995 26.627 -5.078 228 HG12 VAL 49 2HG1 VAL 49 -16.696 26.725 -5.580 229 HG13 VAL 49 3HG1 VAL 49 -16.134 25.348 -4.615 230 HG21 VAL 49 1HG2 VAL 49 -17.589 24.970 -7.292 231 HG22 VAL 49 2HG2 VAL 49 -16.483 23.710 -7.862 232 HG23 VAL 49 3HG2 VAL 49 -16.964 23.737 -6.163 233 H GLU 50 H GLU 50 -12.789 25.471 -7.416 234 HA GLU 50 HA GLU 50 -10.717 26.296 -7.280 235 HB2 GLU 50 2HB GLU 50 -11.752 28.967 -8.309 236 HB3 GLU 50 3HB GLU 50 -10.091 28.385 -8.278 237 HG2 GLU 50 2HG GLU 50 -10.793 26.490 -9.793 238 HG3 GLU 50 3HG GLU 50 -12.381 27.258 -9.938 239 H ASP 51 H ASP 51 -12.729 29.088 -6.183 240 HA ASP 51 HA ASP 51 -10.853 30.045 -4.281 241 HB2 ASP 51 2HB ASP 51 -12.656 31.382 -5.277 242 HB3 ASP 51 3HB ASP 51 -13.874 30.393 -4.464 243 H SER 52 H SER 52 -13.531 27.746 -3.873 244 HA SER 52 HA SER 52 -13.002 27.454 -0.953 245 HB2 SER 52 2HB SER 52 -14.944 26.012 -2.777 246 HB3 SER 52 3HB SER 52 -14.827 25.799 -1.032 247 HG SER 52 HG SER 52 -15.323 28.329 -2.262 248 H PHE 53 H PHE 53 -11.425 26.241 -3.672 249 HA PHE 53 HA PHE 53 -10.841 23.565 -2.511 250 HB2 PHE 53 2HB PHE 53 -10.389 24.761 -5.247 251 HB3 PHE 53 3HB PHE 53 -9.904 23.150 -4.744 252 HD1 PHE 53 HD1 PHE 53 -11.356 23.249 -7.117 253 HD2 PHE 53 HD2 PHE 53 -12.959 23.303 -3.099 254 HE1 PHE 53 HE1 PHE 53 -13.373 22.081 -7.884 255 HE2 PHE 53 HE2 PHE 53 -14.980 22.227 -3.877 256 HZ PHE 53 HZ PHE 53 -15.213 21.554 -6.285 257 H ARG 54 H ARG 54 -9.405 26.693 -3.087 258 HA ARG 54 HA ARG 54 -6.663 25.648 -2.827 259 HB2 ARG 54 2HB ARG 54 -5.912 27.621 -3.857 260 HB3 ARG 54 3HB ARG 54 -7.314 27.018 -4.733 261 HG2 ARG 54 2HG ARG 54 -7.587 29.313 -4.744 262 HG3 ARG 54 3HG ARG 54 -8.723 28.751 -3.520 263 HD2 ARG 54 2HD ARG 54 -6.106 29.443 -2.349 264 HD3 ARG 54 3HD ARG 54 -6.734 30.776 -3.291 265 HE ARG 54 HE ARG 54 -7.896 29.618 -0.834 266 HH11 ARG 54 1HH1 ARG 54 -8.591 31.688 -3.615 267 HH12 ARG 54 2HH1 ARG 54 -10.023 32.355 -2.856 268 HH21 ARG 54 1HH2 ARG 54 -9.598 30.742 0.164 269 HH22 ARG 54 2HH2 ARG 54 -10.508 31.898 -0.763 270 H GLY 55 H GLY 55 -5.095 26.586 -1.512 271 HA2 GLY 55 HA2 GLY 55 -4.229 27.492 0.462 272 HA3 GLY 55 HA3 GLY 55 -5.844 28.141 0.880 273 H LYS 56 H LYS 56 -6.251 24.907 0.157 274 HA LYS 56 HA LYS 56 -5.532 23.815 2.796 275 HB2 LYS 56 2HB LYS 56 -7.852 23.002 3.150 276 HB3 LYS 56 3HB LYS 56 -7.668 24.736 3.236 277 HG2 LYS 56 2HG LYS 56 -9.686 24.350 2.133 278 HG3 LYS 56 3HG LYS 56 -8.605 24.933 0.897 279 HD2 LYS 56 2HD LYS 56 -8.352 22.777 -0.085 280 HD3 LYS 56 3HD LYS 56 -9.060 21.929 1.315 281 HE2 LYS 56 2HE LYS 56 -10.451 23.790 -0.621 282 HE3 LYS 56 3HE LYS 56 -10.537 22.029 -0.666 283 HZ1 LYS 56 HZ1 LYS 56 -11.480 23.638 1.637 284 HZ2 LYS 56 HZ2 LYS 56 -11.814 22.046 1.340 285 HZ3 LYS 56 HZ3 LYS 56 -12.455 23.244 0.402 286 H GLN 57 H GLN 57 -6.405 21.388 2.830 287 HA GLN 57 HA GLN 57 -5.637 20.089 0.251 288 HB2 GLN 57 2HB GLN 57 -4.041 18.827 1.279 289 HB3 GLN 57 3HB GLN 57 -3.951 20.250 2.253 290 HG2 GLN 57 2HG GLN 57 -4.062 18.844 3.975 291 HG3 GLN 57 3HG GLN 57 -5.804 18.865 3.710 292 HE21 GLN 57 1HE2 GLN 57 -4.672 17.050 1.100 293 HE22 GLN 57 2HE2 GLN 57 -4.850 15.498 1.903 294 H CYS 58 H CYS 58 -6.554 17.917 -0.064 295 HA CYS 58 HA CYS 58 -8.511 16.906 1.855 296 HB2 CYS 58 2HB CYS 58 -9.860 18.519 0.612 297 HB3 CYS 58 3HB CYS 58 -9.325 17.824 -0.928 298 HG CYS 58 HG CYS 58 -10.422 15.507 -0.675 299 H ARG 59 H ARG 59 -8.813 14.713 1.678 300 HA ARG 59 HA ARG 59 -7.692 13.287 -0.636 301 HB2 ARG 59 2HB ARG 59 -6.824 11.502 0.768 302 HB3 ARG 59 3HB ARG 59 -5.919 12.988 0.913 303 HG2 ARG 59 2HG ARG 59 -8.011 12.517 3.015 304 HG3 ARG 59 3HG ARG 59 -6.630 11.436 2.986 305 HD2 ARG 59 2HD ARG 59 -5.186 13.595 2.973 306 HD3 ARG 59 3HD ARG 59 -6.715 14.430 3.340 307 HE ARG 59 HE ARG 59 -6.594 13.699 5.496 308 HH11 ARG 59 1HH1 ARG 59 -4.296 11.693 3.693 309 HH12 ARG 59 2HH1 ARG 59 -3.631 11.006 5.142 310 HH21 ARG 59 1HH2 ARG 59 -5.734 12.751 7.296 311 HH22 ARG 59 2HH2 ARG 59 -4.453 11.579 7.157 312 H VAL 60 H VAL 60 -9.103 11.911 -1.481 313 HA VAL 60 HA VAL 60 -10.985 10.449 0.285 314 HB VAL 60 HB VAL 60 -12.930 10.838 -1.074 315 HG11 VAL 60 1HG1 VAL 60 -12.437 12.451 0.799 316 HG12 VAL 60 2HG1 VAL 60 -11.742 13.557 -0.383 317 HG13 VAL 60 3HG1 VAL 60 -13.459 13.134 -0.490 318 HG21 VAL 60 1HG2 VAL 60 -11.315 12.827 -2.729 319 HG22 VAL 60 2HG2 VAL 60 -11.839 11.207 -3.282 320 HG23 VAL 60 3HG2 VAL 60 -13.039 12.460 -2.895 321 H ASN 61 H ASN 61 -12.080 8.662 -1.137 322 HA ASN 61 HA ASN 61 -10.140 7.707 -3.149 323 HB2 ASN 61 2HB ASN 61 -9.461 6.781 -1.039 324 HB3 ASN 61 3HB ASN 61 -11.115 6.323 -0.627 325 HD21 ASN 61 1HD2 ASN 61 -12.157 4.635 -2.022 326 HD22 ASN 61 2HD2 ASN 61 -11.122 3.409 -2.739 327 H LEU 62 H LEU 62 -10.879 6.703 -4.856 328 HA LEU 62 HA LEU 62 -13.861 6.328 -5.113 329 HB2 LEU 62 2HB LEU 62 -11.619 7.089 -6.967 330 HB3 LEU 62 3HB LEU 62 -13.014 6.233 -7.619 331 HG LEU 62 HG LEU 62 -14.520 7.979 -6.903 332 HD11 LEU 62 1HD1 LEU 62 -13.626 10.179 -6.044 333 HD12 LEU 62 2HD1 LEU 62 -12.057 9.376 -5.750 334 HD13 LEU 62 3HD1 LEU 62 -13.509 8.867 -4.876 335 HD21 LEU 62 1HD2 LEU 62 -13.402 8.113 -9.093 336 HD22 LEU 62 2HD2 LEU 62 -12.030 8.982 -8.375 337 HD23 LEU 62 3HD2 LEU 62 -13.618 9.748 -8.454 338 H LYS 63 H LYS 63 -14.670 4.394 -5.377 339 HA LYS 63 HA LYS 63 -12.934 2.082 -6.152 340 HB2 LYS 63 2HB LYS 63 -15.476 2.079 -4.482 341 HB3 LYS 63 3HB LYS 63 -14.455 0.687 -4.872 342 HG2 LYS 63 2HG LYS 63 -12.602 1.715 -3.564 343 HG3 LYS 63 3HG LYS 63 -13.655 3.094 -3.167 344 HD2 LYS 63 2HD LYS 63 -15.268 1.537 -2.075 345 HD3 LYS 63 3HD LYS 63 -14.122 0.201 -2.354 346 HE2 LYS 63 2HE LYS 63 -12.413 1.355 -1.010 347 HE3 LYS 63 3HE LYS 63 -13.461 2.760 -0.828 348 HZ1 LYS 63 HZ1 LYS 63 -14.089 0.081 0.259 349 HZ2 LYS 63 HZ2 LYS 63 -15.004 1.424 0.436 350 HZ3 LYS 63 HZ3 LYS 63 -13.539 1.344 1.129 351 H LEU 64 H LEU 64 -13.256 1.941 -8.391 352 HA LEU 64 HA LEU 64 -16.006 2.300 -9.403 353 HB2 LEU 64 2HB LEU 64 -13.421 2.021 -10.969 354 HB3 LEU 64 3HB LEU 64 -14.996 2.512 -11.570 355 HG LEU 64 HG LEU 64 -13.916 4.449 -11.571 356 HD11 LEU 64 1HD1 LEU 64 -15.135 4.593 -8.803 357 HD12 LEU 64 2HD1 LEU 64 -15.939 4.834 -10.372 358 HD13 LEU 64 3HD1 LEU 64 -14.697 5.961 -9.833 359 HD21 LEU 64 1HD2 LEU 64 -12.598 3.943 -8.882 360 HD22 LEU 64 2HD2 LEU 64 -12.370 5.321 -9.958 361 HD23 LEU 64 3HD2 LEU 64 -11.862 3.715 -10.499 362 H ILE 65 H ILE 65 -16.835 0.955 -10.990 363 HA ILE 65 HA ILE 65 -16.030 -1.930 -10.890 364 HB ILE 65 HB ILE 65 -18.267 -2.298 -12.017 365 HG12 ILE 65 2HG1 ILE 65 -19.012 0.449 -10.939 366 HG13 ILE 65 3HG1 ILE 65 -18.540 0.197 -12.624 367 HG21 ILE 65 1HG2 ILE 65 -17.790 -2.774 -9.619 368 HG22 ILE 65 2HG2 ILE 65 -18.304 -1.125 -9.193 369 HG23 ILE 65 3HG2 ILE 65 -19.471 -2.272 -9.871 370 HD11 ILE 65 1HD1 ILE 65 -20.921 0.219 -12.453 371 HD12 ILE 65 2HD1 ILE 65 -20.374 -1.396 -12.924 372 HD13 ILE 65 3HD1 ILE 65 -20.908 -1.079 -11.241 373 HA PRO 66 HA PRO 66 -14.490 -1.379 -15.026 374 HB2 PRO 66 2HB PRO 66 -14.485 -3.912 -16.027 375 HB3 PRO 66 3HB PRO 66 -13.393 -3.383 -14.714 376 HG2 PRO 66 2HG PRO 66 -16.030 -4.856 -14.458 377 HG3 PRO 66 3HG PRO 66 -14.468 -5.248 -13.679 378 HD2 PRO 66 2HD PRO 66 -16.424 -3.828 -12.393 379 HD3 PRO 66 3HD PRO 66 -14.683 -3.477 -12.132 380 H THR 67 H THR 67 -15.201 -1.096 -17.111 381 HA THR 67 HA THR 67 -17.621 -2.103 -18.310 382 HB THR 67 HB THR 67 -17.665 0.581 -16.925 383 HG1 THR 67 HG1 THR 67 -18.696 -1.426 -16.248 384 HG21 THR 67 1HG2 THR 67 -19.321 -0.076 -19.397 385 HG22 THR 67 2HG2 THR 67 -18.145 1.250 -19.223 386 HG23 THR 67 3HG2 THR 67 -19.620 1.266 -18.263 387 H GLY 68 H GLY 68 -17.712 -1.588 -20.491 388 HA2 GLY 68 HA2 GLY 68 -15.125 -1.554 -21.625 389 HA3 GLY 68 HA3 GLY 68 -16.655 -1.539 -22.534 390 H THR 69 H THR 69 -17.272 1.169 -21.200 391 HA THR 69 HA THR 69 -15.774 2.931 -23.054 392 HB THR 69 HB THR 69 -17.437 4.653 -22.201 393 HG1 THR 69 HG1 THR 69 -19.195 3.804 -21.045 394 HG21 THR 69 1HG2 THR 69 -17.819 3.396 -24.303 395 HG22 THR 69 2HG2 THR 69 -19.329 3.758 -23.456 396 HG23 THR 69 3HG2 THR 69 -18.641 2.122 -23.390 397 H GLY 70 H GLY 70 -15.275 1.824 -19.956 398 HA2 GLY 70 HA2 GLY 70 -13.256 2.943 -18.813 399 HA3 GLY 70 HA3 GLY 70 -14.266 4.398 -18.844 400 H ALA 71 H ALA 71 -13.352 3.352 -16.392 401 HA ALA 71 HA ALA 71 -15.135 1.465 -15.199 402 HB1 ALA 71 1HB ALA 71 -12.736 2.084 -14.536 403 HB2 ALA 71 2HB ALA 71 -13.431 3.496 -13.724 404 HB3 ALA 71 3HB ALA 71 -13.888 1.840 -13.245 405 H LEU 72 H LEU 72 -16.639 1.898 -13.420 406 HA LEU 72 HA LEU 72 -18.121 4.510 -13.604 407 HB2 LEU 72 2HB LEU 72 -18.973 1.786 -14.286 408 HB3 LEU 72 3HB LEU 72 -19.923 2.391 -12.939 409 HG LEU 72 HG LEU 72 -20.663 4.318 -14.237 410 HD11 LEU 72 1HD1 LEU 72 -18.780 4.854 -15.593 411 HD12 LEU 72 2HD1 LEU 72 -20.075 4.395 -16.711 412 HD13 LEU 72 3HD1 LEU 72 -18.759 3.253 -16.364 413 HD21 LEU 72 1HD2 LEU 72 -20.901 1.713 -15.815 414 HD22 LEU 72 2HD2 LEU 72 -21.993 3.109 -15.919 415 HD23 LEU 72 3HD2 LEU 72 -21.893 2.173 -14.416 416 H LEU 73 H LEU 73 -18.912 5.385 -11.729 417 HA LEU 73 HA LEU 73 -17.658 4.686 -9.297 418 HB2 LEU 73 2HB LEU 73 -18.579 6.908 -10.006 419 HB3 LEU 73 3HB LEU 73 -20.186 6.349 -9.593 420 HG LEU 73 HG LEU 73 -19.042 7.846 -7.925 421 HD11 LEU 73 1HD1 LEU 73 -19.779 5.139 -6.750 422 HD12 LEU 73 2HD1 LEU 73 -20.929 6.401 -7.242 423 HD13 LEU 73 3HD1 LEU 73 -19.775 6.706 -5.933 424 HD21 LEU 73 1HD2 LEU 73 -16.750 6.739 -8.185 425 HD22 LEU 73 2HD2 LEU 73 -17.353 5.415 -7.176 426 HD23 LEU 73 3HD2 LEU 73 -17.256 7.063 -6.517 427 H GLY 74 H GLY 74 -17.791 2.901 -8.269 428 HA2 GLY 74 HA2 GLY 74 -20.349 1.464 -7.804 429 HA3 GLY 74 HA3 GLY 74 -18.695 0.888 -7.481 430 H SER 75 H SER 75 -17.700 3.164 -6.033 431 HA SER 75 HA SER 75 -19.510 3.974 -3.928 432 HB2 SER 75 2HB SER 75 -17.498 1.781 -3.399 433 HB3 SER 75 3HB SER 75 -17.849 2.967 -2.147 434 HG SER 75 HG SER 75 -19.869 1.465 -3.473 435 H LEU 76 H LEU 76 -18.543 5.542 -2.521 436 HA LEU 76 HA LEU 76 -15.812 6.474 -3.198 437 HB2 LEU 76 2HB LEU 76 -17.600 7.767 -4.412 438 HB3 LEU 76 3HB LEU 76 -18.235 8.309 -2.876 439 HG LEU 76 HG LEU 76 -15.286 8.741 -3.387 440 HD11 LEU 76 1HD1 LEU 76 -15.795 10.825 -4.667 441 HD12 LEU 76 2HD1 LEU 76 -17.484 10.258 -4.825 442 HD13 LEU 76 3HD1 LEU 76 -16.172 9.327 -5.540 443 HD21 LEU 76 1HD2 LEU 76 -15.702 10.879 -2.243 444 HD22 LEU 76 2HD2 LEU 76 -16.302 9.534 -1.262 445 HD23 LEU 76 3HD2 LEU 76 -17.444 10.540 -2.194 446 H THR 77 H THR 77 -14.628 6.818 -1.519 447 HA THR 77 HA THR 77 -15.727 6.715 1.274 448 HB THR 77 HB THR 77 -13.097 5.750 0.067 449 HG1 THR 77 HG1 THR 77 -15.333 4.388 1.174 450 HG21 THR 77 1HG2 THR 77 -12.633 6.469 2.332 451 HG22 THR 77 2HG2 THR 77 -12.703 4.709 2.294 452 HG23 THR 77 3HG2 THR 77 -14.076 5.643 2.948 453 H VAL 78 H VAL 78 -15.490 8.671 2.312 454 HA VAL 78 HA VAL 78 -13.415 10.584 1.398 455 HB VAL 78 HB VAL 78 -14.195 12.112 3.124 456 HG11 VAL 78 1HG1 VAL 78 -16.335 12.685 2.061 457 HG12 VAL 78 2HG1 VAL 78 -15.134 12.218 0.854 458 HG13 VAL 78 3HG1 VAL 78 -16.414 11.074 1.309 459 HG21 VAL 78 1HG2 VAL 78 -16.334 11.725 4.299 460 HG22 VAL 78 2HG2 VAL 78 -16.366 10.053 3.700 461 HG23 VAL 78 3HG2 VAL 78 -15.090 10.593 4.824 462 H LEU 79 H LEU 79 -11.460 10.995 2.449 463 HA LEU 79 HA LEU 79 -10.842 9.242 4.802 464 HB2 LEU 79 2HB LEU 79 -8.965 10.504 2.785 465 HB3 LEU 79 3HB LEU 79 -8.504 9.469 4.116 466 HG LEU 79 HG LEU 79 -10.238 8.622 1.735 467 HD11 LEU 79 1HD1 LEU 79 -7.301 8.104 2.307 468 HD12 LEU 79 2HD1 LEU 79 -7.954 9.156 1.026 469 HD13 LEU 79 3HD1 LEU 79 -8.238 7.412 0.970 470 HD21 LEU 79 1HD2 LEU 79 -8.944 6.958 3.947 471 HD22 LEU 79 2HD2 LEU 79 -9.801 6.314 2.528 472 HD23 LEU 79 3HD2 LEU 79 -10.685 7.239 3.748 473 H ASP 80 H ASP 80 -10.314 12.533 3.474 474 HA ASP 80 HA ASP 80 -11.237 13.841 5.779 475 HB2 ASP 80 2HB ASP 80 -8.788 13.058 6.539 476 HB3 ASP 80 3HB ASP 80 -8.292 14.361 5.473 477 H GLY 81 H GLY 81 -10.859 16.272 5.610 478 HA2 GLY 81 HA2 GLY 81 -9.581 17.605 3.552 479 HA3 GLY 81 HA3 GLY 81 -11.163 17.247 2.869 480 H ASP 82 H ASP 82 -10.336 19.805 3.079 481 HA ASP 82 HA ASP 82 -11.718 20.979 5.433 482 HB2 ASP 82 2HB ASP 82 -9.269 21.567 4.656 483 HB3 ASP 82 3HB ASP 82 -10.093 22.559 3.453 484 H SER 83 H SER 83 -12.674 23.280 4.584 485 HA SER 83 HA SER 83 -15.192 22.833 4.230 486 HB2 SER 83 2HB SER 83 -13.987 25.064 4.442 487 HB3 SER 83 3HB SER 83 -14.025 25.150 2.677 488 HG SER 83 HG SER 83 -16.131 25.281 4.548 489 H ARG 84 H ARG 84 -16.116 21.321 3.044 490 HA ARG 84 HA ARG 84 -17.470 20.560 1.478 491 HB2 ARG 84 2HB ARG 84 -17.002 23.310 0.260 492 HB3 ARG 84 3HB ARG 84 -18.244 22.201 -0.291 493 HG2 ARG 84 2HG ARG 84 -19.482 22.283 1.706 494 HG3 ARG 84 3HG ARG 84 -18.147 22.960 2.641 495 HD2 ARG 84 2HD ARG 84 -19.532 24.461 0.389 496 HD3 ARG 84 3HD ARG 84 -19.945 24.617 2.101 497 HE ARG 84 HE ARG 84 -17.592 25.330 2.529 498 HH11 ARG 84 1HH1 ARG 84 -18.750 25.865 -0.802 499 HH12 ARG 84 2HH1 ARG 84 -17.368 26.889 -1.133 500 HH21 ARG 84 1HH2 ARG 84 -15.992 26.683 2.004 501 HH22 ARG 84 2HH2 ARG 84 -15.932 27.417 0.401 502 H LEU 85 H LEU 85 -14.191 20.708 0.528 503 HA LEU 85 HA LEU 85 -14.625 20.163 -2.282 504 HB2 LEU 85 2HB LEU 85 -12.573 21.071 -1.528 505 HB3 LEU 85 3HB LEU 85 -12.266 19.719 -0.439 506 HG LEU 85 HG LEU 85 -11.846 18.212 -2.241 507 HD11 LEU 85 1HD1 LEU 85 -12.449 20.419 -4.265 508 HD12 LEU 85 2HD1 LEU 85 -13.487 19.014 -4.004 509 HD13 LEU 85 3HD1 LEU 85 -11.852 18.792 -4.623 510 HD21 LEU 85 1HD2 LEU 85 -10.037 19.829 -1.559 511 HD22 LEU 85 2HD2 LEU 85 -10.502 20.874 -2.913 512 HD23 LEU 85 3HD2 LEU 85 -9.898 19.236 -3.231 513 H CYS 86 H CYS 86 -14.035 17.791 0.446 514 HA CYS 86 HA CYS 86 -14.656 15.462 -0.973 515 HB2 CYS 86 2HB CYS 86 -15.422 14.616 1.251 516 HB3 CYS 86 3HB CYS 86 -13.800 15.339 1.239 517 HG CYS 86 HG CYS 86 -16.702 16.621 2.294 518 H ALA 87 H ALA 87 -16.947 17.961 0.070 519 HA ALA 87 HA ALA 87 -19.307 16.292 -0.437 520 HB1 ALA 87 1HB ALA 87 -19.282 18.107 1.273 521 HB2 ALA 87 2HB ALA 87 -19.056 19.315 -0.015 522 HB3 ALA 87 3HB ALA 87 -20.542 18.364 0.050 523 H ALA 88 H ALA 88 -17.490 18.752 -2.251 524 HA ALA 88 HA ALA 88 -19.280 18.899 -4.491 525 HB1 ALA 88 1HB ALA 88 -16.327 19.683 -4.156 526 HB2 ALA 88 2HB ALA 88 -17.410 20.233 -5.447 527 HB3 ALA 88 3HB ALA 88 -17.729 20.705 -3.773 528 H THR 89 H THR 89 -16.097 17.258 -4.079 529 HA THR 89 HA THR 89 -15.996 15.981 -6.634 530 HB THR 89 HB THR 89 -14.089 16.175 -5.101 531 HG1 THR 89 HG1 THR 89 -13.313 14.151 -5.681 532 HG21 THR 89 1HG2 THR 89 -15.070 13.684 -3.671 533 HG22 THR 89 2HG2 THR 89 -15.399 15.302 -3.019 534 HG23 THR 89 3HG2 THR 89 -13.725 14.767 -3.246 535 H LYS 90 H LYS 90 -17.355 14.784 -3.592 536 HA LYS 90 HA LYS 90 -18.169 12.208 -4.346 537 HB2 LYS 90 2HB LYS 90 -18.124 13.081 -2.097 538 HB3 LYS 90 3HB LYS 90 -19.331 14.316 -2.497 539 HG2 LYS 90 2HG LYS 90 -20.793 12.063 -2.977 540 HG3 LYS 90 3HG LYS 90 -19.638 11.425 -1.799 541 HD2 LYS 90 2HD LYS 90 -21.296 13.951 -1.469 542 HD3 LYS 90 3HD LYS 90 -21.781 12.387 -0.816 543 HE2 LYS 90 2HE LYS 90 -19.166 13.805 -0.066 544 HE3 LYS 90 3HE LYS 90 -20.681 13.982 0.849 545 HZ1 LYS 90 HZ1 LYS 90 -19.244 11.418 0.440 546 HZ2 LYS 90 HZ2 LYS 90 -20.654 11.589 1.256 547 HZ3 LYS 90 HZ3 LYS 90 -19.288 12.286 1.825 548 H ARG 91 H ARG 91 -19.948 15.263 -4.734 549 HA ARG 91 HA ARG 91 -22.207 14.079 -6.112 550 HB2 ARG 91 2HB ARG 91 -21.195 16.934 -5.839 551 HB3 ARG 91 3HB ARG 91 -22.665 16.529 -6.735 552 HG2 ARG 91 2HG ARG 91 -23.739 15.615 -4.779 553 HG3 ARG 91 3HG ARG 91 -22.249 15.717 -3.822 554 HD2 ARG 91 2HD ARG 91 -22.295 18.179 -3.933 555 HD3 ARG 91 3HD ARG 91 -23.691 18.123 -5.010 556 HE ARG 91 HE ARG 91 -25.082 17.807 -3.233 557 HH11 ARG 91 1HH1 ARG 91 -21.843 16.991 -2.042 558 HH12 ARG 91 2HH1 ARG 91 -22.419 16.780 -0.409 559 HH21 ARG 91 1HH2 ARG 91 -25.724 17.566 -1.109 560 HH22 ARG 91 2HH2 ARG 91 -24.578 17.126 0.112 561 H ALA 92 H ALA 92 -19.281 15.751 -7.370 562 HA ALA 92 HA ALA 92 -19.939 15.611 -10.132 563 HB1 ALA 92 1HB ALA 92 -17.491 15.887 -10.464 564 HB2 ALA 92 2HB ALA 92 -18.137 16.992 -9.253 565 HB3 ALA 92 3HB ALA 92 -17.216 15.569 -8.737 566 H VAL 93 H VAL 93 -18.048 13.298 -8.160 567 HA VAL 93 HA VAL 93 -17.697 11.389 -10.224 568 HB VAL 93 HB VAL 93 -17.821 10.528 -7.334 569 HG11 VAL 93 1HG1 VAL 93 -17.319 8.886 -9.200 570 HG12 VAL 93 2HG1 VAL 93 -15.879 9.857 -9.574 571 HG13 VAL 93 3HG1 VAL 93 -16.044 9.044 -8.003 572 HG21 VAL 93 1HG2 VAL 93 -16.282 12.009 -6.699 573 HG22 VAL 93 2HG2 VAL 93 -15.128 11.323 -7.851 574 HG23 VAL 93 3HG2 VAL 93 -16.123 12.684 -8.324 575 H ALA 94 H ALA 94 -20.455 11.998 -8.252 576 HA ALA 94 HA ALA 94 -21.781 9.419 -8.780 577 HB1 ALA 94 1HB ALA 94 -22.810 11.978 -7.484 578 HB2 ALA 94 2HB ALA 94 -23.656 10.420 -7.527 579 HB3 ALA 94 3HB ALA 94 -22.141 10.578 -6.628 580 H GLN 95 H GLN 95 -21.199 12.209 -10.632 581 HA GLN 95 HA GLN 95 -23.575 11.656 -12.363 582 HB2 GLN 95 2HB GLN 95 -23.951 14.000 -12.691 583 HB3 GLN 95 3HB GLN 95 -23.978 13.606 -10.970 584 HG2 GLN 95 2HG GLN 95 -22.718 15.578 -10.950 585 HG3 GLN 95 3HG GLN 95 -21.543 14.362 -10.894 586 HE21 GLN 95 1HE2 GLN 95 -19.906 14.489 -12.486 587 HE22 GLN 95 2HE2 GLN 95 -20.003 15.614 -13.846 588 H VAL 96 H VAL 96 -20.129 12.028 -12.298 589 HA VAL 96 HA VAL 96 -19.614 12.570 -15.041 590 HB VAL 96 HB VAL 96 -17.573 11.179 -14.762 591 HG11 VAL 96 1HG1 VAL 96 -17.879 13.088 -12.439 592 HG12 VAL 96 2HG1 VAL 96 -16.410 12.625 -13.263 593 HG13 VAL 96 3HG1 VAL 96 -17.624 13.584 -14.131 594 HG21 VAL 96 1HG2 VAL 96 -18.099 9.431 -13.276 595 HG22 VAL 96 2HG2 VAL 96 -17.055 10.528 -12.340 596 HG23 VAL 96 3HG2 VAL 96 -18.792 10.544 -12.080 597 H ASN 97 H ASN 97 -19.394 11.271 -16.891 598 HA ASN 97 HA ASN 97 -21.339 9.196 -17.121 599 HB2 ASN 97 2HB ASN 97 -20.654 10.886 -18.866 600 HB3 ASN 97 3HB ASN 97 -19.175 9.963 -19.125 601 HD21 ASN 97 1HD2 ASN 97 -19.419 7.697 -20.038 602 HD22 ASN 97 2HD2 ASN 97 -20.894 7.333 -20.916 603 H SER 98 H SER 98 -17.754 9.058 -17.153 604 HA SER 98 HA SER 98 -17.324 6.406 -16.316 605 HB2 SER 98 2HB SER 98 -16.684 5.408 -18.566 606 HB3 SER 98 3HB SER 98 -18.416 5.512 -18.254 607 HG SER 98 HG SER 98 -16.844 7.267 -19.887 608 H PHE 99 H PHE 99 -15.168 6.017 -16.082 609 HA PHE 99 HA PHE 99 -13.378 8.273 -16.621 610 HB2 PHE 99 2HB PHE 99 -12.885 5.736 -15.040 611 HB3 PHE 99 3HB PHE 99 -11.941 7.227 -15.001 612 HD1 PHE 99 HD1 PHE 99 -14.773 5.443 -13.622 613 HD2 PHE 99 HD2 PHE 99 -13.147 9.384 -14.223 614 HE1 PHE 99 HE1 PHE 99 -16.360 6.346 -11.972 615 HE2 PHE 99 HE2 PHE 99 -14.718 10.274 -12.514 616 HZ PHE 99 HZ PHE 99 -16.322 8.718 -11.385 617 HA PRO 100 HA PRO 100 -12.060 5.776 -20.152 618 HB2 PRO 100 2HB PRO 100 -10.609 7.611 -21.555 619 HB3 PRO 100 3HB PRO 100 -12.399 7.602 -21.497 620 HG2 PRO 100 2HG PRO 100 -10.471 9.283 -19.848 621 HG3 PRO 100 3HG PRO 100 -11.946 9.819 -20.724 622 HD2 PRO 100 2HD PRO 100 -11.953 9.255 -18.042 623 HD3 PRO 100 3HD PRO 100 -13.360 8.898 -19.089 624 H LEU 101 H LEU 101 -10.558 4.302 -19.882 625 HA LEU 101 HA LEU 101 -8.118 4.899 -18.358 626 HB2 LEU 101 2HB LEU 101 -7.951 2.323 -18.340 627 HB3 LEU 101 3HB LEU 101 -9.143 3.171 -17.365 628 HG LEU 101 HG LEU 101 -10.941 2.559 -18.887 629 HD11 LEU 101 1HD1 LEU 101 -9.890 2.381 -21.053 630 HD12 LEU 101 2HD1 LEU 101 -10.554 0.809 -20.635 631 HD13 LEU 101 3HD1 LEU 101 -8.803 1.094 -20.476 632 HD21 LEU 101 1HD2 LEU 101 -10.356 1.119 -16.986 633 HD22 LEU 101 2HD2 LEU 101 -9.248 0.192 -18.028 634 HD23 LEU 101 3HD2 LEU 101 -10.997 0.172 -18.341 635 HA PRO 102 HA PRO 102 -5.479 4.719 -21.870 636 HB2 PRO 102 2HB PRO 102 -3.023 4.307 -20.763 637 HB3 PRO 102 3HB PRO 102 -3.970 5.801 -20.465 638 HG2 PRO 102 2HG PRO 102 -3.788 3.324 -18.712 639 HG3 PRO 102 3HG PRO 102 -3.591 5.043 -18.226 640 HD2 PRO 102 2HD PRO 102 -5.969 3.712 -17.941 641 HD3 PRO 102 3HD PRO 102 -5.895 5.449 -18.347 642 H LYS 103 H LYS 103 -5.482 1.913 -19.679 643 HA LYS 103 HA LYS 103 -5.229 0.098 -21.980 644 HB2 LYS 103 2HB LYS 103 -3.503 0.028 -19.507 645 HB3 LYS 103 3HB LYS 103 -3.916 -1.426 -20.375 646 HG2 LYS 103 2HG LYS 103 -1.982 -1.014 -21.484 647 HG3 LYS 103 3HG LYS 103 -3.045 -0.055 -22.493 648 HD2 LYS 103 2HD LYS 103 -1.134 1.294 -22.034 649 HD3 LYS 103 3HD LYS 103 -2.435 1.944 -21.032 650 HE2 LYS 103 2HE LYS 103 -1.587 0.639 -19.090 651 HE3 LYS 103 3HE LYS 103 -0.301 -0.042 -20.085 652 HZ1 LYS 103 HZ1 LYS 103 0.610 2.184 -20.331 653 HZ2 LYS 103 HZ2 LYS 103 0.472 1.832 -18.735 654 HZ3 LYS 103 HZ3 LYS 103 -0.598 2.838 -19.450 655 H ASP 104 H ASP 104 -6.379 -1.847 -21.692 656 HA ASP 104 HA ASP 104 -8.486 -1.756 -19.603 657 HB2 ASP 104 2HB ASP 104 -9.031 -1.033 -21.937 658 HB3 ASP 104 3HB ASP 104 -8.610 -2.643 -22.511 659 H GLN 105 H GLN 105 -5.920 -3.452 -19.499 660 HA GLN 105 HA GLN 105 -6.973 -6.165 -19.893 661 HB2 GLN 105 2HB GLN 105 -4.223 -5.230 -19.158 662 HB3 GLN 105 3HB GLN 105 -4.726 -6.910 -19.151 663 HG2 GLN 105 2HG GLN 105 -3.634 -6.509 -21.236 664 HG3 GLN 105 3HG GLN 105 -5.353 -6.767 -21.553 665 HE21 GLN 105 1HE2 GLN 105 -3.335 -3.938 -20.619 666 HE22 GLN 105 2HE2 GLN 105 -3.903 -2.901 -21.923 667 HA PRO 106 HA PRO 106 -8.370 -6.646 -15.732 668 HB2 PRO 106 2HB PRO 106 -7.289 -9.459 -15.984 669 HB3 PRO 106 3HB PRO 106 -8.874 -8.921 -15.356 670 HG2 PRO 106 2HG PRO 106 -8.685 -9.903 -17.868 671 HG3 PRO 106 3HG PRO 106 -9.660 -8.420 -17.564 672 HD2 PRO 106 2HD PRO 106 -6.828 -8.622 -18.645 673 HD3 PRO 106 3HD PRO 106 -8.217 -7.617 -19.192 674 H ASP 107 H ASP 107 -4.992 -6.774 -16.406 675 HA ASP 107 HA ASP 107 -4.241 -7.352 -13.599 676 HB2 ASP 107 2HB ASP 107 -1.989 -7.255 -14.351 677 HB3 ASP 107 3HB ASP 107 -2.910 -8.386 -15.343 678 H VAL 108 H VAL 108 -4.124 -4.712 -15.969 679 HA VAL 108 HA VAL 108 -3.384 -2.724 -13.908 680 HB VAL 108 HB VAL 108 -3.265 -1.128 -15.680 681 HG11 VAL 108 1HG1 VAL 108 -1.423 -1.977 -16.951 682 HG12 VAL 108 2HG1 VAL 108 -1.333 -2.652 -15.312 683 HG13 VAL 108 3HG1 VAL 108 -1.920 -3.656 -16.662 684 HG21 VAL 108 1HG2 VAL 108 -5.123 -1.691 -17.097 685 HG22 VAL 108 2HG2 VAL 108 -3.634 -1.737 -18.052 686 HG23 VAL 108 3HG2 VAL 108 -4.386 -3.251 -17.528 687 H VAL 109 H VAL 109 -6.365 -3.677 -15.584 688 HA VAL 109 HA VAL 109 -7.985 -1.433 -14.893 689 HB VAL 109 HB VAL 109 -8.600 -4.383 -15.176 690 HG11 VAL 109 1HG1 VAL 109 -10.650 -2.161 -14.740 691 HG12 VAL 109 2HG1 VAL 109 -11.018 -3.791 -15.352 692 HG13 VAL 109 3HG1 VAL 109 -10.393 -3.577 -13.707 693 HG21 VAL 109 1HG2 VAL 109 -9.545 -3.711 -17.321 694 HG22 VAL 109 2HG2 VAL 109 -9.393 -1.985 -16.917 695 HG23 VAL 109 3HG2 VAL 109 -7.943 -2.943 -17.211 696 H GLU 110 H GLU 110 -6.648 -3.991 -12.920 697 HA GLU 110 HA GLU 110 -8.346 -3.549 -10.607 698 HB2 GLU 110 2HB GLU 110 -5.870 -5.129 -11.029 699 HB3 GLU 110 3HB GLU 110 -6.749 -5.107 -9.503 700 HG2 GLU 110 2HG GLU 110 -8.060 -5.883 -12.162 701 HG3 GLU 110 3HG GLU 110 -7.282 -7.012 -11.068 702 H LYS 111 H LYS 111 -5.780 -1.756 -11.880 703 HA LYS 111 HA LYS 111 -4.921 -0.770 -9.211 704 HB2 LYS 111 2HB LYS 111 -3.721 -0.523 -11.982 705 HB3 LYS 111 3HB LYS 111 -3.313 0.645 -10.727 706 HG2 LYS 111 2HG LYS 111 -1.682 -1.170 -10.874 707 HG3 LYS 111 3HG LYS 111 -2.419 -1.056 -9.275 708 HD2 LYS 111 2HD LYS 111 -3.763 -3.003 -9.621 709 HD3 LYS 111 3HD LYS 111 -3.443 -2.975 -11.377 710 HE2 LYS 111 2HE LYS 111 -1.017 -3.395 -10.857 711 HE3 LYS 111 3HE LYS 111 -1.466 -3.546 -9.141 712 HZ1 LYS 111 HZ1 LYS 111 -2.567 -5.248 -11.326 713 HZ2 LYS 111 HZ2 LYS 111 -2.830 -5.447 -9.720 714 HZ3 LYS 111 HZ3 LYS 111 -1.343 -5.715 -10.342 715 H LEU 112 H LEU 112 -6.198 0.416 -12.250 716 HA LEU 112 HA LEU 112 -6.643 3.093 -11.320 717 HB2 LEU 112 2HB LEU 112 -7.832 3.386 -13.503 718 HB3 LEU 112 3HB LEU 112 -6.239 2.698 -13.585 719 HG LEU 112 HG LEU 112 -7.352 0.460 -13.652 720 HD11 LEU 112 1HD1 LEU 112 -9.598 1.023 -13.065 721 HD12 LEU 112 2HD1 LEU 112 -9.534 0.222 -14.617 722 HD13 LEU 112 3HD1 LEU 112 -9.766 1.983 -14.561 723 HD21 LEU 112 1HD2 LEU 112 -7.501 2.339 -16.004 724 HD22 LEU 112 2HD2 LEU 112 -7.688 0.565 -16.136 725 HD23 LEU 112 3HD2 LEU 112 -6.170 1.235 -15.566 726 H LYS 113 H LYS 113 -8.691 0.176 -10.991 727 HA LYS 113 HA LYS 113 -11.081 1.654 -10.604 728 HB2 LYS 113 2HB LYS 113 -11.948 -0.465 -9.818 729 HB3 LYS 113 3HB LYS 113 -10.989 -0.694 -11.279 730 HG2 LYS 113 2HG LYS 113 -9.024 -1.392 -9.840 731 HG3 LYS 113 3HG LYS 113 -10.053 -1.213 -8.407 732 HD2 LYS 113 2HD LYS 113 -10.351 -3.157 -10.692 733 HD3 LYS 113 3HD LYS 113 -9.918 -3.491 -8.987 734 HE2 LYS 113 2HE LYS 113 -12.243 -2.636 -8.406 735 HE3 LYS 113 3HE LYS 113 -12.528 -2.556 -10.155 736 HZ1 LYS 113 HZ1 LYS 113 -13.300 -4.717 -9.479 737 HZ2 LYS 113 HZ2 LYS 113 -11.993 -4.987 -8.532 738 HZ3 LYS 113 HZ3 LYS 113 -11.816 -5.011 -10.141 739 H ASN 114 H ASN 114 -8.516 0.960 -8.389 740 HA ASN 114 HA ASN 114 -10.077 2.234 -6.163 741 HB2 ASN 114 2HB ASN 114 -7.888 0.171 -5.840 742 HB3 ASN 114 3HB ASN 114 -8.819 0.952 -4.552 743 HD21 ASN 114 1HD2 ASN 114 -11.447 0.772 -5.401 744 HD22 ASN 114 2HD2 ASN 114 -11.880 -0.927 -5.575 745 H ILE 115 H ILE 115 -9.408 4.322 -6.731 746 HA ILE 115 HA ILE 115 -6.525 4.937 -6.261 747 HB ILE 115 HB ILE 115 -6.830 6.966 -7.509 748 HG12 ILE 115 2HG1 ILE 115 -9.296 7.208 -7.138 749 HG13 ILE 115 3HG1 ILE 115 -8.681 7.638 -8.690 750 HG21 ILE 115 1HG2 ILE 115 -5.825 5.168 -8.675 751 HG22 ILE 115 2HG2 ILE 115 -7.379 4.374 -8.975 752 HG23 ILE 115 3HG2 ILE 115 -7.012 5.897 -9.777 753 HD11 ILE 115 1HD1 ILE 115 -10.176 5.079 -8.069 754 HD12 ILE 115 2HD1 ILE 115 -10.748 6.495 -8.975 755 HD13 ILE 115 3HD1 ILE 115 -9.455 5.498 -9.636 756 H ASN 116 H ASN 116 -5.960 6.824 -5.137 757 HA ASN 116 HA ASN 116 -8.133 8.077 -3.535 758 HB2 ASN 116 2HB ASN 116 -5.225 8.815 -3.292 759 HB3 ASN 116 3HB ASN 116 -6.586 9.138 -2.213 760 HD21 ASN 116 1HD2 ASN 116 -7.558 6.263 -2.177 761 HD22 ASN 116 2HD2 ASN 116 -6.370 5.452 -1.201 762 H LEU 117 H LEU 117 -8.825 10.054 -4.038 763 HA LEU 117 HA LEU 117 -7.309 11.806 -5.950 764 HB2 LEU 117 2HB LEU 117 -10.033 12.265 -4.687 765 HB3 LEU 117 3HB LEU 117 -9.192 13.355 -5.786 766 HG LEU 117 HG LEU 117 -10.231 10.543 -6.458 767 HD11 LEU 117 1HD1 LEU 117 -11.956 11.712 -7.777 768 HD12 LEU 117 2HD1 LEU 117 -11.303 13.282 -7.277 769 HD13 LEU 117 3HD1 LEU 117 -12.033 12.198 -6.068 770 HD21 LEU 117 1HD2 LEU 117 -8.312 11.061 -7.884 771 HD22 LEU 117 2HD2 LEU 117 -8.998 12.653 -8.265 772 HD23 LEU 117 3HD2 LEU 117 -9.795 11.169 -8.834 773 H THR 118 H THR 118 -5.734 12.820 -4.876 774 HA THR 118 HA THR 118 -6.251 13.901 -2.140 775 HB THR 118 HB THR 118 -3.789 12.323 -3.002 776 HG1 THR 118 HG1 THR 118 -4.533 10.969 -1.333 777 HG21 THR 118 1HG2 THR 118 -3.063 14.105 -1.519 778 HG22 THR 118 2HG2 THR 118 -3.220 12.650 -0.527 779 HG23 THR 118 3HG2 THR 118 -4.488 13.903 -0.482 780 H VAL 119 H VAL 119 -5.848 15.940 -2.035 781 HA VAL 119 HA VAL 119 -4.017 17.275 -3.974 782 HB VAL 119 HB VAL 119 -5.567 18.951 -4.412 783 HG11 VAL 119 1HG1 VAL 119 -7.415 17.856 -5.556 784 HG12 VAL 119 2HG1 VAL 119 -5.956 16.864 -5.718 785 HG13 VAL 119 3HG1 VAL 119 -7.227 16.410 -4.546 786 HG21 VAL 119 1HG2 VAL 119 -7.572 17.772 -2.467 787 HG22 VAL 119 2HG2 VAL 119 -6.632 19.260 -2.199 788 HG23 VAL 119 3HG2 VAL 119 -7.781 19.194 -3.524 789 H ALA 120 H ALA 120 -3.156 19.274 -3.303 790 HA ALA 120 HA ALA 120 -3.432 20.286 -0.588 791 HB1 ALA 120 1HB ALA 120 -1.082 19.649 0.077 792 HB2 ALA 120 2HB ALA 120 -2.134 18.246 -0.151 793 HB3 ALA 120 3HB ALA 120 -0.959 18.699 -1.405 794 HA PRO 121 HA PRO 121 -1.720 23.826 -2.627 795 HB2 PRO 121 2HB PRO 121 -0.884 25.425 -0.603 796 HB3 PRO 121 3HB PRO 121 -2.594 24.962 -0.789 797 HG2 PRO 121 2HG PRO 121 -0.501 23.676 0.997 798 HG3 PRO 121 3HG PRO 121 -2.144 24.234 1.447 799 HD2 PRO 121 2HD PRO 121 -1.601 21.628 0.813 800 HD3 PRO 121 3HD PRO 121 -3.157 22.405 0.415 801 H GLU 122 H GLU 122 0.322 25.247 -2.784 802 HA GLU 122 HA GLU 122 2.883 23.977 -2.120 803 HB2 GLU 122 2HB GLU 122 2.076 22.797 -4.194 804 HB3 GLU 122 3HB GLU 122 2.020 24.352 -5.027 805 HG2 GLU 122 2HG GLU 122 4.491 24.612 -4.630 806 HG3 GLU 122 3HG GLU 122 4.510 23.064 -3.792 Start of MODEL 8 1 H1 ALA 22 H ALA 22 15.548 6.230 -17.816 2 HA ALA 22 HA ALA 22 13.046 7.746 -17.818 3 HB1 ALA 22 1HB ALA 22 13.246 5.134 -19.376 4 HB2 ALA 22 2HB ALA 22 11.744 6.013 -19.022 5 HB3 ALA 22 3HB ALA 22 12.976 6.747 -20.072 6 H ALA 23 H ALA 23 14.563 4.555 -17.189 7 HA ALA 23 HA ALA 23 14.715 3.255 -15.421 8 HB1 ALA 23 1HB ALA 23 14.443 4.080 -13.198 9 HB2 ALA 23 2HB ALA 23 15.075 5.409 -14.190 10 HB3 ALA 23 3HB ALA 23 13.344 5.368 -13.732 11 H ARG 24 H ARG 24 13.524 2.000 -13.825 12 HA ARG 24 HA ARG 24 10.639 1.673 -14.223 13 HB2 ARG 24 2HB ARG 24 10.788 -0.585 -15.126 14 HB3 ARG 24 3HB ARG 24 11.453 0.652 -16.177 15 HG2 ARG 24 2HG ARG 24 13.777 -0.093 -15.083 16 HG3 ARG 24 3HG ARG 24 12.872 -1.577 -14.731 17 HD2 ARG 24 2HD ARG 24 13.205 -0.234 -17.429 18 HD3 ARG 24 3HD ARG 24 14.109 -1.659 -16.888 19 HE ARG 24 HE ARG 24 11.474 -2.447 -16.658 20 HH11 ARG 24 1HH1 ARG 24 13.435 -1.292 -19.355 21 HH12 ARG 24 2HH1 ARG 24 12.419 -2.000 -20.550 22 HH21 ARG 24 1HH2 ARG 24 10.230 -3.451 -18.226 23 HH22 ARG 24 2HH2 ARG 24 10.644 -3.291 -19.906 24 H GLN 25 H GLN 25 12.473 2.169 -11.932 25 HA GLN 25 HA GLN 25 11.964 -0.222 -10.189 26 HB2 GLN 25 2HB GLN 25 13.821 2.086 -9.640 27 HB3 GLN 25 3HB GLN 25 13.747 0.531 -8.835 28 HG2 GLN 25 2HG GLN 25 14.689 1.005 -11.722 29 HG3 GLN 25 3HG GLN 25 15.711 0.739 -10.340 30 HE21 GLN 25 1HE2 GLN 25 14.165 -0.838 -12.953 31 HE22 GLN 25 2HE2 GLN 25 14.289 -2.461 -12.308 32 H GLN 26 H GLN 26 11.061 3.015 -10.746 33 HA GLN 26 HA GLN 26 9.499 3.319 -8.237 34 HB2 GLN 26 2HB GLN 26 10.433 5.481 -7.880 35 HB3 GLN 26 3HB GLN 26 11.732 4.300 -7.949 36 HG2 GLN 26 2HG GLN 26 10.924 6.179 -10.213 37 HG3 GLN 26 3HG GLN 26 12.272 6.430 -9.108 38 HE21 GLN 26 1HE2 GLN 26 14.121 4.865 -9.225 39 HE22 GLN 26 2HE2 GLN 26 14.411 4.063 -10.747 40 H PHE 27 H PHE 27 9.845 3.969 -11.641 41 HA PHE 27 HA PHE 27 8.422 6.142 -12.254 42 HB2 PHE 27 2HB PHE 27 8.488 5.371 -14.387 43 HB3 PHE 27 3HB PHE 27 9.718 4.368 -13.659 44 HD1 PHE 27 HD1 PHE 27 8.978 2.004 -12.815 45 HD2 PHE 27 HD2 PHE 27 6.560 4.451 -15.402 46 HE1 PHE 27 HE1 PHE 27 7.593 0.022 -13.394 47 HE2 PHE 27 HE2 PHE 27 5.152 2.486 -15.951 48 HZ PHE 27 HZ PHE 27 5.678 0.253 -14.952 49 H VAL 28 H VAL 28 6.845 3.389 -10.902 50 HA VAL 28 HA VAL 28 4.195 3.628 -11.919 51 HB VAL 28 HB VAL 28 3.471 2.789 -9.652 52 HG11 VAL 28 1HG1 VAL 28 5.591 1.174 -11.149 53 HG12 VAL 28 2HG1 VAL 28 4.321 0.516 -10.088 54 HG13 VAL 28 3HG1 VAL 28 3.881 1.322 -11.607 55 HG21 VAL 28 1HG2 VAL 28 5.121 1.876 -8.120 56 HG22 VAL 28 2HG2 VAL 28 6.449 2.490 -9.104 57 HG23 VAL 28 3HG2 VAL 28 5.369 3.619 -8.271 58 H THR 29 H THR 29 5.921 5.606 -9.540 59 HA THR 29 HA THR 29 3.743 7.201 -8.638 60 HB THR 29 HB THR 29 5.987 7.139 -7.660 61 HG1 THR 29 HG1 THR 29 5.913 9.350 -7.137 62 HG21 THR 29 1HG2 THR 29 6.846 9.157 -9.776 63 HG22 THR 29 2HG2 THR 29 7.290 7.454 -9.864 64 HG23 THR 29 3HG2 THR 29 7.825 8.432 -8.489 65 H SER 30 H SER 30 5.791 7.613 -11.564 66 HA SER 30 HA SER 30 4.350 9.918 -12.502 67 HB2 SER 30 2HB SER 30 5.970 7.895 -14.121 68 HB3 SER 30 3HB SER 30 5.589 9.563 -14.577 69 HG SER 30 HG SER 30 7.728 9.360 -13.737 70 H GLU 31 H GLU 31 3.859 6.409 -12.918 71 HA GLU 31 HA GLU 31 1.721 6.720 -14.829 72 HB2 GLU 31 2HB GLU 31 2.369 4.467 -12.913 73 HB3 GLU 31 3HB GLU 31 1.018 4.427 -14.044 74 HG2 GLU 31 2HG GLU 31 3.902 4.874 -14.901 75 HG3 GLU 31 3HG GLU 31 3.111 3.287 -14.839 76 H VAL 32 H VAL 32 1.743 7.099 -11.267 77 HA VAL 32 HA VAL 32 -1.176 7.038 -11.040 78 HB VAL 32 HB VAL 32 0.935 8.295 -9.253 79 HG11 VAL 32 1HG1 VAL 32 -0.863 8.476 -7.535 80 HG12 VAL 32 2HG1 VAL 32 -1.118 9.579 -8.886 81 HG13 VAL 32 3HG1 VAL 32 -2.062 8.076 -8.790 82 HG21 VAL 32 1HG2 VAL 32 0.871 5.808 -9.348 83 HG22 VAL 32 2HG2 VAL 32 0.374 6.424 -7.767 84 HG23 VAL 32 3HG2 VAL 32 -0.848 5.841 -8.915 85 H GLY 33 H GLY 33 1.156 9.349 -12.180 86 HA2 GLY 33 HA2 GLY 33 -0.551 11.697 -12.294 87 HA3 GLY 33 HA3 GLY 33 0.976 11.427 -13.166 88 H ARG 34 H ARG 34 -0.569 8.770 -14.147 89 HA ARG 34 HA ARG 34 -2.445 10.091 -16.085 90 HB2 ARG 34 2HB ARG 34 -1.256 7.316 -16.336 91 HB3 ARG 34 3HB ARG 34 -2.140 8.260 -17.539 92 HG2 ARG 34 2HG ARG 34 -0.195 9.973 -17.358 93 HG3 ARG 34 3HG ARG 34 0.684 8.740 -16.446 94 HD2 ARG 34 2HD ARG 34 -0.312 8.589 -19.295 95 HD3 ARG 34 3HD ARG 34 1.363 8.688 -18.741 96 HE ARG 34 HE ARG 34 1.178 6.437 -17.818 97 HH11 ARG 34 1HH1 ARG 34 -1.133 7.241 -20.378 98 HH12 ARG 34 2HH1 ARG 34 -1.488 5.579 -20.699 99 HH21 ARG 34 1HH2 ARG 34 0.642 4.371 -18.181 100 HH22 ARG 34 2HH2 ARG 34 -0.494 3.933 -19.432 101 H TYR 35 H TYR 35 -2.071 7.032 -14.270 102 HA TYR 35 HA TYR 35 -4.577 5.888 -14.599 103 HB2 TYR 35 2HB TYR 35 -2.394 5.694 -12.499 104 HB3 TYR 35 3HB TYR 35 -3.919 4.873 -12.243 105 HD1 TYR 35 HD1 TYR 35 -1.421 5.283 -15.078 106 HD2 TYR 35 HD2 TYR 35 -4.063 2.704 -12.882 107 HE1 TYR 35 HE1 TYR 35 -0.930 3.463 -16.664 108 HE2 TYR 35 HE2 TYR 35 -3.689 0.899 -14.524 109 HH TYR 35 HH TYR 35 -1.375 1.286 -17.281 110 H GLY 36 H GLY 36 -3.650 7.968 -11.860 111 HA2 GLY 36 HA2 GLY 36 -6.414 8.159 -10.879 112 HA3 GLY 36 HA3 GLY 36 -4.989 8.958 -10.205 113 H ALA 37 H ALA 37 -4.553 9.857 -13.273 114 HA ALA 37 HA ALA 37 -5.808 12.425 -12.855 115 HB1 ALA 37 1HB ALA 37 -4.600 13.123 -14.822 116 HB2 ALA 37 2HB ALA 37 -3.528 12.233 -13.726 117 HB3 ALA 37 3HB ALA 37 -4.159 11.457 -15.200 118 H ILE 38 H ILE 38 -6.405 9.553 -14.878 119 HA ILE 38 HA ILE 38 -8.319 10.733 -16.648 120 HB ILE 38 HB ILE 38 -9.019 8.519 -17.165 121 HG12 ILE 38 2HG1 ILE 38 -8.020 7.761 -14.421 122 HG13 ILE 38 3HG1 ILE 38 -9.635 7.577 -15.093 123 HG21 ILE 38 1HG2 ILE 38 -6.551 9.170 -17.653 124 HG22 ILE 38 2HG2 ILE 38 -6.126 8.005 -16.369 125 HG23 ILE 38 3HG2 ILE 38 -7.004 7.470 -17.811 126 HD11 ILE 38 1HD1 ILE 38 -7.182 5.929 -15.747 127 HD12 ILE 38 2HD1 ILE 38 -8.681 5.410 -14.963 128 HD13 ILE 38 3HD1 ILE 38 -8.716 5.845 -16.667 129 H TYR 39 H TYR 39 -8.600 9.817 -13.351 130 HA TYR 39 HA TYR 39 -11.511 10.102 -13.231 131 HB2 TYR 39 2HB TYR 39 -9.486 9.786 -10.974 132 HB3 TYR 39 3HB TYR 39 -11.225 9.675 -10.840 133 HD1 TYR 39 HD1 TYR 39 -12.499 7.838 -11.919 134 HD2 TYR 39 HD2 TYR 39 -8.210 7.819 -11.746 135 HE1 TYR 39 HE1 TYR 39 -12.434 5.495 -12.796 136 HE2 TYR 39 HE2 TYR 39 -8.138 5.393 -12.456 137 HH TYR 39 HH TYR 39 -9.485 3.653 -13.217 138 H THR 40 H THR 40 -8.700 11.869 -11.837 139 HA THR 40 HA THR 40 -10.240 13.945 -10.671 140 HB THR 40 HB THR 40 -7.798 13.171 -10.261 141 HG1 THR 40 HG1 THR 40 -8.561 15.902 -10.248 142 HG21 THR 40 1HG2 THR 40 -7.119 13.913 -12.643 143 HG22 THR 40 2HG2 THR 40 -6.038 14.257 -11.287 144 HG23 THR 40 3HG2 THR 40 -7.065 15.541 -11.971 145 H GLN 41 H GLN 41 -8.913 13.700 -13.947 146 HA GLN 41 HA GLN 41 -9.387 16.474 -14.650 147 HB2 GLN 41 2HB GLN 41 -8.878 13.926 -16.239 148 HB3 GLN 41 3HB GLN 41 -9.083 15.505 -17.005 149 HG2 GLN 41 2HG GLN 41 -6.890 14.785 -15.000 150 HG3 GLN 41 3HG GLN 41 -6.678 14.922 -16.740 151 HE21 GLN 41 1HE2 GLN 41 -5.295 16.430 -14.582 152 HE22 GLN 41 2HE2 GLN 41 -5.704 18.114 -14.865 153 H LEU 42 H LEU 42 -11.308 13.448 -14.875 154 HA LEU 42 HA LEU 42 -13.414 14.748 -16.407 155 HB2 LEU 42 2HB LEU 42 -12.909 12.257 -16.393 156 HB3 LEU 42 3HB LEU 42 -13.530 12.228 -14.735 157 HG LEU 42 HG LEU 42 -15.755 12.968 -15.555 158 HD11 LEU 42 1HD1 LEU 42 -15.188 14.283 -17.552 159 HD12 LEU 42 2HD1 LEU 42 -16.258 12.960 -17.997 160 HD13 LEU 42 3HD1 LEU 42 -14.518 12.839 -18.341 161 HD21 LEU 42 1HD2 LEU 42 -15.388 10.607 -15.368 162 HD22 LEU 42 2HD2 LEU 42 -14.585 10.546 -16.950 163 HD23 LEU 42 3HD2 LEU 42 -16.327 10.905 -16.835 164 H ILE 43 H ILE 43 -12.784 14.220 -12.935 165 HA ILE 43 HA ILE 43 -15.344 15.203 -12.046 166 HB ILE 43 HB ILE 43 -12.654 14.611 -10.764 167 HG12 ILE 43 2HG1 ILE 43 -14.186 13.266 -9.290 168 HG13 ILE 43 3HG1 ILE 43 -15.557 13.833 -10.273 169 HG21 ILE 43 1HG2 ILE 43 -14.936 16.089 -9.392 170 HG22 ILE 43 2HG2 ILE 43 -13.567 15.321 -8.572 171 HG23 ILE 43 3HG2 ILE 43 -13.275 16.706 -9.617 172 HD11 ILE 43 1HD1 ILE 43 -14.505 12.655 -12.247 173 HD12 ILE 43 2HD1 ILE 43 -13.301 11.989 -11.111 174 HD13 ILE 43 3HD1 ILE 43 -15.017 11.619 -10.917 175 H ARG 44 H ARG 44 -12.192 16.847 -12.402 176 HA ARG 44 HA ARG 44 -13.181 19.363 -11.455 177 HB2 ARG 44 2HB ARG 44 -11.095 20.296 -12.009 178 HB3 ARG 44 3HB ARG 44 -10.834 18.634 -11.491 179 HG2 ARG 44 2HG ARG 44 -9.373 18.774 -13.255 180 HG3 ARG 44 3HG ARG 44 -10.801 18.040 -13.990 181 HD2 ARG 44 2HD ARG 44 -11.435 20.254 -14.936 182 HD3 ARG 44 3HD ARG 44 -10.008 20.978 -14.161 183 HE ARG 44 HE ARG 44 -8.934 18.923 -15.630 184 HH11 ARG 44 1HH1 ARG 44 -8.269 18.864 -17.632 185 HH12 ARG 44 2HH1 ARG 44 -8.855 19.983 -18.854 186 HH21 ARG 44 1HH2 ARG 44 -10.997 21.643 -16.635 187 HH22 ARG 44 2HH2 ARG 44 -10.444 21.514 -18.283 188 H GLN 45 H GLN 45 -13.513 17.871 -14.536 189 HA GLN 45 HA GLN 45 -14.178 20.161 -16.201 190 HB2 GLN 45 2HB GLN 45 -15.264 17.331 -16.106 191 HB3 GLN 45 3HB GLN 45 -15.751 18.489 -17.329 192 HG2 GLN 45 2HG GLN 45 -12.811 18.160 -17.025 193 HG3 GLN 45 3HG GLN 45 -13.697 16.735 -17.601 194 HE21 GLN 45 1HE2 GLN 45 -14.853 16.884 -19.669 195 HE22 GLN 45 2HE2 GLN 45 -14.442 18.163 -20.797 196 H ASN 46 H ASN 46 -16.024 18.354 -13.737 197 HA ASN 46 HA ASN 46 -18.455 19.955 -14.204 198 HB2 ASN 46 2HB ASN 46 -17.740 18.225 -11.820 199 HB3 ASN 46 3HB ASN 46 -19.345 18.813 -12.266 200 HD21 ASN 46 1HD2 ASN 46 -17.033 16.308 -12.675 201 HD22 ASN 46 2HD2 ASN 46 -18.009 15.376 -13.807 202 H LEU 47 H LEU 47 -15.739 19.953 -11.899 203 HA LEU 47 HA LEU 47 -17.047 21.937 -10.181 204 HB2 LEU 47 2HB LEU 47 -14.509 20.312 -9.841 205 HB3 LEU 47 3HB LEU 47 -15.363 21.247 -8.627 206 HG LEU 47 HG LEU 47 -16.412 18.804 -9.959 207 HD11 LEU 47 1HD1 LEU 47 -15.449 19.443 -7.181 208 HD12 LEU 47 2HD1 LEU 47 -14.537 18.565 -8.446 209 HD13 LEU 47 3HD1 LEU 47 -16.029 17.850 -7.778 210 HD21 LEU 47 1HD2 LEU 47 -18.387 20.091 -9.467 211 HD22 LEU 47 2HD2 LEU 47 -17.716 20.651 -7.924 212 HD23 LEU 47 3HD2 LEU 47 -18.194 18.956 -8.115 213 H LEU 48 H LEU 48 -16.866 23.688 -11.309 214 HA LEU 48 HA LEU 48 -14.361 24.828 -12.211 215 HB2 LEU 48 2HB LEU 48 -15.822 26.758 -12.923 216 HB3 LEU 48 3HB LEU 48 -16.166 25.177 -13.601 217 HG LEU 48 HG LEU 48 -18.117 24.884 -12.202 218 HD11 LEU 48 1HD1 LEU 48 -17.536 26.103 -10.160 219 HD12 LEU 48 2HD1 LEU 48 -19.049 26.714 -10.823 220 HD13 LEU 48 3HD1 LEU 48 -17.560 27.647 -11.045 221 HD21 LEU 48 1HD2 LEU 48 -18.066 27.586 -13.600 222 HD22 LEU 48 2HD2 LEU 48 -19.519 26.628 -13.238 223 HD23 LEU 48 3HD2 LEU 48 -18.315 26.011 -14.381 224 H VAL 49 H VAL 49 -14.213 24.324 -9.474 225 HA VAL 49 HA VAL 49 -14.828 26.840 -8.052 226 HB VAL 49 HB VAL 49 -13.713 24.279 -6.943 227 HG11 VAL 49 1HG1 VAL 49 -14.886 26.711 -5.543 228 HG12 VAL 49 2HG1 VAL 49 -14.501 25.173 -4.747 229 HG13 VAL 49 3HG1 VAL 49 -13.203 26.139 -5.444 230 HG21 VAL 49 1HG2 VAL 49 -16.571 25.337 -7.041 231 HG22 VAL 49 2HG2 VAL 49 -15.960 23.874 -7.843 232 HG23 VAL 49 3HG2 VAL 49 -16.066 23.923 -6.085 233 H GLU 50 H GLU 50 -11.911 24.758 -8.085 234 HA GLU 50 HA GLU 50 -9.717 25.139 -8.372 235 HB2 GLU 50 2HB GLU 50 -10.358 27.969 -9.283 236 HB3 GLU 50 3HB GLU 50 -8.884 27.037 -9.560 237 HG2 GLU 50 2HG GLU 50 -10.257 25.355 -10.852 238 HG3 GLU 50 3HG GLU 50 -11.648 26.425 -10.692 239 H ASP 51 H ASP 51 -10.886 28.292 -7.050 240 HA ASP 51 HA ASP 51 -8.490 28.704 -5.516 241 HB2 ASP 51 2HB ASP 51 -9.869 30.511 -6.474 242 HB3 ASP 51 3HB ASP 51 -11.201 30.071 -5.393 243 H SER 52 H SER 52 -11.842 27.788 -4.528 244 HA SER 52 HA SER 52 -11.050 27.375 -1.750 245 HB2 SER 52 2HB SER 52 -13.622 26.451 -3.058 246 HB3 SER 52 3HB SER 52 -13.302 26.686 -1.346 247 HG SER 52 HG SER 52 -14.454 28.473 -2.261 248 H PHE 53 H PHE 53 -10.267 25.521 -4.365 249 HA PHE 53 HA PHE 53 -10.217 22.944 -2.890 250 HB2 PHE 53 2HB PHE 53 -9.492 23.696 -5.739 251 HB3 PHE 53 3HB PHE 53 -9.307 22.103 -5.041 252 HD1 PHE 53 HD1 PHE 53 -12.272 22.879 -3.473 253 HD2 PHE 53 HD2 PHE 53 -10.790 22.346 -7.508 254 HE1 PHE 53 HE1 PHE 53 -14.468 22.142 -4.180 255 HE2 PHE 53 HE2 PHE 53 -12.998 21.515 -8.185 256 HZ PHE 53 HZ PHE 53 -14.861 21.406 -6.535 257 H ARG 54 H ARG 54 -8.423 25.776 -3.325 258 HA ARG 54 HA ARG 54 -5.831 24.506 -2.525 259 HB2 ARG 54 2HB ARG 54 -6.449 27.052 -4.076 260 HB3 ARG 54 3HB ARG 54 -4.843 26.620 -3.503 261 HG2 ARG 54 2HG ARG 54 -6.499 24.891 -5.397 262 HG3 ARG 54 3HG ARG 54 -5.276 26.037 -5.894 263 HD2 ARG 54 2HD ARG 54 -3.576 24.745 -4.529 264 HD3 ARG 54 3HD ARG 54 -4.855 23.563 -4.155 265 HE ARG 54 HE ARG 54 -4.744 23.907 -6.957 266 HH11 ARG 54 1HH1 ARG 54 -2.845 22.365 -4.399 267 HH12 ARG 54 2HH1 ARG 54 -1.994 21.349 -5.525 268 HH21 ARG 54 1HH2 ARG 54 -3.657 22.516 -8.348 269 HH22 ARG 54 2HH2 ARG 54 -2.486 21.391 -7.715 270 H GLY 55 H GLY 55 -4.441 26.196 -1.292 271 HA2 GLY 55 HA2 GLY 55 -4.110 27.390 0.680 272 HA3 GLY 55 HA3 GLY 55 -5.840 27.775 0.744 273 H LYS 56 H LYS 56 -6.421 24.819 0.510 274 HA LYS 56 HA LYS 56 -5.712 23.788 3.215 275 HB2 LYS 56 2HB LYS 56 -7.996 22.840 3.287 276 HB3 LYS 56 3HB LYS 56 -7.962 24.588 3.241 277 HG2 LYS 56 2HG LYS 56 -9.758 23.893 1.912 278 HG3 LYS 56 3HG LYS 56 -8.564 24.561 0.824 279 HD2 LYS 56 2HD LYS 56 -7.932 22.390 0.001 280 HD3 LYS 56 3HD LYS 56 -8.847 21.544 1.274 281 HE2 LYS 56 2HE LYS 56 -9.940 23.297 -0.945 282 HE3 LYS 56 3HE LYS 56 -9.911 21.524 -0.983 283 HZ1 LYS 56 HZ1 LYS 56 -11.512 21.475 0.805 284 HZ2 LYS 56 HZ2 LYS 56 -12.075 22.530 -0.336 285 HZ3 LYS 56 HZ3 LYS 56 -11.424 23.090 1.041 286 H GLN 57 H GLN 57 -6.537 21.225 3.127 287 HA GLN 57 HA GLN 57 -5.526 20.020 0.592 288 HB2 GLN 57 2HB GLN 57 -3.878 18.820 1.626 289 HB3 GLN 57 3HB GLN 57 -3.878 20.195 2.666 290 HG2 GLN 57 2HG GLN 57 -3.936 18.691 4.283 291 HG3 GLN 57 3HG GLN 57 -5.672 18.726 4.034 292 HE21 GLN 57 1HE2 GLN 57 -4.148 17.029 1.452 293 HE22 GLN 57 2HE2 GLN 57 -4.526 15.439 2.110 294 H CYS 58 H CYS 58 -6.216 17.739 0.327 295 HA CYS 58 HA CYS 58 -8.225 16.642 2.107 296 HB2 CYS 58 2HB CYS 58 -9.639 18.225 0.900 297 HB3 CYS 58 3HB CYS 58 -8.942 17.724 -0.634 298 HG CYS 58 HG CYS 58 -10.602 15.729 1.430 299 H ARG 59 H ARG 59 -8.444 14.475 1.841 300 HA ARG 59 HA ARG 59 -7.392 13.181 -0.582 301 HB2 ARG 59 2HB ARG 59 -6.621 11.237 0.747 302 HB3 ARG 59 3HB ARG 59 -5.623 12.660 0.895 303 HG2 ARG 59 2HG ARG 59 -7.682 12.413 3.023 304 HG3 ARG 59 3HG ARG 59 -6.512 11.088 2.983 305 HD2 ARG 59 2HD ARG 59 -5.801 14.030 3.053 306 HD3 ARG 59 3HD ARG 59 -5.923 12.998 4.486 307 HE ARG 59 HE ARG 59 -4.163 11.725 2.663 308 HH11 ARG 59 1HH1 ARG 59 -4.125 14.641 4.693 309 HH12 ARG 59 2HH1 ARG 59 -2.437 14.438 5.078 310 HH21 ARG 59 1HH2 ARG 59 -1.982 11.601 3.125 311 HH22 ARG 59 2HH2 ARG 59 -1.236 12.785 4.159 312 H VAL 60 H VAL 60 -8.855 11.862 -1.485 313 HA VAL 60 HA VAL 60 -10.798 10.435 0.229 314 HB VAL 60 HB VAL 60 -12.728 10.928 -1.130 315 HG11 VAL 60 1HG1 VAL 60 -11.439 13.562 -0.341 316 HG12 VAL 60 2HG1 VAL 60 -13.161 13.242 -0.489 317 HG13 VAL 60 3HG1 VAL 60 -12.206 12.467 0.802 318 HG21 VAL 60 1HG2 VAL 60 -12.755 12.629 -2.893 319 HG22 VAL 60 2HG2 VAL 60 -11.006 12.884 -2.718 320 HG23 VAL 60 3HG2 VAL 60 -11.635 11.318 -3.318 321 H ASN 61 H ASN 61 -11.942 8.713 -1.196 322 HA ASN 61 HA ASN 61 -10.032 7.757 -3.245 323 HB2 ASN 61 2HB ASN 61 -9.352 6.786 -1.172 324 HB3 ASN 61 3HB ASN 61 -10.997 6.367 -0.716 325 HD21 ASN 61 1HD2 ASN 61 -12.128 4.737 -2.147 326 HD22 ASN 61 2HD2 ASN 61 -11.140 3.471 -2.857 327 H LEU 62 H LEU 62 -10.813 6.823 -4.956 328 HA LEU 62 HA LEU 62 -13.798 6.497 -5.194 329 HB2 LEU 62 2HB LEU 62 -11.540 7.194 -7.057 330 HB3 LEU 62 3HB LEU 62 -12.957 6.369 -7.707 331 HG LEU 62 HG LEU 62 -14.415 8.165 -6.973 332 HD11 LEU 62 1HD1 LEU 62 -11.883 9.507 -5.903 333 HD12 LEU 62 2HD1 LEU 62 -13.314 9.041 -4.956 334 HD13 LEU 62 3HD1 LEU 62 -13.436 10.341 -6.145 335 HD21 LEU 62 1HD2 LEU 62 -13.533 9.913 -8.533 336 HD22 LEU 62 2HD2 LEU 62 -13.344 8.278 -9.187 337 HD23 LEU 62 3HD2 LEU 62 -11.949 9.123 -8.488 338 H LYS 63 H LYS 63 -14.667 4.589 -5.437 339 HA LYS 63 HA LYS 63 -12.985 2.209 -6.141 340 HB2 LYS 63 2HB LYS 63 -15.528 2.324 -4.482 341 HB3 LYS 63 3HB LYS 63 -14.565 0.892 -4.836 342 HG2 LYS 63 2HG LYS 63 -12.662 1.890 -3.556 343 HG3 LYS 63 3HG LYS 63 -13.686 3.287 -3.171 344 HD2 LYS 63 2HD LYS 63 -15.298 1.803 -2.026 345 HD3 LYS 63 3HD LYS 63 -14.240 0.416 -2.361 346 HE2 LYS 63 2HE LYS 63 -12.427 1.422 -1.050 347 HE3 LYS 63 3HE LYS 63 -13.378 2.897 -0.806 348 HZ1 LYS 63 HZ1 LYS 63 -14.975 1.598 0.459 349 HZ2 LYS 63 HZ2 LYS 63 -13.490 1.448 1.126 350 HZ3 LYS 63 HZ3 LYS 63 -14.109 0.223 0.233 351 H LEU 64 H LEU 64 -13.295 2.018 -8.367 352 HA LEU 64 HA LEU 64 -16.030 2.432 -9.404 353 HB2 LEU 64 2HB LEU 64 -13.479 2.031 -10.992 354 HB3 LEU 64 3HB LEU 64 -15.058 2.577 -11.560 355 HG LEU 64 HG LEU 64 -13.943 4.476 -11.656 356 HD11 LEU 64 1HD1 LEU 64 -14.562 6.039 -9.902 357 HD12 LEU 64 2HD1 LEU 64 -14.987 4.704 -8.817 358 HD13 LEU 64 3HD1 LEU 64 -15.871 4.941 -10.339 359 HD21 LEU 64 1HD2 LEU 64 -12.267 5.307 -10.127 360 HD22 LEU 64 2HD2 LEU 64 -11.858 3.696 -10.733 361 HD23 LEU 64 3HD2 LEU 64 -12.484 3.913 -9.064 362 H ILE 65 H ILE 65 -16.877 1.054 -10.974 363 HA ILE 65 HA ILE 65 -16.101 -1.839 -10.778 364 HB ILE 65 HB ILE 65 -18.351 -2.200 -11.913 365 HG12 ILE 65 2HG1 ILE 65 -19.083 0.545 -10.796 366 HG13 ILE 65 3HG1 ILE 65 -18.631 0.310 -12.487 367 HG21 ILE 65 1HG2 ILE 65 -17.869 -2.721 -9.533 368 HG22 ILE 65 2HG2 ILE 65 -18.314 -1.070 -9.070 369 HG23 ILE 65 3HG2 ILE 65 -19.534 -2.174 -9.741 370 HD11 ILE 65 1HD1 ILE 65 -21.016 0.317 -12.270 371 HD12 ILE 65 2HD1 ILE 65 -20.465 -1.284 -12.791 372 HD13 ILE 65 3HD1 ILE 65 -20.970 -1.011 -11.098 373 HA PRO 66 HA PRO 66 -14.468 -1.246 -14.896 374 HB2 PRO 66 2HB PRO 66 -14.128 -3.840 -15.739 375 HB3 PRO 66 3HB PRO 66 -13.094 -3.058 -14.506 376 HG2 PRO 66 2HG PRO 66 -15.472 -4.890 -14.050 377 HG3 PRO 66 3HG PRO 66 -13.856 -4.947 -13.273 378 HD2 PRO 66 2HD PRO 66 -16.011 -3.769 -12.088 379 HD3 PRO 66 3HD PRO 66 -14.351 -3.132 -11.866 380 H THR 67 H THR 67 -15.463 -0.748 -16.736 381 HA THR 67 HA THR 67 -18.029 -2.024 -17.553 382 HB THR 67 HB THR 67 -17.672 0.951 -17.033 383 HG1 THR 67 HG1 THR 67 -17.876 -0.288 -15.127 384 HG21 THR 67 1HG2 THR 67 -19.261 0.494 -18.863 385 HG22 THR 67 2HG2 THR 67 -20.125 1.022 -17.413 386 HG23 THR 67 3HG2 THR 67 -20.109 -0.709 -17.853 387 H GLY 68 H GLY 68 -16.917 -2.852 -19.288 388 HA2 GLY 68 HA2 GLY 68 -16.192 -2.893 -21.502 389 HA3 GLY 68 HA3 GLY 68 -16.842 -1.261 -21.656 390 H THR 69 H THR 69 -15.414 0.106 -22.390 391 HA THR 69 HA THR 69 -12.511 -0.185 -22.072 392 HB THR 69 HB THR 69 -12.512 1.881 -23.527 393 HG1 THR 69 HG1 THR 69 -14.520 2.466 -24.388 394 HG21 THR 69 1HG2 THR 69 -12.383 -0.402 -24.489 395 HG22 THR 69 2HG2 THR 69 -13.228 0.728 -25.554 396 HG23 THR 69 3HG2 THR 69 -14.159 -0.457 -24.603 397 H GLY 70 H GLY 70 -14.722 0.945 -19.922 398 HA2 GLY 70 HA2 GLY 70 -12.762 2.845 -18.718 399 HA3 GLY 70 HA3 GLY 70 -14.447 3.304 -18.902 400 H ALA 71 H ALA 71 -14.028 3.585 -16.496 401 HA ALA 71 HA ALA 71 -15.272 1.235 -15.186 402 HB1 ALA 71 1HB ALA 71 -13.483 3.197 -13.711 403 HB2 ALA 71 2HB ALA 71 -14.060 1.585 -13.189 404 HB3 ALA 71 3HB ALA 71 -12.854 1.717 -14.451 405 H LEU 72 H LEU 72 -16.742 1.880 -13.374 406 HA LEU 72 HA LEU 72 -17.994 4.586 -13.660 407 HB2 LEU 72 2HB LEU 72 -19.093 1.990 -14.367 408 HB3 LEU 72 3HB LEU 72 -19.897 2.504 -12.907 409 HG LEU 72 HG LEU 72 -20.560 4.635 -14.004 410 HD11 LEU 72 1HD1 LEU 72 -18.815 4.971 -15.608 411 HD12 LEU 72 2HD1 LEU 72 -20.311 4.728 -16.526 412 HD13 LEU 72 3HD1 LEU 72 -19.132 3.404 -16.398 413 HD21 LEU 72 1HD2 LEU 72 -21.283 2.105 -15.567 414 HD22 LEU 72 2HD2 LEU 72 -22.219 3.622 -15.527 415 HD23 LEU 72 3HD2 LEU 72 -22.047 2.653 -14.049 416 H LEU 73 H LEU 73 -18.870 5.499 -11.744 417 HA LEU 73 HA LEU 73 -17.625 4.779 -9.328 418 HB2 LEU 73 2HB LEU 73 -18.508 7.004 -10.017 419 HB3 LEU 73 3HB LEU 73 -20.140 6.459 -9.649 420 HG LEU 73 HG LEU 73 -18.984 7.916 -7.943 421 HD11 LEU 73 1HD1 LEU 73 -20.941 6.558 -7.307 422 HD12 LEU 73 2HD1 LEU 73 -19.808 6.795 -5.969 423 HD13 LEU 73 3HD1 LEU 73 -19.869 5.238 -6.809 424 HD21 LEU 73 1HD2 LEU 73 -16.714 6.778 -8.130 425 HD22 LEU 73 2HD2 LEU 73 -17.385 5.428 -7.201 426 HD23 LEU 73 3HD2 LEU 73 -17.288 7.043 -6.483 427 H GLY 74 H GLY 74 -17.767 3.032 -8.238 428 HA2 GLY 74 HA2 GLY 74 -20.336 1.613 -7.744 429 HA3 GLY 74 HA3 GLY 74 -18.691 1.044 -7.380 430 H SER 75 H SER 75 -17.707 3.394 -6.041 431 HA SER 75 HA SER 75 -19.497 4.272 -3.945 432 HB2 SER 75 2HB SER 75 -17.535 2.049 -3.358 433 HB3 SER 75 3HB SER 75 -17.859 3.270 -2.131 434 HG SER 75 HG SER 75 -19.910 1.778 -3.422 435 H LEU 76 H LEU 76 -18.534 5.896 -2.619 436 HA LEU 76 HA LEU 76 -15.746 6.689 -3.275 437 HB2 LEU 76 2HB LEU 76 -17.456 8.061 -4.481 438 HB3 LEU 76 3HB LEU 76 -18.080 8.634 -2.951 439 HG LEU 76 HG LEU 76 -15.123 8.922 -3.410 440 HD11 LEU 76 1HD1 LEU 76 -15.939 9.531 -5.587 441 HD12 LEU 76 2HD1 LEU 76 -15.511 11.024 -4.734 442 HD13 LEU 76 3HD1 LEU 76 -17.221 10.529 -4.900 443 HD21 LEU 76 1HD2 LEU 76 -15.461 11.081 -2.275 444 HD22 LEU 76 2HD2 LEU 76 -16.146 9.770 -1.316 445 HD23 LEU 76 3HD2 LEU 76 -17.222 10.815 -2.260 446 H THR 77 H THR 77 -14.537 6.947 -1.606 447 HA THR 77 HA THR 77 -15.652 6.887 1.191 448 HB THR 77 HB THR 77 -13.029 5.892 -0.011 449 HG1 THR 77 HG1 THR 77 -15.254 4.535 1.131 450 HG21 THR 77 1HG2 THR 77 -14.033 5.766 2.865 451 HG22 THR 77 2HG2 THR 77 -12.593 6.620 2.258 452 HG23 THR 77 3HG2 THR 77 -12.643 4.856 2.213 453 H VAL 78 H VAL 78 -15.413 8.843 2.228 454 HA VAL 78 HA VAL 78 -13.249 10.682 1.372 455 HB VAL 78 HB VAL 78 -14.023 12.240 3.076 456 HG11 VAL 78 1HG1 VAL 78 -16.099 12.895 1.948 457 HG12 VAL 78 2HG1 VAL 78 -14.893 12.363 0.779 458 HG13 VAL 78 3HG1 VAL 78 -16.246 11.288 1.204 459 HG21 VAL 78 1HG2 VAL 78 -16.285 10.267 3.588 460 HG22 VAL 78 2HG2 VAL 78 -15.023 10.753 4.751 461 HG23 VAL 78 3HG2 VAL 78 -16.206 11.944 4.180 462 H LEU 79 H LEU 79 -11.268 10.865 2.361 463 HA LEU 79 HA LEU 79 -10.774 9.083 4.722 464 HB2 LEU 79 2HB LEU 79 -8.822 10.295 2.731 465 HB3 LEU 79 3HB LEU 79 -8.415 9.214 4.035 466 HG LEU 79 HG LEU 79 -10.193 8.471 1.657 467 HD11 LEU 79 1HD1 LEU 79 -7.911 8.953 0.924 468 HD12 LEU 79 2HD1 LEU 79 -8.196 7.209 0.870 469 HD13 LEU 79 3HD1 LEU 79 -7.253 7.895 2.200 470 HD21 LEU 79 1HD2 LEU 79 -9.826 6.149 2.409 471 HD22 LEU 79 2HD2 LEU 79 -10.652 7.091 3.659 472 HD23 LEU 79 3HD2 LEU 79 -8.914 6.734 3.819 473 H ASP 80 H ASP 80 -10.055 12.357 3.436 474 HA ASP 80 HA ASP 80 -10.749 13.643 5.870 475 HB2 ASP 80 2HB ASP 80 -8.307 12.682 6.353 476 HB3 ASP 80 3HB ASP 80 -7.805 13.974 5.277 477 H GLY 81 H GLY 81 -10.217 16.022 5.753 478 HA2 GLY 81 HA2 GLY 81 -8.995 17.578 4.059 479 HA3 GLY 81 HA3 GLY 81 -10.297 17.092 2.971 480 H ASP 82 H ASP 82 -10.180 19.546 3.105 481 HA ASP 82 HA ASP 82 -12.003 20.687 5.148 482 HB2 ASP 82 2HB ASP 82 -10.123 22.058 4.491 483 HB3 ASP 82 3HB ASP 82 -10.490 21.829 2.797 484 H SER 83 H SER 83 -14.114 20.530 4.826 485 HA SER 83 HA SER 83 -15.063 18.638 3.075 486 HB2 SER 83 2HB SER 83 -17.292 19.194 3.968 487 HB3 SER 83 3HB SER 83 -16.062 19.149 5.228 488 HG SER 83 HG SER 83 -17.038 21.025 5.656 489 H ARG 84 H ARG 84 -14.753 21.953 2.258 490 HA ARG 84 HA ARG 84 -16.826 22.267 0.315 491 HB2 ARG 84 2HB ARG 84 -14.113 23.582 0.719 492 HB3 ARG 84 3HB ARG 84 -15.097 23.921 -0.695 493 HG2 ARG 84 2HG ARG 84 -15.479 25.641 0.851 494 HG3 ARG 84 3HG ARG 84 -16.953 24.708 0.707 495 HD2 ARG 84 2HD ARG 84 -14.979 24.331 2.990 496 HD3 ARG 84 3HD ARG 84 -16.235 25.556 3.031 497 HE ARG 84 HE ARG 84 -16.566 22.765 3.588 498 HH11 ARG 84 1HH1 ARG 84 -18.402 25.500 2.277 499 HH12 ARG 84 2HH1 ARG 84 -19.922 24.745 2.647 500 HH21 ARG 84 1HH2 ARG 84 -18.479 21.866 3.992 501 HH22 ARG 84 2HH2 ARG 84 -19.973 22.706 3.636 502 H LEU 85 H LEU 85 -13.741 20.464 0.130 503 HA LEU 85 HA LEU 85 -14.204 20.052 -2.793 504 HB2 LEU 85 2HB LEU 85 -11.945 20.539 -2.188 505 HB3 LEU 85 3HB LEU 85 -11.912 19.233 -0.986 506 HG LEU 85 HG LEU 85 -12.014 17.545 -2.687 507 HD11 LEU 85 1HD1 LEU 85 -12.177 19.733 -4.828 508 HD12 LEU 85 2HD1 LEU 85 -13.498 18.630 -4.412 509 HD13 LEU 85 3HD1 LEU 85 -12.006 17.991 -5.106 510 HD21 LEU 85 1HD2 LEU 85 -9.839 18.702 -2.196 511 HD22 LEU 85 2HD2 LEU 85 -10.070 19.694 -3.641 512 HD23 LEU 85 3HD2 LEU 85 -9.892 17.937 -3.797 513 H CYS 86 H CYS 86 -13.922 17.963 0.196 514 HA CYS 86 HA CYS 86 -14.743 15.562 -0.804 515 HB2 CYS 86 2HB CYS 86 -15.853 16.734 1.785 516 HB3 CYS 86 3HB CYS 86 -15.596 15.027 1.384 517 HG CYS 86 HG CYS 86 -12.956 15.219 1.148 518 H ALA 87 H ALA 87 -17.062 18.212 0.043 519 HA ALA 87 HA ALA 87 -19.413 16.687 -0.664 520 HB1 ALA 87 1HB ALA 87 -18.930 19.696 -0.470 521 HB2 ALA 87 2HB ALA 87 -20.517 18.896 -0.493 522 HB3 ALA 87 3HB ALA 87 -19.422 18.620 0.873 523 H ALA 88 H ALA 88 -17.384 18.965 -2.517 524 HA ALA 88 HA ALA 88 -19.118 19.114 -4.799 525 HB1 ALA 88 1HB ALA 88 -17.512 20.874 -4.138 526 HB2 ALA 88 2HB ALA 88 -16.145 19.783 -4.439 527 HB3 ALA 88 3HB ALA 88 -17.175 20.313 -5.777 528 H THR 89 H THR 89 -16.024 17.319 -4.297 529 HA THR 89 HA THR 89 -15.989 16.001 -6.834 530 HB THR 89 HB THR 89 -14.052 16.234 -5.307 531 HG1 THR 89 HG1 THR 89 -13.292 14.163 -5.898 532 HG21 THR 89 1HG2 THR 89 -15.289 15.357 -3.198 533 HG22 THR 89 2HG2 THR 89 -13.639 14.775 -3.496 534 HG23 THR 89 3HG2 THR 89 -15.050 13.750 -3.871 535 H LYS 90 H LYS 90 -17.338 14.932 -3.722 536 HA LYS 90 HA LYS 90 -18.189 12.337 -4.391 537 HB2 LYS 90 2HB LYS 90 -18.109 13.291 -2.159 538 HB3 LYS 90 3HB LYS 90 -19.309 14.513 -2.610 539 HG2 LYS 90 2HG LYS 90 -20.840 12.337 -2.978 540 HG3 LYS 90 3HG LYS 90 -19.663 11.618 -1.864 541 HD2 LYS 90 2HD LYS 90 -21.198 14.205 -1.406 542 HD3 LYS 90 3HD LYS 90 -21.684 12.621 -0.762 543 HE2 LYS 90 2HE LYS 90 -19.446 12.462 0.409 544 HE3 LYS 90 3HE LYS 90 -19.095 14.116 -0.117 545 HZ1 LYS 90 HZ1 LYS 90 -20.004 14.117 2.128 546 HZ2 LYS 90 HZ2 LYS 90 -21.346 13.320 1.653 547 HZ3 LYS 90 HZ3 LYS 90 -21.079 14.841 1.133 548 H ARG 91 H ARG 91 -19.936 15.405 -4.794 549 HA ARG 91 HA ARG 91 -22.229 14.222 -6.064 550 HB2 ARG 91 2HB ARG 91 -21.137 17.059 -6.016 551 HB3 ARG 91 3HB ARG 91 -22.646 16.661 -6.845 552 HG2 ARG 91 2HG ARG 91 -22.166 16.200 -3.869 553 HG3 ARG 91 3HG ARG 91 -22.994 17.597 -4.571 554 HD2 ARG 91 2HD ARG 91 -24.657 16.021 -5.612 555 HD3 ARG 91 3HD ARG 91 -23.852 14.688 -4.769 556 HE ARG 91 HE ARG 91 -24.504 16.700 -2.870 557 HH11 ARG 91 1HH1 ARG 91 -26.191 14.290 -4.848 558 HH12 ARG 91 2HH1 ARG 91 -27.522 14.176 -3.734 559 HH21 ARG 91 1HH2 ARG 91 -26.260 16.510 -1.483 560 HH22 ARG 91 2HH2 ARG 91 -27.566 15.433 -1.870 561 H ALA 92 H ALA 92 -19.352 15.803 -7.481 562 HA ALA 92 HA ALA 92 -20.096 15.565 -10.212 563 HB1 ALA 92 1HB ALA 92 -17.347 15.615 -8.897 564 HB2 ALA 92 2HB ALA 92 -17.651 15.808 -10.640 565 HB3 ALA 92 3HB ALA 92 -18.286 16.995 -9.489 566 H VAL 93 H VAL 93 -18.123 13.317 -8.225 567 HA VAL 93 HA VAL 93 -17.781 11.401 -10.288 568 HB VAL 93 HB VAL 93 -17.839 10.530 -7.400 569 HG11 VAL 93 1HG1 VAL 93 -16.053 9.076 -8.097 570 HG12 VAL 93 2HG1 VAL 93 -17.334 8.921 -9.298 571 HG13 VAL 93 3HG1 VAL 93 -15.904 9.903 -9.654 572 HG21 VAL 93 1HG2 VAL 93 -16.374 12.086 -6.805 573 HG22 VAL 93 2HG2 VAL 93 -15.187 11.362 -7.892 574 HG23 VAL 93 3HG2 VAL 93 -16.175 12.700 -8.447 575 H ALA 94 H ALA 94 -20.501 11.991 -8.233 576 HA ALA 94 HA ALA 94 -21.790 9.376 -8.665 577 HB1 ALA 94 1HB ALA 94 -22.847 11.957 -7.425 578 HB2 ALA 94 2HB ALA 94 -23.656 10.381 -7.399 579 HB3 ALA 94 3HB ALA 94 -22.126 10.582 -6.541 580 H GLN 95 H GLN 95 -21.316 12.136 -10.598 581 HA GLN 95 HA GLN 95 -23.726 11.495 -12.263 582 HB2 GLN 95 2HB GLN 95 -24.176 13.832 -12.583 583 HB3 GLN 95 3HB GLN 95 -24.150 13.440 -10.860 584 HG2 GLN 95 2HG GLN 95 -22.924 15.459 -10.896 585 HG3 GLN 95 3HG GLN 95 -21.721 14.266 -10.876 586 HE21 GLN 95 1HE2 GLN 95 -20.134 14.450 -12.504 587 HE22 GLN 95 2HE2 GLN 95 -20.329 15.558 -13.869 588 H VAL 96 H VAL 96 -20.295 11.961 -12.302 589 HA VAL 96 HA VAL 96 -19.885 12.637 -15.020 590 HB VAL 96 HB VAL 96 -17.791 11.268 -14.857 591 HG11 VAL 96 1HG1 VAL 96 -17.900 13.677 -14.162 592 HG12 VAL 96 2HG1 VAL 96 -18.048 13.122 -12.482 593 HG13 VAL 96 3HG1 VAL 96 -16.606 12.735 -13.401 594 HG21 VAL 96 1HG2 VAL 96 -18.237 9.492 -13.382 595 HG22 VAL 96 2HG2 VAL 96 -17.159 10.590 -12.490 596 HG23 VAL 96 3HG2 VAL 96 -18.863 10.573 -12.123 597 H ASN 97 H ASN 97 -19.556 11.468 -16.922 598 HA ASN 97 HA ASN 97 -21.486 9.438 -17.338 599 HB2 ASN 97 2HB ASN 97 -20.682 11.174 -18.972 600 HB3 ASN 97 3HB ASN 97 -19.225 10.206 -19.222 601 HD21 ASN 97 1HD2 ASN 97 -19.545 7.945 -20.164 602 HD22 ASN 97 2HD2 ASN 97 -20.980 7.675 -21.130 603 H SER 98 H SER 98 -17.908 9.175 -17.300 604 HA SER 98 HA SER 98 -17.551 6.537 -16.404 605 HB2 SER 98 2HB SER 98 -16.999 5.403 -18.596 606 HB3 SER 98 3HB SER 98 -18.723 5.612 -18.306 607 HG SER 98 HG SER 98 -17.058 7.249 -19.972 608 H PHE 99 H PHE 99 -15.395 6.032 -16.223 609 HA PHE 99 HA PHE 99 -13.479 8.139 -17.059 610 HB2 PHE 99 2HB PHE 99 -12.939 5.830 -15.177 611 HB3 PHE 99 3HB PHE 99 -12.113 7.371 -15.292 612 HD1 PHE 99 HD1 PHE 99 -13.336 9.485 -14.494 613 HD2 PHE 99 HD2 PHE 99 -14.820 5.483 -13.738 614 HE1 PHE 99 HE1 PHE 99 -14.846 10.350 -12.744 615 HE2 PHE 99 HE2 PHE 99 -16.329 6.376 -12.012 616 HZ PHE 99 HZ PHE 99 -16.344 8.778 -11.499 617 HA PRO 100 HA PRO 100 -12.383 4.909 -20.096 618 HB2 PRO 100 2HB PRO 100 -10.946 6.378 -21.880 619 HB3 PRO 100 3HB PRO 100 -12.726 6.502 -21.744 620 HG2 PRO 100 2HG PRO 100 -10.621 8.303 -20.523 621 HG3 PRO 100 3HG PRO 100 -12.088 8.788 -21.418 622 HD2 PRO 100 2HD PRO 100 -12.010 8.712 -18.673 623 HD3 PRO 100 3HD PRO 100 -13.487 8.315 -19.600 624 H LEU 101 H LEU 101 -10.662 3.457 -20.072 625 HA LEU 101 HA LEU 101 -8.559 4.055 -18.187 626 HB2 LEU 101 2HB LEU 101 -8.770 1.542 -19.875 627 HB3 LEU 101 3HB LEU 101 -7.979 1.762 -18.319 628 HG LEU 101 HG LEU 101 -10.916 1.603 -18.924 629 HD11 LEU 101 1HD1 LEU 101 -10.880 -0.350 -17.483 630 HD12 LEU 101 2HD1 LEU 101 -9.149 -0.082 -17.151 631 HD13 LEU 101 3HD1 LEU 101 -9.692 -0.509 -18.788 632 HD21 LEU 101 1HD2 LEU 101 -9.632 2.387 -16.286 633 HD22 LEU 101 2HD2 LEU 101 -11.297 1.816 -16.420 634 HD23 LEU 101 3HD2 LEU 101 -10.805 3.321 -17.199 635 HA PRO 102 HA PRO 102 -5.246 4.912 -21.147 636 HB2 PRO 102 2HB PRO 102 -3.046 4.340 -19.636 637 HB3 PRO 102 3HB PRO 102 -4.052 5.787 -19.373 638 HG2 PRO 102 2HG PRO 102 -4.141 3.144 -17.882 639 HG3 PRO 102 3HG PRO 102 -4.149 4.805 -17.206 640 HD2 PRO 102 2HD PRO 102 -6.433 3.357 -17.567 641 HD3 PRO 102 3HD PRO 102 -6.396 5.130 -17.764 642 H LYS 103 H LYS 103 -5.335 1.830 -19.345 643 HA LYS 103 HA LYS 103 -4.673 0.288 -21.747 644 HB2 LYS 103 2HB LYS 103 -3.093 0.265 -19.148 645 HB3 LYS 103 3HB LYS 103 -3.348 -1.226 -20.026 646 HG2 LYS 103 2HG LYS 103 -1.362 -0.626 -20.975 647 HG3 LYS 103 3HG LYS 103 -2.496 0.085 -22.123 648 HD2 LYS 103 2HD LYS 103 -2.201 2.169 -20.374 649 HD3 LYS 103 3HD LYS 103 -0.631 1.395 -20.154 650 HE2 LYS 103 2HE LYS 103 -1.875 2.174 -22.833 651 HE3 LYS 103 3HE LYS 103 -0.747 3.204 -21.957 652 HZ1 LYS 103 HZ1 LYS 103 -0.072 0.487 -22.963 653 HZ2 LYS 103 HZ2 LYS 103 0.955 1.496 -22.178 654 HZ3 LYS 103 HZ3 LYS 103 0.399 1.888 -23.657 655 H ASP 104 H ASP 104 -5.463 -1.884 -21.661 656 HA ASP 104 HA ASP 104 -7.995 -1.970 -20.133 657 HB2 ASP 104 2HB ASP 104 -7.875 -1.573 -22.610 658 HB3 ASP 104 3HB ASP 104 -7.201 -3.190 -22.798 659 H GLN 105 H GLN 105 -5.183 -3.497 -19.537 660 HA GLN 105 HA GLN 105 -6.017 -6.258 -19.898 661 HB2 GLN 105 2HB GLN 105 -3.473 -5.076 -18.759 662 HB3 GLN 105 3HB GLN 105 -3.816 -6.792 -18.808 663 HG2 GLN 105 2HG GLN 105 -2.462 -6.266 -20.705 664 HG3 GLN 105 3HG GLN 105 -4.053 -6.767 -21.262 665 HE21 GLN 105 1HE2 GLN 105 -2.552 -3.679 -20.179 666 HE22 GLN 105 2HE2 GLN 105 -3.051 -2.756 -21.599 667 HA PRO 106 HA PRO 106 -7.828 -6.677 -15.875 668 HB2 PRO 106 2HB PRO 106 -7.639 -9.384 -15.407 669 HB3 PRO 106 3HB PRO 106 -8.744 -8.646 -16.606 670 HG2 PRO 106 2HG PRO 106 -5.980 -9.814 -17.086 671 HG3 PRO 106 3HG PRO 106 -7.488 -10.163 -17.982 672 HD2 PRO 106 2HD PRO 106 -5.693 -8.361 -18.896 673 HD3 PRO 106 3HD PRO 106 -7.453 -8.049 -19.043 674 H ASP 107 H ASP 107 -4.529 -6.845 -16.320 675 HA ASP 107 HA ASP 107 -3.825 -7.364 -13.470 676 HB2 ASP 107 2HB ASP 107 -2.346 -8.100 -15.337 677 HB3 ASP 107 3HB ASP 107 -2.162 -6.423 -15.839 678 H VAL 108 H VAL 108 -4.184 -4.651 -15.780 679 HA VAL 108 HA VAL 108 -3.391 -2.683 -13.694 680 HB VAL 108 HB VAL 108 -3.306 -1.037 -15.398 681 HG11 VAL 108 1HG1 VAL 108 -1.415 -1.838 -16.699 682 HG12 VAL 108 2HG1 VAL 108 -1.316 -2.482 -15.058 683 HG13 VAL 108 3HG1 VAL 108 -1.858 -3.517 -16.402 684 HG21 VAL 108 1HG2 VAL 108 -4.201 -3.108 -17.406 685 HG22 VAL 108 2HG2 VAL 108 -5.130 -1.677 -16.869 686 HG23 VAL 108 3HG2 VAL 108 -3.622 -1.479 -17.766 687 H VAL 109 H VAL 109 -6.246 -3.745 -15.527 688 HA VAL 109 HA VAL 109 -8.081 -1.716 -14.846 689 HB VAL 109 HB VAL 109 -8.369 -4.720 -15.139 690 HG11 VAL 109 1HG1 VAL 109 -10.830 -4.385 -15.440 691 HG12 VAL 109 2HG1 VAL 109 -10.309 -4.117 -13.777 692 HG13 VAL 109 3HG1 VAL 109 -10.650 -2.728 -14.835 693 HG21 VAL 109 1HG2 VAL 109 -7.784 -3.237 -17.162 694 HG22 VAL 109 2HG2 VAL 109 -9.237 -4.238 -17.328 695 HG23 VAL 109 3HG2 VAL 109 -9.370 -2.500 -16.960 696 H GLU 110 H GLU 110 -6.568 -4.132 -12.800 697 HA GLU 110 HA GLU 110 -8.466 -3.807 -10.587 698 HB2 GLU 110 2HB GLU 110 -5.884 -5.363 -10.809 699 HB3 GLU 110 3HB GLU 110 -6.948 -5.360 -9.401 700 HG2 GLU 110 2HG GLU 110 -8.840 -6.136 -10.867 701 HG3 GLU 110 3HG GLU 110 -7.681 -6.339 -12.182 702 H LYS 111 H LYS 111 -5.902 -1.889 -11.661 703 HA LYS 111 HA LYS 111 -5.103 -1.031 -8.913 704 HB2 LYS 111 2HB LYS 111 -3.798 -0.959 -11.623 705 HB3 LYS 111 3HB LYS 111 -3.521 0.428 -10.585 706 HG2 LYS 111 2HG LYS 111 -1.796 -1.308 -10.336 707 HG3 LYS 111 3HG LYS 111 -2.635 -0.908 -8.818 708 HD2 LYS 111 2HD LYS 111 -3.970 -2.984 -8.979 709 HD3 LYS 111 3HD LYS 111 -3.286 -3.310 -10.570 710 HE2 LYS 111 2HE LYS 111 -2.232 -4.705 -8.951 711 HE3 LYS 111 3HE LYS 111 -1.055 -3.523 -9.577 712 HZ1 LYS 111 HZ1 LYS 111 -1.384 -2.253 -7.516 713 HZ2 LYS 111 HZ2 LYS 111 -0.906 -3.772 -7.161 714 HZ3 LYS 111 HZ3 LYS 111 -2.467 -3.351 -6.962 715 H LEU 112 H LEU 112 -6.182 0.329 -12.017 716 HA LEU 112 HA LEU 112 -6.679 2.942 -10.992 717 HB2 LEU 112 2HB LEU 112 -7.685 3.376 -13.243 718 HB3 LEU 112 3HB LEU 112 -6.116 2.663 -13.240 719 HG LEU 112 HG LEU 112 -7.071 0.515 -13.612 720 HD11 LEU 112 1HD1 LEU 112 -9.296 0.496 -12.997 721 HD12 LEU 112 2HD1 LEU 112 -9.285 0.260 -14.733 722 HD13 LEU 112 3HD1 LEU 112 -9.703 1.845 -14.064 723 HD21 LEU 112 1HD2 LEU 112 -7.501 2.486 -15.818 724 HD22 LEU 112 2HD2 LEU 112 -7.314 0.715 -16.018 725 HD23 LEU 112 3HD2 LEU 112 -5.989 1.662 -15.392 726 H LYS 113 H LYS 113 -8.714 0.120 -10.789 727 HA LYS 113 HA LYS 113 -11.190 1.521 -10.512 728 HB2 LYS 113 2HB LYS 113 -11.923 -0.606 -9.539 729 HB3 LYS 113 3HB LYS 113 -11.065 -0.841 -11.066 730 HG2 LYS 113 2HG LYS 113 -9.040 -1.572 -9.957 731 HG3 LYS 113 3HG LYS 113 -9.634 -1.080 -8.376 732 HD2 LYS 113 2HD LYS 113 -10.739 -3.371 -10.030 733 HD3 LYS 113 3HD LYS 113 -9.672 -3.457 -8.600 734 HE2 LYS 113 2HE LYS 113 -11.402 -2.168 -7.319 735 HE3 LYS 113 3HE LYS 113 -12.493 -2.314 -8.709 736 HZ1 LYS 113 HZ1 LYS 113 -11.396 -4.623 -7.181 737 HZ2 LYS 113 HZ2 LYS 113 -12.415 -4.739 -8.455 738 HZ3 LYS 113 HZ3 LYS 113 -12.922 -4.058 -7.067 739 H ASN 114 H ASN 114 -8.562 1.009 -8.300 740 HA ASN 114 HA ASN 114 -10.089 2.313 -6.099 741 HB2 ASN 114 2HB ASN 114 -7.906 0.233 -5.865 742 HB3 ASN 114 3HB ASN 114 -8.718 1.059 -4.521 743 HD21 ASN 114 1HD2 ASN 114 -11.384 0.928 -5.132 744 HD22 ASN 114 2HD2 ASN 114 -11.878 -0.749 -5.289 745 H ILE 115 H ILE 115 -9.369 4.385 -6.837 746 HA ILE 115 HA ILE 115 -6.472 4.974 -6.432 747 HB ILE 115 HB ILE 115 -6.779 7.029 -7.654 748 HG12 ILE 115 2HG1 ILE 115 -9.240 7.281 -7.268 749 HG13 ILE 115 3HG1 ILE 115 -8.648 7.673 -8.836 750 HG21 ILE 115 1HG2 ILE 115 -5.819 5.131 -8.780 751 HG22 ILE 115 2HG2 ILE 115 -7.411 4.488 -9.192 752 HG23 ILE 115 3HG2 ILE 115 -6.849 6.011 -9.924 753 HD11 ILE 115 1HD1 ILE 115 -10.177 5.150 -8.150 754 HD12 ILE 115 2HD1 ILE 115 -10.711 6.549 -9.111 755 HD13 ILE 115 3HD1 ILE 115 -9.443 5.494 -9.720 756 H ASN 116 H ASN 116 -5.850 6.798 -5.259 757 HA ASN 116 HA ASN 116 -7.979 8.089 -3.627 758 HB2 ASN 116 2HB ASN 116 -5.057 8.679 -3.288 759 HB3 ASN 116 3HB ASN 116 -6.431 8.951 -2.201 760 HD21 ASN 116 1HD2 ASN 116 -7.493 6.158 -2.286 761 HD22 ASN 116 2HD2 ASN 116 -6.300 5.232 -1.407 762 H LEU 117 H LEU 117 -8.554 10.111 -4.055 763 HA LEU 117 HA LEU 117 -6.936 11.850 -5.908 764 HB2 LEU 117 2HB LEU 117 -9.679 12.375 -4.684 765 HB3 LEU 117 3HB LEU 117 -8.789 13.449 -5.759 766 HG LEU 117 HG LEU 117 -9.886 10.680 -6.493 767 HD11 LEU 117 1HD1 LEU 117 -11.514 11.924 -7.865 768 HD12 LEU 117 2HD1 LEU 117 -10.835 13.467 -7.291 769 HD13 LEU 117 3HD1 LEU 117 -11.648 12.364 -6.149 770 HD21 LEU 117 1HD2 LEU 117 -9.343 11.360 -8.851 771 HD22 LEU 117 2HD2 LEU 117 -7.907 11.115 -7.849 772 HD23 LEU 117 3HD2 LEU 117 -8.466 12.766 -8.181 773 H THR 118 H THR 118 -5.440 13.018 -4.841 774 HA THR 118 HA THR 118 -5.986 13.958 -2.079 775 HB THR 118 HB THR 118 -3.403 12.649 -2.980 776 HG1 THR 118 HG1 THR 118 -4.049 11.081 -1.471 777 HG21 THR 118 1HG2 THR 118 -4.303 13.913 -0.352 778 HG22 THR 118 2HG2 THR 118 -2.919 14.397 -1.349 779 HG23 THR 118 3HG2 THR 118 -2.881 12.845 -0.500 780 H VAL 119 H VAL 119 -5.580 16.011 -1.824 781 HA VAL 119 HA VAL 119 -3.881 17.540 -3.745 782 HB VAL 119 HB VAL 119 -5.518 19.155 -4.077 783 HG11 VAL 119 1HG1 VAL 119 -5.924 17.077 -5.409 784 HG12 VAL 119 2HG1 VAL 119 -7.133 16.592 -4.188 785 HG13 VAL 119 3HG1 VAL 119 -7.376 18.061 -5.158 786 HG21 VAL 119 1HG2 VAL 119 -7.368 17.847 -2.061 787 HG22 VAL 119 2HG2 VAL 119 -6.484 19.371 -1.794 788 HG23 VAL 119 3HG2 VAL 119 -7.704 19.298 -3.049 789 H ALA 120 H ALA 120 -3.440 19.783 -2.932 790 HA ALA 120 HA ALA 120 -3.504 20.293 -0.061 791 HB1 ALA 120 1HB ALA 120 -1.060 20.087 0.241 792 HB2 ALA 120 2HB ALA 120 -1.769 18.577 -0.268 793 HB3 ALA 120 3HB ALA 120 -0.890 19.569 -1.458 794 HA PRO 121 HA PRO 121 -3.646 24.318 -0.610 795 HB2 PRO 121 2HB PRO 121 -0.886 24.975 0.476 796 HB3 PRO 121 3HB PRO 121 -2.450 25.749 0.883 797 HG2 PRO 121 2HG PRO 121 -1.451 23.876 2.518 798 HG3 PRO 121 3HG PRO 121 -3.182 23.776 2.047 799 HD2 PRO 121 2HD PRO 121 -0.835 22.256 0.908 800 HD3 PRO 121 3HD PRO 121 -2.449 21.649 1.376 801 H GLU 122 H GLU 122 -0.516 23.425 -2.027 802 HA GLU 122 HA GLU 122 -0.786 25.368 -4.210 803 HB2 GLU 122 2HB GLU 122 0.215 26.702 -2.396 804 HB3 GLU 122 3HB GLU 122 1.453 25.482 -2.144 805 HG2 GLU 122 2HG GLU 122 2.383 27.360 -3.341 806 HG3 GLU 122 3HG GLU 122 2.424 25.932 -4.369 Start of MODEL 9 1 H1 ALA 22 H ALA 22 16.612 2.366 -21.150 2 HA ALA 22 HA ALA 22 13.992 2.250 -21.389 3 HB1 ALA 22 1HB ALA 22 15.011 -0.301 -22.736 4 HB2 ALA 22 2HB ALA 22 13.380 -0.118 -22.072 5 HB3 ALA 22 3HB ALA 22 13.883 0.899 -23.414 6 H ALA 23 H ALA 23 13.028 0.974 -19.637 7 HA ALA 23 HA ALA 23 14.950 -0.233 -17.726 8 HB1 ALA 23 1HB ALA 23 15.320 2.222 -17.637 9 HB2 ALA 23 2HB ALA 23 13.604 2.473 -17.234 10 HB3 ALA 23 3HB ALA 23 14.654 1.585 -16.116 11 H ARG 24 H ARG 24 11.813 1.421 -17.315 12 HA ARG 24 HA ARG 24 9.793 0.796 -16.673 13 HB2 ARG 24 2HB ARG 24 10.506 -2.109 -17.217 14 HB3 ARG 24 3HB ARG 24 8.895 -1.434 -17.011 15 HG2 ARG 24 2HG ARG 24 9.168 -0.040 -19.031 16 HG3 ARG 24 3HG ARG 24 10.810 -0.668 -19.248 17 HD2 ARG 24 2HD ARG 24 9.614 -1.928 -20.748 18 HD3 ARG 24 3HD ARG 24 9.698 -3.012 -19.355 19 HE ARG 24 HE ARG 24 7.351 -1.579 -20.471 20 HH11 ARG 24 1HH1 ARG 24 8.428 -3.776 -17.910 21 HH12 ARG 24 2HH1 ARG 24 6.800 -4.130 -17.420 22 HH21 ARG 24 1HH2 ARG 24 5.330 -2.047 -19.803 23 HH22 ARG 24 2HH2 ARG 24 5.045 -3.203 -18.516 24 H GLN 25 H GLN 25 12.181 0.704 -14.732 25 HA GLN 25 HA GLN 25 11.176 -1.165 -12.634 26 HB2 GLN 25 2HB GLN 25 13.733 0.448 -12.599 27 HB3 GLN 25 3HB GLN 25 13.306 -0.893 -11.563 28 HG2 GLN 25 2HG GLN 25 13.904 -1.022 -14.537 29 HG3 GLN 25 3HG GLN 25 14.944 -1.589 -13.244 30 HE21 GLN 25 1HE2 GLN 25 12.689 -2.631 -15.535 31 HE22 GLN 25 2HE2 GLN 25 12.258 -4.149 -14.752 32 H GLN 26 H GLN 26 11.243 2.158 -13.357 33 HA GLN 26 HA GLN 26 10.472 3.030 -10.591 34 HB2 GLN 26 2HB GLN 26 11.968 4.877 -10.804 35 HB3 GLN 26 3HB GLN 26 12.853 3.366 -10.961 36 HG2 GLN 26 2HG GLN 26 12.020 5.181 -13.263 37 HG3 GLN 26 3HG GLN 26 13.605 5.159 -12.525 38 HE21 GLN 26 1HE2 GLN 26 14.882 3.045 -12.664 39 HE22 GLN 26 2HE2 GLN 26 14.645 2.118 -14.124 40 H PHE 27 H PHE 27 10.116 3.495 -14.063 41 HA PHE 27 HA PHE 27 8.888 5.997 -14.095 42 HB2 PHE 27 2HB PHE 27 8.872 5.668 -16.310 43 HB3 PHE 27 3HB PHE 27 9.876 4.267 -15.933 44 HD1 PHE 27 HD1 PHE 27 6.897 5.404 -17.511 45 HD2 PHE 27 HD2 PHE 27 8.585 2.034 -15.441 46 HE1 PHE 27 HE1 PHE 27 5.206 3.892 -18.584 47 HE2 PHE 27 HE2 PHE 27 6.915 0.529 -16.504 48 HZ PHE 27 HZ PHE 27 5.240 1.454 -18.097 49 H VAL 28 H VAL 28 7.523 3.291 -12.728 50 HA VAL 28 HA VAL 28 4.766 3.425 -13.382 51 HB VAL 28 HB VAL 28 4.386 2.517 -11.056 52 HG11 VAL 28 1HG1 VAL 28 6.389 1.050 -12.842 53 HG12 VAL 28 2HG1 VAL 28 5.316 0.307 -11.629 54 HG13 VAL 28 3HG1 VAL 28 4.629 1.093 -13.058 55 HG21 VAL 28 1HG2 VAL 28 7.426 2.381 -10.893 56 HG22 VAL 28 2HG2 VAL 28 6.394 3.452 -9.923 57 HG23 VAL 28 3HG2 VAL 28 6.265 1.691 -9.755 58 H THR 29 H THR 29 6.664 5.508 -11.255 59 HA THR 29 HA THR 29 4.519 6.921 -10.035 60 HB THR 29 HB THR 29 6.885 7.064 -9.389 61 HG1 THR 29 HG1 THR 29 6.712 9.248 -8.836 62 HG21 THR 29 1HG2 THR 29 7.923 7.402 -11.640 63 HG22 THR 29 2HG2 THR 29 8.410 8.623 -10.467 64 HG23 THR 29 3HG2 THR 29 7.199 9.034 -11.703 65 H SER 30 H SER 30 5.912 7.284 -13.304 66 HA SER 30 HA SER 30 4.185 9.545 -13.938 67 HB2 SER 30 2HB SER 30 5.852 7.751 -15.758 68 HB3 SER 30 3HB SER 30 5.090 9.285 -16.218 69 HG SER 30 HG SER 30 7.307 9.573 -15.681 70 H GLU 31 H GLU 31 3.928 6.028 -14.293 71 HA GLU 31 HA GLU 31 1.468 6.121 -15.829 72 HB2 GLU 31 2HB GLU 31 2.538 4.050 -13.875 73 HB3 GLU 31 3HB GLU 31 1.034 3.856 -14.757 74 HG2 GLU 31 2HG GLU 31 3.559 4.475 -16.292 75 HG3 GLU 31 3HG GLU 31 3.294 2.848 -15.677 76 H VAL 32 H VAL 32 2.194 6.399 -12.297 77 HA VAL 32 HA VAL 32 -0.604 6.424 -11.494 78 HB VAL 32 HB VAL 32 1.924 7.397 -10.131 79 HG11 VAL 32 1HG1 VAL 32 -0.901 7.380 -8.963 80 HG12 VAL 32 2HG1 VAL 32 0.603 7.572 -8.030 81 HG13 VAL 32 3HG1 VAL 32 0.144 8.801 -9.198 82 HG21 VAL 32 1HG2 VAL 32 0.039 5.071 -9.543 83 HG22 VAL 32 2HG2 VAL 32 1.592 4.926 -10.381 84 HG23 VAL 32 3HG2 VAL 32 1.559 5.460 -8.697 85 H GLY 33 H GLY 33 1.544 8.788 -12.824 86 HA2 GLY 33 HA2 GLY 33 -0.063 11.171 -12.405 87 HA3 GLY 33 HA3 GLY 33 1.290 10.957 -13.549 88 H ARG 34 H ARG 34 -0.443 8.465 -14.571 89 HA ARG 34 HA ARG 34 -2.421 10.018 -16.206 90 HB2 ARG 34 2HB ARG 34 -1.214 7.246 -16.597 91 HB3 ARG 34 3HB ARG 34 -2.437 8.016 -17.623 92 HG2 ARG 34 2HG ARG 34 -0.874 9.855 -18.128 93 HG3 ARG 34 3HG ARG 34 0.373 9.110 -17.116 94 HD2 ARG 34 2HD ARG 34 -0.873 7.500 -19.339 95 HD3 ARG 34 3HD ARG 34 0.272 8.754 -19.766 96 HE ARG 34 HE ARG 34 0.855 6.204 -18.391 97 HH11 ARG 34 1HH1 ARG 34 2.266 9.408 -19.139 98 HH12 ARG 34 2HH1 ARG 34 3.870 8.717 -19.130 99 HH21 ARG 34 1HH2 ARG 34 2.831 5.532 -18.334 100 HH22 ARG 34 2HH2 ARG 34 4.211 6.596 -18.678 101 H TYR 35 H TYR 35 -2.071 6.912 -14.545 102 HA TYR 35 HA TYR 35 -4.588 5.818 -14.767 103 HB2 TYR 35 2HB TYR 35 -2.394 5.633 -12.680 104 HB3 TYR 35 3HB TYR 35 -3.920 4.857 -12.374 105 HD1 TYR 35 HD1 TYR 35 -1.773 5.113 -15.502 106 HD2 TYR 35 HD2 TYR 35 -3.806 2.614 -12.636 107 HE1 TYR 35 HE1 TYR 35 -1.147 3.120 -16.813 108 HE2 TYR 35 HE2 TYR 35 -3.334 0.641 -14.011 109 HH TYR 35 HH TYR 35 -1.231 0.833 -16.966 110 H GLY 36 H GLY 36 -3.601 7.890 -12.062 111 HA2 GLY 36 HA2 GLY 36 -6.324 8.098 -10.971 112 HA3 GLY 36 HA3 GLY 36 -4.862 8.882 -10.365 113 H ALA 37 H ALA 37 -4.510 9.844 -13.390 114 HA ALA 37 HA ALA 37 -5.731 12.408 -12.901 115 HB1 ALA 37 1HB ALA 37 -4.590 13.109 -14.923 116 HB2 ALA 37 2HB ALA 37 -3.489 12.233 -13.847 117 HB3 ALA 37 3HB ALA 37 -4.146 11.438 -15.293 118 H ILE 38 H ILE 38 -6.432 9.573 -14.937 119 HA ILE 38 HA ILE 38 -8.369 10.800 -16.633 120 HB ILE 38 HB ILE 38 -9.068 8.574 -17.206 121 HG12 ILE 38 2HG1 ILE 38 -7.936 7.768 -14.517 122 HG13 ILE 38 3HG1 ILE 38 -9.585 7.602 -15.087 123 HG21 ILE 38 1HG2 ILE 38 -6.620 9.304 -17.723 124 HG22 ILE 38 2HG2 ILE 38 -6.153 8.102 -16.493 125 HG23 ILE 38 3HG2 ILE 38 -7.039 7.602 -17.926 126 HD11 ILE 38 1HD1 ILE 38 -7.228 5.972 -16.108 127 HD12 ILE 38 2HD1 ILE 38 -8.474 5.446 -14.982 128 HD13 ILE 38 3HD1 ILE 38 -8.937 5.845 -16.637 129 H TYR 39 H TYR 39 -8.586 9.768 -13.365 130 HA TYR 39 HA TYR 39 -11.507 10.045 -13.193 131 HB2 TYR 39 2HB TYR 39 -9.446 9.702 -10.974 132 HB3 TYR 39 3HB TYR 39 -11.183 9.585 -10.806 133 HD1 TYR 39 HD1 TYR 39 -12.437 7.722 -11.798 134 HD2 TYR 39 HD2 TYR 39 -8.161 7.786 -11.853 135 HE1 TYR 39 HE1 TYR 39 -12.402 5.391 -12.669 136 HE2 TYR 39 HE2 TYR 39 -8.093 5.349 -12.557 137 HH TYR 39 HH TYR 39 -11.173 3.654 -13.349 138 H THR 40 H THR 40 -8.661 11.766 -11.801 139 HA THR 40 HA THR 40 -10.169 13.793 -10.507 140 HB THR 40 HB THR 40 -7.726 13.017 -10.187 141 HG1 THR 40 HG1 THR 40 -7.321 15.086 -9.240 142 HG21 THR 40 1HG2 THR 40 -5.995 14.173 -11.249 143 HG22 THR 40 2HG2 THR 40 -7.080 15.451 -11.874 144 HG23 THR 40 3HG2 THR 40 -7.105 13.826 -12.574 145 H GLN 41 H GLN 41 -8.893 13.691 -13.829 146 HA GLN 41 HA GLN 41 -9.489 16.469 -14.439 147 HB2 GLN 41 2HB GLN 41 -8.922 13.987 -16.120 148 HB3 GLN 41 3HB GLN 41 -9.207 15.583 -16.826 149 HG2 GLN 41 2HG GLN 41 -6.954 14.856 -14.895 150 HG3 GLN 41 3HG GLN 41 -6.790 15.116 -16.632 151 HE21 GLN 41 1HE2 GLN 41 -5.324 16.541 -14.535 152 HE22 GLN 41 2HE2 GLN 41 -5.809 18.215 -14.672 153 H LEU 42 H LEU 42 -11.269 13.377 -14.883 154 HA LEU 42 HA LEU 42 -13.447 14.651 -16.297 155 HB2 LEU 42 2HB LEU 42 -12.853 12.184 -16.341 156 HB3 LEU 42 3HB LEU 42 -13.485 12.114 -14.689 157 HG LEU 42 HG LEU 42 -15.729 12.781 -15.513 158 HD11 LEU 42 1HD1 LEU 42 -16.198 12.773 -17.978 159 HD12 LEU 42 2HD1 LEU 42 -14.459 12.728 -18.292 160 HD13 LEU 42 3HD1 LEU 42 -15.191 14.128 -17.488 161 HD21 LEU 42 1HD2 LEU 42 -14.510 10.428 -16.973 162 HD22 LEU 42 2HD2 LEU 42 -16.257 10.724 -16.785 163 HD23 LEU 42 3HD2 LEU 42 -15.271 10.414 -15.364 164 H ILE 43 H ILE 43 -12.714 14.212 -12.892 165 HA ILE 43 HA ILE 43 -15.310 15.107 -11.921 166 HB ILE 43 HB ILE 43 -12.605 14.481 -10.712 167 HG12 ILE 43 2HG1 ILE 43 -14.111 13.148 -9.207 168 HG13 ILE 43 3HG1 ILE 43 -15.506 13.752 -10.141 169 HG21 ILE 43 1HG2 ILE 43 -14.836 15.963 -9.245 170 HG22 ILE 43 2HG2 ILE 43 -13.387 15.207 -8.513 171 HG23 ILE 43 3HG2 ILE 43 -13.196 16.598 -9.550 172 HD11 ILE 43 1HD1 ILE 43 -13.306 11.882 -11.062 173 HD12 ILE 43 2HD1 ILE 43 -15.024 11.525 -10.816 174 HD13 ILE 43 3HD1 ILE 43 -14.545 12.583 -12.157 175 H ARG 44 H ARG 44 -12.107 16.711 -12.149 176 HA ARG 44 HA ARG 44 -13.130 19.183 -11.141 177 HB2 ARG 44 2HB ARG 44 -10.993 20.084 -11.489 178 HB3 ARG 44 3HB ARG 44 -10.750 18.385 -11.112 179 HG2 ARG 44 2HG ARG 44 -9.294 18.478 -12.844 180 HG3 ARG 44 3HG ARG 44 -10.767 18.147 -13.766 181 HD2 ARG 44 2HD ARG 44 -9.783 19.931 -14.921 182 HD3 ARG 44 3HD ARG 44 -11.041 20.690 -13.935 183 HE ARG 44 HE ARG 44 -8.312 20.542 -12.796 184 HH11 ARG 44 1HH1 ARG 44 -10.621 22.715 -14.439 185 HH12 ARG 44 2HH1 ARG 44 -9.675 24.118 -13.950 186 HH21 ARG 44 1HH2 ARG 44 -7.200 22.471 -12.327 187 HH22 ARG 44 2HH2 ARG 44 -7.928 23.986 -12.866 188 H GLN 45 H GLN 45 -13.162 17.800 -14.350 189 HA GLN 45 HA GLN 45 -13.705 20.331 -15.678 190 HB2 GLN 45 2HB GLN 45 -13.969 19.165 -17.649 191 HB3 GLN 45 3HB GLN 45 -12.713 18.329 -16.712 192 HG2 GLN 45 2HG GLN 45 -13.977 16.662 -17.771 193 HG3 GLN 45 3HG GLN 45 -14.301 16.651 -16.051 194 HE21 GLN 45 1HE2 GLN 45 -16.385 16.093 -15.660 195 HE22 GLN 45 2HE2 GLN 45 -17.769 16.695 -16.576 196 H ASN 46 H ASN 46 -15.721 18.425 -13.551 197 HA ASN 46 HA ASN 46 -18.208 19.584 -14.674 198 HB2 ASN 46 2HB ASN 46 -17.609 18.177 -12.042 199 HB3 ASN 46 3HB ASN 46 -19.198 18.709 -12.574 200 HD21 ASN 46 1HD2 ASN 46 -16.992 16.160 -12.575 201 HD22 ASN 46 2HD2 ASN 46 -17.939 15.113 -13.623 202 H LEU 47 H LEU 47 -15.845 20.237 -12.107 203 HA LEU 47 HA LEU 47 -17.164 22.797 -11.430 204 HB2 LEU 47 2HB LEU 47 -16.182 21.740 -9.014 205 HB3 LEU 47 3HB LEU 47 -17.821 22.134 -9.480 206 HG LEU 47 HG LEU 47 -17.848 19.671 -10.415 207 HD11 LEU 47 1HD1 LEU 47 -16.347 18.132 -9.166 208 HD12 LEU 47 2HD1 LEU 47 -15.613 19.503 -8.324 209 HD13 LEU 47 3HD1 LEU 47 -15.368 19.300 -10.072 210 HD21 LEU 47 1HD2 LEU 47 -17.881 20.258 -7.465 211 HD22 LEU 47 2HD2 LEU 47 -18.585 18.830 -8.265 212 HD23 LEU 47 3HD2 LEU 47 -19.235 20.440 -8.592 213 H LEU 48 H LEU 48 -15.589 23.711 -12.756 214 HA LEU 48 HA LEU 48 -12.765 23.564 -12.140 215 HB2 LEU 48 2HB LEU 48 -12.658 25.445 -13.871 216 HB3 LEU 48 3HB LEU 48 -13.181 23.844 -14.364 217 HG LEU 48 HG LEU 48 -15.494 24.534 -14.505 218 HD11 LEU 48 1HD1 LEU 48 -14.597 27.344 -13.724 219 HD12 LEU 48 2HD1 LEU 48 -15.645 26.271 -12.762 220 HD13 LEU 48 3HD1 LEU 48 -16.208 26.875 -14.320 221 HD21 LEU 48 1HD2 LEU 48 -13.616 26.455 -15.930 222 HD22 LEU 48 2HD2 LEU 48 -15.272 26.038 -16.436 223 HD23 LEU 48 3HD2 LEU 48 -13.998 24.800 -16.445 224 H VAL 49 H VAL 49 -13.678 24.042 -9.781 225 HA VAL 49 HA VAL 49 -14.127 26.801 -9.104 226 HB VAL 49 HB VAL 49 -13.416 24.512 -7.257 227 HG11 VAL 49 1HG1 VAL 49 -14.591 27.265 -6.639 228 HG12 VAL 49 2HG1 VAL 49 -14.513 25.908 -5.497 229 HG13 VAL 49 3HG1 VAL 49 -13.015 26.615 -6.116 230 HG21 VAL 49 1HG2 VAL 49 -15.872 24.443 -6.803 231 HG22 VAL 49 2HG2 VAL 49 -16.131 25.673 -8.051 232 HG23 VAL 49 3HG2 VAL 49 -15.516 24.053 -8.484 233 H GLU 50 H GLU 50 -11.356 24.697 -8.338 234 HA GLU 50 HA GLU 50 -9.131 24.935 -8.412 235 HB2 GLU 50 2HB GLU 50 -9.596 27.606 -9.777 236 HB3 GLU 50 3HB GLU 50 -8.095 26.694 -9.713 237 HG2 GLU 50 2HG GLU 50 -9.203 24.787 -10.874 238 HG3 GLU 50 3HG GLU 50 -10.653 25.782 -11.066 239 H ASP 51 H ASP 51 -10.443 28.132 -7.463 240 HA ASP 51 HA ASP 51 -8.101 28.806 -5.891 241 HB2 ASP 51 2HB ASP 51 -9.428 30.440 -7.195 242 HB3 ASP 51 3HB ASP 51 -10.821 30.140 -6.150 243 H SER 52 H SER 52 -11.372 27.627 -5.100 244 HA SER 52 HA SER 52 -10.889 27.701 -2.187 245 HB2 SER 52 2HB SER 52 -13.119 26.297 -3.686 246 HB3 SER 52 3HB SER 52 -13.085 26.738 -1.980 247 HG SER 52 HG SER 52 -13.113 28.965 -2.630 248 H PHE 53 H PHE 53 -10.009 25.543 -4.722 249 HA PHE 53 HA PHE 53 -10.089 23.116 -3.060 250 HB2 PHE 53 2HB PHE 53 -9.395 23.669 -5.969 251 HB3 PHE 53 3HB PHE 53 -9.270 22.089 -5.215 252 HD1 PHE 53 HD1 PHE 53 -10.762 22.213 -7.579 253 HD2 PHE 53 HD2 PHE 53 -12.135 23.148 -3.593 254 HE1 PHE 53 HE1 PHE 53 -13.057 21.468 -8.171 255 HE2 PHE 53 HE2 PHE 53 -14.400 22.451 -4.200 256 HZ PHE 53 HZ PHE 53 -14.884 21.580 -6.497 257 H ARG 54 H ARG 54 -8.005 25.666 -3.484 258 HA ARG 54 HA ARG 54 -5.543 24.071 -2.993 259 HB2 ARG 54 2HB ARG 54 -4.301 25.752 -4.093 260 HB3 ARG 54 3HB ARG 54 -5.697 25.312 -5.092 261 HG2 ARG 54 2HG ARG 54 -6.875 27.351 -4.418 262 HG3 ARG 54 3HG ARG 54 -5.556 27.801 -3.331 263 HD2 ARG 54 2HD ARG 54 -5.319 29.035 -5.422 264 HD3 ARG 54 3HD ARG 54 -4.005 27.844 -5.271 265 HE ARG 54 HE ARG 54 -6.342 26.824 -6.661 266 HH11 ARG 54 1HH1 ARG 54 -3.210 28.454 -7.165 267 HH12 ARG 54 2HH1 ARG 54 -3.202 28.066 -8.864 268 HH21 ARG 54 1HH2 ARG 54 -6.180 26.273 -8.804 269 HH22 ARG 54 2HH2 ARG 54 -4.847 26.819 -9.778 270 H GLY 55 H GLY 55 -3.821 25.344 -1.801 271 HA2 GLY 55 HA2 GLY 55 -3.020 26.603 0.008 272 HA3 GLY 55 HA3 GLY 55 -4.659 27.243 0.301 273 H LYS 56 H LYS 56 -6.109 24.951 0.606 274 HA LYS 56 HA LYS 56 -5.131 23.653 3.083 275 HB2 LYS 56 2HB LYS 56 -7.422 22.725 3.172 276 HB3 LYS 56 3HB LYS 56 -7.334 24.470 3.231 277 HG2 LYS 56 2HG LYS 56 -9.242 23.707 1.920 278 HG3 LYS 56 3HG LYS 56 -8.150 24.686 0.952 279 HD2 LYS 56 2HD LYS 56 -7.381 22.834 -0.294 280 HD3 LYS 56 3HD LYS 56 -7.938 21.661 0.940 281 HE2 LYS 56 2HE LYS 56 -10.258 22.134 0.386 282 HE3 LYS 56 3HE LYS 56 -9.730 23.282 -0.866 283 HZ1 LYS 56 HZ1 LYS 56 -10.149 21.077 -1.800 284 HZ2 LYS 56 HZ2 LYS 56 -9.072 20.381 -0.784 285 HZ3 LYS 56 HZ3 LYS 56 -8.549 21.427 -1.936 286 H GLN 57 H GLN 57 -6.113 21.140 2.933 287 HA GLN 57 HA GLN 57 -5.355 19.927 0.328 288 HB2 GLN 57 2HB GLN 57 -3.775 18.508 1.244 289 HB3 GLN 57 3HB GLN 57 -3.531 19.874 2.255 290 HG2 GLN 57 2HG GLN 57 -3.702 18.430 3.942 291 HG3 GLN 57 3HG GLN 57 -5.436 18.589 3.721 292 HE21 GLN 57 1HE2 GLN 57 -4.382 16.752 1.055 293 HE22 GLN 57 2HE2 GLN 57 -4.756 15.208 1.818 294 H CYS 58 H CYS 58 -6.275 17.749 0.029 295 HA CYS 58 HA CYS 58 -8.283 16.815 1.917 296 HB2 CYS 58 2HB CYS 58 -9.621 18.427 0.624 297 HB3 CYS 58 3HB CYS 58 -9.001 17.743 -0.900 298 HG CYS 58 HG CYS 58 -10.647 15.981 1.377 299 H ARG 59 H ARG 59 -8.657 14.642 1.726 300 HA ARG 59 HA ARG 59 -7.499 13.168 -0.549 301 HB2 ARG 59 2HB ARG 59 -6.603 11.450 0.864 302 HB3 ARG 59 3HB ARG 59 -5.806 12.979 1.164 303 HG2 ARG 59 2HG ARG 59 -8.022 12.389 3.054 304 HG3 ARG 59 3HG ARG 59 -6.733 11.198 3.045 305 HD2 ARG 59 2HD ARG 59 -5.152 13.209 3.417 306 HD3 ARG 59 3HD ARG 59 -6.641 14.132 3.736 307 HE ARG 59 HE ARG 59 -6.619 11.673 5.211 308 HH11 ARG 59 1HH1 ARG 59 -5.119 14.871 5.365 309 HH12 ARG 59 2HH1 ARG 59 -4.878 14.750 7.090 310 HH21 ARG 59 1HH2 ARG 59 -6.286 11.607 7.422 311 HH22 ARG 59 2HH2 ARG 59 -5.526 12.944 8.223 312 H VAL 60 H VAL 60 -8.926 11.829 -1.426 313 HA VAL 60 HA VAL 60 -10.900 10.429 0.287 314 HB VAL 60 HB VAL 60 -12.782 10.855 -1.171 315 HG11 VAL 60 1HG1 VAL 60 -13.275 13.174 -0.680 316 HG12 VAL 60 2HG1 VAL 60 -12.369 12.510 0.692 317 HG13 VAL 60 3HG1 VAL 60 -11.559 13.558 -0.478 318 HG21 VAL 60 1HG2 VAL 60 -11.026 12.748 -2.784 319 HG22 VAL 60 2HG2 VAL 60 -11.625 11.165 -3.345 320 HG23 VAL 60 3HG2 VAL 60 -12.766 12.469 -3.000 321 H ASN 61 H ASN 61 -11.969 8.644 -1.131 322 HA ASN 61 HA ASN 61 -10.048 7.659 -3.153 323 HB2 ASN 61 2HB ASN 61 -9.386 6.704 -1.041 324 HB3 ASN 61 3HB ASN 61 -11.034 6.270 -0.635 325 HD21 ASN 61 1HD2 ASN 61 -12.106 4.597 -2.016 326 HD22 ASN 61 2HD2 ASN 61 -11.083 3.395 -2.799 327 H LEU 62 H LEU 62 -10.870 6.663 -4.880 328 HA LEU 62 HA LEU 62 -13.852 6.205 -4.982 329 HB2 LEU 62 2HB LEU 62 -11.764 6.722 -7.116 330 HB3 LEU 62 3HB LEU 62 -13.348 6.113 -7.488 331 HG LEU 62 HG LEU 62 -12.495 8.827 -6.485 332 HD11 LEU 62 1HD1 LEU 62 -12.522 8.365 -8.877 333 HD12 LEU 62 2HD1 LEU 62 -13.686 9.620 -8.441 334 HD13 LEU 62 3HD1 LEU 62 -14.245 7.970 -8.803 335 HD21 LEU 62 1HD2 LEU 62 -15.335 7.793 -6.278 336 HD22 LEU 62 2HD2 LEU 62 -14.857 9.513 -6.205 337 HD23 LEU 62 3HD2 LEU 62 -14.286 8.396 -4.980 338 H LYS 63 H LYS 63 -14.678 4.338 -5.352 339 HA LYS 63 HA LYS 63 -12.954 2.028 -6.171 340 HB2 LYS 63 2HB LYS 63 -15.479 1.987 -4.474 341 HB3 LYS 63 3HB LYS 63 -14.489 0.599 -4.910 342 HG2 LYS 63 2HG LYS 63 -12.590 1.533 -3.582 343 HG3 LYS 63 3HG LYS 63 -13.585 2.948 -3.165 344 HD2 LYS 63 2HD LYS 63 -15.252 1.427 -2.086 345 HD3 LYS 63 3HD LYS 63 -14.149 0.061 -2.385 346 HE2 LYS 63 2HE LYS 63 -12.384 1.185 -1.051 347 HE3 LYS 63 3HE LYS 63 -13.442 2.592 -0.812 348 HZ1 LYS 63 HZ1 LYS 63 -14.978 1.150 0.397 349 HZ2 LYS 63 HZ2 LYS 63 -13.510 1.138 1.106 350 HZ3 LYS 63 HZ3 LYS 63 -13.987 -0.135 0.210 351 H LEU 64 H LEU 64 -13.321 1.891 -8.411 352 HA LEU 64 HA LEU 64 -16.087 2.317 -9.391 353 HB2 LEU 64 2HB LEU 64 -13.519 2.039 -10.971 354 HB3 LEU 64 3HB LEU 64 -15.099 2.516 -11.568 355 HG LEU 64 HG LEU 64 -14.031 4.459 -11.572 356 HD11 LEU 64 1HD1 LEU 64 -14.791 5.969 -9.825 357 HD12 LEU 64 2HD1 LEU 64 -15.220 4.590 -8.787 358 HD13 LEU 64 3HD1 LEU 64 -16.034 4.839 -10.357 359 HD21 LEU 64 1HD2 LEU 64 -12.671 3.962 -8.921 360 HD22 LEU 64 2HD2 LEU 64 -12.467 5.349 -10.004 361 HD23 LEU 64 3HD2 LEU 64 -11.959 3.750 -10.555 362 H ILE 65 H ILE 65 -16.928 0.982 -10.999 363 HA ILE 65 HA ILE 65 -16.129 -1.911 -10.927 364 HB ILE 65 HB ILE 65 -18.425 -2.249 -11.979 365 HG12 ILE 65 2HG1 ILE 65 -19.150 0.413 -10.690 366 HG13 ILE 65 3HG1 ILE 65 -18.712 0.324 -12.392 367 HG21 ILE 65 1HG2 ILE 65 -17.827 -2.850 -9.637 368 HG22 ILE 65 2HG2 ILE 65 -18.271 -1.224 -9.101 369 HG23 ILE 65 3HG2 ILE 65 -19.508 -2.315 -9.763 370 HD11 ILE 65 1HD1 ILE 65 -21.096 0.268 -12.177 371 HD12 ILE 65 2HD1 ILE 65 -20.508 -1.272 -12.829 372 HD13 ILE 65 3HD1 ILE 65 -21.020 -1.167 -11.124 373 HA PRO 66 HA PRO 66 -14.881 -1.242 -15.235 374 HB2 PRO 66 2HB PRO 66 -15.367 -4.205 -15.496 375 HB3 PRO 66 3HB PRO 66 -13.946 -3.232 -16.002 376 HG2 PRO 66 2HG PRO 66 -13.861 -4.778 -13.769 377 HG3 PRO 66 3HG PRO 66 -13.126 -3.136 -13.763 378 HD2 PRO 66 2HD PRO 66 -15.864 -4.005 -12.736 379 HD3 PRO 66 3HD PRO 66 -14.621 -2.988 -11.935 380 H THR 67 H THR 67 -16.055 -0.745 -17.030 381 HA THR 67 HA THR 67 -18.559 -2.101 -17.781 382 HB THR 67 HB THR 67 -18.367 0.886 -17.184 383 HG1 THR 67 HG1 THR 67 -18.820 -0.754 -15.525 384 HG21 THR 67 1HG2 THR 67 -20.795 0.951 -17.804 385 HG22 THR 67 2HG2 THR 67 -20.612 -0.664 -18.526 386 HG23 THR 67 3HG2 THR 67 -19.727 0.739 -19.181 387 H GLY 68 H GLY 68 -19.140 -1.435 -20.071 388 HA2 GLY 68 HA2 GLY 68 -16.870 -1.899 -21.692 389 HA3 GLY 68 HA3 GLY 68 -18.493 -1.483 -22.285 390 H THR 69 H THR 69 -18.255 1.201 -20.836 391 HA THR 69 HA THR 69 -16.798 2.683 -22.953 392 HB THR 69 HB THR 69 -18.468 3.912 -20.735 393 HG1 THR 69 HG1 THR 69 -20.255 3.603 -22.105 394 HG21 THR 69 1HG2 THR 69 -19.034 5.540 -22.515 395 HG22 THR 69 2HG2 THR 69 -17.991 4.659 -23.656 396 HG23 THR 69 3HG2 THR 69 -17.287 5.474 -22.251 397 H GLY 70 H GLY 70 -16.304 1.774 -19.671 398 HA2 GLY 70 HA2 GLY 70 -13.775 2.610 -19.124 399 HA3 GLY 70 HA3 GLY 70 -14.721 4.067 -18.814 400 H ALA 71 H ALA 71 -13.700 3.420 -16.461 401 HA ALA 71 HA ALA 71 -15.285 1.371 -15.095 402 HB1 ALA 71 1HB ALA 71 -13.962 1.820 -13.231 403 HB2 ALA 71 2HB ALA 71 -12.858 2.052 -14.573 404 HB3 ALA 71 3HB ALA 71 -13.553 3.470 -13.765 405 H LEU 72 H LEU 72 -16.790 1.898 -13.352 406 HA LEU 72 HA LEU 72 -18.149 4.567 -13.547 407 HB2 LEU 72 2HB LEU 72 -19.116 1.953 -14.343 408 HB3 LEU 72 3HB LEU 72 -19.963 2.384 -12.862 409 HG LEU 72 HG LEU 72 -20.724 4.501 -13.886 410 HD11 LEU 72 1HD1 LEU 72 -19.173 3.472 -16.302 411 HD12 LEU 72 2HD1 LEU 72 -18.998 5.022 -15.444 412 HD13 LEU 72 3HD1 LEU 72 -20.455 4.702 -16.397 413 HD21 LEU 72 1HD2 LEU 72 -22.104 2.455 -14.015 414 HD22 LEU 72 2HD2 LEU 72 -21.312 2.029 -15.552 415 HD23 LEU 72 3HD2 LEU 72 -22.330 3.483 -15.435 416 H LEU 73 H LEU 73 -18.882 5.482 -11.625 417 HA LEU 73 HA LEU 73 -17.701 4.744 -9.217 418 HB2 LEU 73 2HB LEU 73 -18.592 6.962 -9.896 419 HB3 LEU 73 3HB LEU 73 -20.217 6.407 -9.561 420 HG LEU 73 HG LEU 73 -19.030 7.869 -7.827 421 HD11 LEU 73 1HD1 LEU 73 -21.091 6.606 -7.316 422 HD12 LEU 73 2HD1 LEU 73 -20.029 6.803 -5.913 423 HD13 LEU 73 3HD1 LEU 73 -20.113 5.238 -6.742 424 HD21 LEU 73 1HD2 LEU 73 -17.518 6.879 -6.251 425 HD22 LEU 73 2HD2 LEU 73 -16.841 6.642 -7.871 426 HD23 LEU 73 3HD2 LEU 73 -17.627 5.288 -7.025 427 H GLY 74 H GLY 74 -17.807 2.946 -8.222 428 HA2 GLY 74 HA2 GLY 74 -20.363 1.506 -7.715 429 HA3 GLY 74 HA3 GLY 74 -18.699 0.935 -7.399 430 H SER 75 H SER 75 -17.684 3.217 -5.996 431 HA SER 75 HA SER 75 -19.461 4.008 -3.835 432 HB2 SER 75 2HB SER 75 -17.466 1.785 -3.399 433 HB3 SER 75 3HB SER 75 -17.749 2.965 -2.119 434 HG SER 75 HG SER 75 -19.834 1.503 -3.397 435 H LEU 76 H LEU 76 -18.587 5.628 -2.558 436 HA LEU 76 HA LEU 76 -15.858 6.632 -3.195 437 HB2 LEU 76 2HB LEU 76 -17.716 7.922 -4.219 438 HB3 LEU 76 3HB LEU 76 -18.397 8.254 -2.639 439 HG LEU 76 HG LEU 76 -15.518 9.032 -3.261 440 HD11 LEU 76 1HD1 LEU 76 -16.358 11.206 -4.112 441 HD12 LEU 76 2HD1 LEU 76 -18.029 10.563 -4.001 442 HD13 LEU 76 3HD1 LEU 76 -16.878 9.860 -5.145 443 HD21 LEU 76 1HD2 LEU 76 -16.236 9.376 -0.921 444 HD22 LEU 76 2HD2 LEU 76 -17.673 10.250 -1.467 445 HD23 LEU 76 3HD2 LEU 76 -16.043 10.929 -1.718 446 H THR 77 H THR 77 -14.605 6.836 -1.512 447 HA THR 77 HA THR 77 -15.683 6.786 1.304 448 HB THR 77 HB THR 77 -13.035 5.827 0.129 449 HG1 THR 77 HG1 THR 77 -15.192 4.434 1.313 450 HG21 THR 77 1HG2 THR 77 -12.623 6.664 2.376 451 HG22 THR 77 2HG2 THR 77 -12.612 4.897 2.398 452 HG23 THR 77 3HG2 THR 77 -14.033 5.776 3.010 453 H VAL 78 H VAL 78 -15.518 8.784 2.222 454 HA VAL 78 HA VAL 78 -13.393 10.655 1.313 455 HB VAL 78 HB VAL 78 -14.267 12.254 2.965 456 HG11 VAL 78 1HG1 VAL 78 -15.005 12.320 0.605 457 HG12 VAL 78 2HG1 VAL 78 -16.349 11.225 0.991 458 HG13 VAL 78 3HG1 VAL 78 -16.285 12.856 1.687 459 HG21 VAL 78 1HG2 VAL 78 -16.490 11.932 3.978 460 HG22 VAL 78 2HG2 VAL 78 -16.529 10.256 3.386 461 HG23 VAL 78 3HG2 VAL 78 -15.327 10.755 4.599 462 H LEU 79 H LEU 79 -11.511 11.075 2.440 463 HA LEU 79 HA LEU 79 -11.047 9.398 4.891 464 HB2 LEU 79 2HB LEU 79 -9.081 10.426 2.818 465 HB3 LEU 79 3HB LEU 79 -8.671 9.503 4.255 466 HG LEU 79 HG LEU 79 -10.423 8.479 1.979 467 HD11 LEU 79 1HD1 LEU 79 -8.164 8.935 1.175 468 HD12 LEU 79 2HD1 LEU 79 -8.427 7.189 1.284 469 HD13 LEU 79 3HD1 LEU 79 -7.467 8.008 2.528 470 HD21 LEU 79 1HD2 LEU 79 -9.088 7.011 4.303 471 HD22 LEU 79 2HD2 LEU 79 -9.987 6.245 2.973 472 HD23 LEU 79 3HD2 LEU 79 -10.835 7.299 4.115 473 H ASP 80 H ASP 80 -10.317 12.609 3.429 474 HA ASP 80 HA ASP 80 -11.264 13.994 5.689 475 HB2 ASP 80 2HB ASP 80 -8.894 13.215 6.563 476 HB3 ASP 80 3HB ASP 80 -8.288 14.403 5.413 477 H GLY 81 H GLY 81 -10.848 16.397 5.485 478 HA2 GLY 81 HA2 GLY 81 -9.477 17.672 3.456 479 HA3 GLY 81 HA3 GLY 81 -11.056 17.366 2.751 480 H ASP 82 H ASP 82 -10.223 19.836 2.868 481 HA ASP 82 HA ASP 82 -11.992 21.114 4.897 482 HB2 ASP 82 2HB ASP 82 -9.319 21.352 5.100 483 HB3 ASP 82 3HB ASP 82 -9.607 22.628 3.927 484 H SER 83 H SER 83 -12.123 23.600 4.043 485 HA SER 83 HA SER 83 -13.628 24.811 2.926 486 HB2 SER 83 2HB SER 83 -13.221 25.403 0.689 487 HB3 SER 83 3HB SER 83 -11.672 25.173 1.500 488 HG SER 83 HG SER 83 -11.674 24.289 -0.585 489 H ARG 84 H ARG 84 -13.815 22.705 0.168 490 HA ARG 84 HA ARG 84 -16.403 21.521 1.048 491 HB2 ARG 84 2HB ARG 84 -15.998 23.242 -1.450 492 HB3 ARG 84 3HB ARG 84 -17.416 22.240 -1.182 493 HG2 ARG 84 2HG ARG 84 -16.597 24.605 0.551 494 HG3 ARG 84 3HG ARG 84 -17.845 24.596 -0.690 495 HD2 ARG 84 2HD ARG 84 -19.127 22.880 0.537 496 HD3 ARG 84 3HD ARG 84 -17.929 22.896 1.841 497 HE ARG 84 HE ARG 84 -19.970 24.924 1.243 498 HH11 ARG 84 1HH1 ARG 84 -17.023 24.294 3.115 499 HH12 ARG 84 2HH1 ARG 84 -17.373 25.567 4.248 500 HH21 ARG 84 1HH2 ARG 84 -20.345 26.559 2.727 501 HH22 ARG 84 2HH2 ARG 84 -19.206 26.845 4.001 502 H LEU 85 H LEU 85 -13.395 20.809 -0.335 503 HA LEU 85 HA LEU 85 -14.219 19.895 -2.873 504 HB2 LEU 85 2HB LEU 85 -11.972 20.612 -2.484 505 HB3 LEU 85 3HB LEU 85 -11.704 19.321 -1.293 506 HG LEU 85 HG LEU 85 -11.852 17.616 -3.029 507 HD11 LEU 85 1HD1 LEU 85 -11.954 18.190 -5.437 508 HD12 LEU 85 2HD1 LEU 85 -12.192 19.896 -5.036 509 HD13 LEU 85 3HD1 LEU 85 -13.448 18.695 -4.646 510 HD21 LEU 85 1HD2 LEU 85 -9.989 19.850 -3.941 511 HD22 LEU 85 2HD2 LEU 85 -9.812 18.113 -4.258 512 HD23 LEU 85 3HD2 LEU 85 -9.674 18.720 -2.608 513 H CYS 86 H CYS 86 -13.670 17.874 0.077 514 HA CYS 86 HA CYS 86 -14.191 15.373 -1.059 515 HB2 CYS 86 2HB CYS 86 -14.860 14.780 1.293 516 HB3 CYS 86 3HB CYS 86 -13.283 15.559 1.151 517 HG CYS 86 HG CYS 86 -14.488 16.418 3.342 518 H ALA 87 H ALA 87 -16.569 17.847 -0.246 519 HA ALA 87 HA ALA 87 -18.857 16.027 -0.787 520 HB1 ALA 87 1HB ALA 87 -19.029 17.698 1.029 521 HB2 ALA 87 2HB ALA 87 -18.718 19.002 -0.132 522 HB3 ALA 87 3HB ALA 87 -20.204 18.032 -0.260 523 H ALA 88 H ALA 88 -17.178 18.798 -2.335 524 HA ALA 88 HA ALA 88 -18.932 19.095 -4.565 525 HB1 ALA 88 1HB ALA 88 -15.937 19.705 -4.319 526 HB2 ALA 88 2HB ALA 88 -17.071 20.440 -5.467 527 HB3 ALA 88 3HB ALA 88 -17.241 20.755 -3.736 528 H THR 89 H THR 89 -15.792 17.358 -4.422 529 HA THR 89 HA THR 89 -15.904 16.106 -6.962 530 HB THR 89 HB THR 89 -13.952 16.135 -5.407 531 HG1 THR 89 HG1 THR 89 -14.770 13.566 -6.319 532 HG21 THR 89 1HG2 THR 89 -13.612 14.588 -3.672 533 HG22 THR 89 2HG2 THR 89 -15.013 13.595 -4.113 534 HG23 THR 89 3HG2 THR 89 -15.249 15.168 -3.343 535 H LYS 90 H LYS 90 -17.230 15.027 -3.846 536 HA LYS 90 HA LYS 90 -18.150 12.525 -4.723 537 HB2 LYS 90 2HB LYS 90 -17.736 12.945 -2.458 538 HB3 LYS 90 3HB LYS 90 -18.805 14.334 -2.394 539 HG2 LYS 90 2HG LYS 90 -20.084 11.695 -3.010 540 HG3 LYS 90 3HG LYS 90 -19.393 11.887 -1.395 541 HD2 LYS 90 2HD LYS 90 -21.197 14.067 -2.497 542 HD3 LYS 90 3HD LYS 90 -21.916 12.599 -1.846 543 HE2 LYS 90 2HE LYS 90 -19.879 14.266 -0.304 544 HE3 LYS 90 3HE LYS 90 -21.607 14.637 -0.278 545 HZ1 LYS 90 HZ1 LYS 90 -22.029 12.435 0.613 546 HZ2 LYS 90 HZ2 LYS 90 -20.985 13.221 1.588 547 HZ3 LYS 90 HZ3 LYS 90 -20.439 12.054 0.587 548 H ARG 91 H ARG 91 -19.768 15.625 -5.032 549 HA ARG 91 HA ARG 91 -22.203 14.367 -6.102 550 HB2 ARG 91 2HB ARG 91 -21.177 17.224 -6.384 551 HB3 ARG 91 3HB ARG 91 -22.766 16.662 -6.895 552 HG2 ARG 91 2HG ARG 91 -21.723 17.019 -4.079 553 HG3 ARG 91 3HG ARG 91 -23.094 17.797 -4.843 554 HD2 ARG 91 2HD ARG 91 -22.881 14.863 -4.087 555 HD3 ARG 91 3HD ARG 91 -23.734 16.071 -3.156 556 HE ARG 91 HE ARG 91 -24.597 14.814 -5.683 557 HH11 ARG 91 1HH1 ARG 91 -25.340 17.395 -3.364 558 HH12 ARG 91 2HH1 ARG 91 -26.989 17.496 -3.898 559 HH21 ARG 91 1HH2 ARG 91 -26.737 14.988 -6.278 560 HH22 ARG 91 2HH2 ARG 91 -27.764 16.161 -5.510 561 H ALA 92 H ALA 92 -19.281 15.774 -7.569 562 HA ALA 92 HA ALA 92 -20.054 15.485 -10.284 563 HB1 ALA 92 1HB ALA 92 -17.570 15.612 -10.697 564 HB2 ALA 92 2HB ALA 92 -18.251 16.924 -9.722 565 HB3 ALA 92 3HB ALA 92 -17.325 15.607 -8.952 566 H VAL 93 H VAL 93 -18.069 13.237 -8.274 567 HA VAL 93 HA VAL 93 -17.851 11.254 -10.269 568 HB VAL 93 HB VAL 93 -17.934 10.439 -7.369 569 HG11 VAL 93 1HG1 VAL 93 -16.260 8.887 -8.042 570 HG12 VAL 93 2HG1 VAL 93 -17.456 8.837 -9.323 571 HG13 VAL 93 3HG1 VAL 93 -15.955 9.736 -9.570 572 HG21 VAL 93 1HG2 VAL 93 -16.485 12.045 -6.822 573 HG22 VAL 93 2HG2 VAL 93 -15.267 11.180 -7.769 574 HG23 VAL 93 3HG2 VAL 93 -16.150 12.501 -8.501 575 H ALA 94 H ALA 94 -20.535 11.984 -8.221 576 HA ALA 94 HA ALA 94 -21.932 9.417 -8.579 577 HB1 ALA 94 1HB ALA 94 -22.209 10.766 -6.513 578 HB2 ALA 94 2HB ALA 94 -22.940 12.080 -7.468 579 HB3 ALA 94 3HB ALA 94 -23.740 10.511 -7.355 580 H GLN 95 H GLN 95 -21.341 12.077 -10.621 581 HA GLN 95 HA GLN 95 -23.749 11.452 -12.287 582 HB2 GLN 95 2HB GLN 95 -24.160 13.794 -12.642 583 HB3 GLN 95 3HB GLN 95 -24.158 13.415 -10.924 584 HG2 GLN 95 2HG GLN 95 -22.921 15.402 -10.935 585 HG3 GLN 95 3HG GLN 95 -21.720 14.211 -10.902 586 HE21 GLN 95 1HE2 GLN 95 -20.145 14.327 -12.542 587 HE22 GLN 95 2HE2 GLN 95 -20.284 15.436 -13.910 588 H VAL 96 H VAL 96 -20.321 11.860 -12.317 589 HA VAL 96 HA VAL 96 -19.862 12.457 -15.040 590 HB VAL 96 HB VAL 96 -17.788 11.077 -14.808 591 HG11 VAL 96 1HG1 VAL 96 -16.633 12.580 -13.366 592 HG12 VAL 96 2HG1 VAL 96 -17.879 13.499 -14.236 593 HG13 VAL 96 3HG1 VAL 96 -18.103 13.042 -12.536 594 HG21 VAL 96 1HG2 VAL 96 -18.329 9.350 -13.280 595 HG22 VAL 96 2HG2 VAL 96 -17.191 10.449 -12.440 596 HG23 VAL 96 3HG2 VAL 96 -18.912 10.505 -12.068 597 H ASN 97 H ASN 97 -19.533 11.218 -16.906 598 HA ASN 97 HA ASN 97 -21.476 9.152 -17.254 599 HB2 ASN 97 2HB ASN 97 -20.803 9.247 -19.613 600 HB3 ASN 97 3HB ASN 97 -21.095 10.841 -18.939 601 HD21 ASN 97 1HD2 ASN 97 -18.571 8.626 -20.162 602 HD22 ASN 97 2HD2 ASN 97 -17.335 9.868 -20.255 603 H SER 98 H SER 98 -17.917 8.962 -17.195 604 HA SER 98 HA SER 98 -17.503 6.358 -16.344 605 HB2 SER 98 2HB SER 98 -16.854 5.187 -18.494 606 HB3 SER 98 3HB SER 98 -18.592 5.337 -18.239 607 HG SER 98 HG SER 98 -16.955 6.951 -19.928 608 H PHE 99 H PHE 99 -15.340 5.908 -16.112 609 HA PHE 99 HA PHE 99 -13.502 8.107 -16.870 610 HB2 PHE 99 2HB PHE 99 -12.934 5.717 -15.096 611 HB3 PHE 99 3HB PHE 99 -12.080 7.243 -15.166 612 HD1 PHE 99 HD1 PHE 99 -13.292 9.364 -14.348 613 HD2 PHE 99 HD2 PHE 99 -14.848 5.397 -13.722 614 HE1 PHE 99 HE1 PHE 99 -14.847 10.242 -12.637 615 HE2 PHE 99 HE2 PHE 99 -16.421 6.282 -12.022 616 HZ PHE 99 HZ PHE 99 -16.389 8.669 -11.450 617 HA PRO 100 HA PRO 100 -12.199 5.172 -20.058 618 HB2 PRO 100 2HB PRO 100 -10.783 6.819 -21.703 619 HB3 PRO 100 3HB PRO 100 -12.571 6.839 -21.611 620 HG2 PRO 100 2HG PRO 100 -10.605 8.692 -20.228 621 HG3 PRO 100 3HG PRO 100 -12.105 9.121 -21.115 622 HD2 PRO 100 2HD PRO 100 -12.002 8.883 -18.379 623 HD3 PRO 100 3HD PRO 100 -13.456 8.469 -19.332 624 H LEU 101 H LEU 101 -10.619 3.756 -19.664 625 HA LEU 101 HA LEU 101 -8.215 4.570 -18.199 626 HB2 LEU 101 2HB LEU 101 -7.903 2.016 -18.089 627 HB3 LEU 101 3HB LEU 101 -9.094 2.811 -17.076 628 HG LEU 101 HG LEU 101 -10.008 1.631 -19.708 629 HD11 LEU 101 1HD1 LEU 101 -9.460 0.020 -17.177 630 HD12 LEU 101 2HD1 LEU 101 -8.650 -0.160 -18.747 631 HD13 LEU 101 3HD1 LEU 101 -10.363 -0.545 -18.608 632 HD21 LEU 101 1HD2 LEU 101 -12.060 1.132 -18.384 633 HD22 LEU 101 2HD2 LEU 101 -11.658 2.846 -18.274 634 HD23 LEU 101 3HD2 LEU 101 -11.287 1.757 -16.922 635 HA PRO 102 HA PRO 102 -5.736 4.574 -21.785 636 HB2 PRO 102 2HB PRO 102 -3.212 4.688 -20.740 637 HB3 PRO 102 3HB PRO 102 -4.408 6.005 -20.537 638 HG2 PRO 102 2HG PRO 102 -3.718 3.827 -18.556 639 HG3 PRO 102 3HG PRO 102 -3.890 5.585 -18.268 640 HD2 PRO 102 2HD PRO 102 -5.926 3.827 -17.767 641 HD3 PRO 102 3HD PRO 102 -6.207 5.497 -18.352 642 H LYS 103 H LYS 103 -4.532 2.168 -19.378 643 HA LYS 103 HA LYS 103 -3.971 0.219 -21.568 644 HB2 LYS 103 2HB LYS 103 -2.990 0.472 -18.698 645 HB3 LYS 103 3HB LYS 103 -2.875 -1.016 -19.612 646 HG2 LYS 103 2HG LYS 103 -0.780 -0.065 -19.822 647 HG3 LYS 103 3HG LYS 103 -1.545 0.203 -21.394 648 HD2 LYS 103 2HD LYS 103 -2.051 2.525 -20.721 649 HD3 LYS 103 3HD LYS 103 -1.312 2.254 -19.141 650 HE2 LYS 103 2HE LYS 103 0.083 2.141 -21.858 651 HE3 LYS 103 3HE LYS 103 0.106 3.520 -20.747 652 HZ1 LYS 103 HZ1 LYS 103 2.104 2.208 -20.481 653 HZ2 LYS 103 HZ2 LYS 103 1.246 0.845 -20.161 654 HZ3 LYS 103 HZ3 LYS 103 1.223 2.106 -19.105 655 H ASP 104 H ASP 104 -4.844 -1.822 -21.494 656 HA ASP 104 HA ASP 104 -7.450 -1.996 -20.080 657 HB2 ASP 104 2HB ASP 104 -7.310 -1.374 -22.534 658 HB3 ASP 104 3HB ASP 104 -6.624 -2.969 -22.840 659 H GLN 105 H GLN 105 -4.686 -3.459 -19.405 660 HA GLN 105 HA GLN 105 -5.366 -6.223 -19.986 661 HB2 GLN 105 2HB GLN 105 -3.073 -5.052 -18.393 662 HB3 GLN 105 3HB GLN 105 -3.369 -6.766 -18.597 663 HG2 GLN 105 2HG GLN 105 -1.729 -6.125 -20.216 664 HG3 GLN 105 3HG GLN 105 -3.214 -6.576 -21.052 665 HE21 GLN 105 1HE2 GLN 105 -1.982 -3.546 -19.526 666 HE22 GLN 105 2HE2 GLN 105 -2.205 -2.554 -20.964 667 HA PRO 106 HA PRO 106 -7.820 -6.703 -16.296 668 HB2 PRO 106 2HB PRO 106 -7.664 -9.419 -15.820 669 HB3 PRO 106 3HB PRO 106 -8.597 -8.683 -17.154 670 HG2 PRO 106 2HG PRO 106 -5.778 -9.799 -17.268 671 HG3 PRO 106 3HG PRO 106 -7.151 -10.166 -18.366 672 HD2 PRO 106 2HD PRO 106 -5.280 -8.337 -19.020 673 HD3 PRO 106 3HD PRO 106 -7.003 -8.017 -19.389 674 H ASP 107 H ASP 107 -4.448 -6.999 -16.289 675 HA ASP 107 HA ASP 107 -4.213 -7.537 -13.379 676 HB2 ASP 107 2HB ASP 107 -2.511 -8.382 -15.021 677 HB3 ASP 107 3HB ASP 107 -2.113 -6.697 -15.418 678 H VAL 108 H VAL 108 -4.287 -4.813 -15.629 679 HA VAL 108 HA VAL 108 -3.588 -2.925 -13.431 680 HB VAL 108 HB VAL 108 -3.119 -1.293 -15.034 681 HG11 VAL 108 1HG1 VAL 108 -1.330 -2.906 -14.497 682 HG12 VAL 108 2HG1 VAL 108 -1.786 -3.890 -15.907 683 HG13 VAL 108 3HG1 VAL 108 -1.149 -2.249 -16.132 684 HG21 VAL 108 1HG2 VAL 108 -3.920 -3.209 -17.240 685 HG22 VAL 108 2HG2 VAL 108 -4.772 -1.715 -16.785 686 HG23 VAL 108 3HG2 VAL 108 -3.142 -1.646 -17.463 687 H VAL 109 H VAL 109 -6.236 -3.771 -15.630 688 HA VAL 109 HA VAL 109 -8.042 -1.667 -15.074 689 HB VAL 109 HB VAL 109 -8.460 -4.655 -15.420 690 HG11 VAL 109 1HG1 VAL 109 -10.478 -3.898 -14.279 691 HG12 VAL 109 2HG1 VAL 109 -10.617 -2.479 -15.357 692 HG13 VAL 109 3HG1 VAL 109 -10.866 -4.125 -15.986 693 HG21 VAL 109 1HG2 VAL 109 -7.549 -3.261 -17.383 694 HG22 VAL 109 2HG2 VAL 109 -9.067 -4.113 -17.705 695 HG23 VAL 109 3HG2 VAL 109 -9.080 -2.374 -17.356 696 H GLU 110 H GLU 110 -6.810 -4.201 -13.002 697 HA GLU 110 HA GLU 110 -8.783 -3.932 -10.877 698 HB2 GLU 110 2HB GLU 110 -6.160 -5.380 -11.136 699 HB3 GLU 110 3HB GLU 110 -7.145 -5.461 -9.681 700 HG2 GLU 110 2HG GLU 110 -8.269 -6.202 -12.413 701 HG3 GLU 110 3HG GLU 110 -7.397 -7.328 -11.387 702 H LYS 111 H LYS 111 -6.099 -2.019 -11.757 703 HA LYS 111 HA LYS 111 -5.474 -1.236 -8.941 704 HB2 LYS 111 2HB LYS 111 -3.947 -1.156 -11.548 705 HB3 LYS 111 3HB LYS 111 -3.548 -0.007 -10.284 706 HG2 LYS 111 2HG LYS 111 -2.139 -2.037 -10.308 707 HG3 LYS 111 3HG LYS 111 -2.891 -1.691 -8.757 708 HD2 LYS 111 2HD LYS 111 -4.464 -3.466 -8.967 709 HD3 LYS 111 3HD LYS 111 -4.122 -3.689 -10.680 710 HE2 LYS 111 2HE LYS 111 -2.061 -4.150 -8.491 711 HE3 LYS 111 3HE LYS 111 -3.168 -5.413 -9.045 712 HZ1 LYS 111 HZ1 LYS 111 -1.181 -4.039 -10.755 713 HZ2 LYS 111 HZ2 LYS 111 -2.291 -5.126 -11.294 714 HZ3 LYS 111 HZ3 LYS 111 -1.111 -5.594 -10.249 715 H LEU 112 H LEU 112 -6.398 0.121 -12.052 716 HA LEU 112 HA LEU 112 -6.533 2.840 -11.026 717 HB2 LEU 112 2HB LEU 112 -7.379 3.408 -13.297 718 HB3 LEU 112 3HB LEU 112 -5.885 2.532 -13.241 719 HG LEU 112 HG LEU 112 -7.163 0.480 -13.650 720 HD11 LEU 112 1HD1 LEU 112 -9.212 0.389 -14.788 721 HD12 LEU 112 2HD1 LEU 112 -9.361 2.161 -14.709 722 HD13 LEU 112 3HD1 LEU 112 -9.404 1.153 -13.225 723 HD21 LEU 112 1HD2 LEU 112 -6.974 2.519 -15.867 724 HD22 LEU 112 2HD2 LEU 112 -7.167 0.766 -16.119 725 HD23 LEU 112 3HD2 LEU 112 -5.705 1.384 -15.336 726 H LYS 113 H LYS 113 -8.780 0.178 -11.050 727 HA LYS 113 HA LYS 113 -11.172 1.693 -10.648 728 HB2 LYS 113 2HB LYS 113 -12.055 -0.392 -9.642 729 HB3 LYS 113 3HB LYS 113 -11.302 -0.648 -11.214 730 HG2 LYS 113 2HG LYS 113 -9.389 -1.654 -10.291 731 HG3 LYS 113 3HG LYS 113 -9.678 -1.042 -8.669 732 HD2 LYS 113 2HD LYS 113 -10.065 -3.519 -9.112 733 HD3 LYS 113 3HD LYS 113 -11.253 -2.634 -8.149 734 HE2 LYS 113 2HE LYS 113 -12.793 -2.466 -9.967 735 HE3 LYS 113 3HE LYS 113 -11.607 -3.053 -11.138 736 HZ1 LYS 113 HZ1 LYS 113 -12.665 -4.709 -8.910 737 HZ2 LYS 113 HZ2 LYS 113 -11.660 -5.201 -10.110 738 HZ3 LYS 113 HZ3 LYS 113 -13.200 -4.795 -10.458 739 H ASN 114 H ASN 114 -8.556 1.090 -8.477 740 HA ASN 114 HA ASN 114 -10.151 2.204 -6.195 741 HB2 ASN 114 2HB ASN 114 -7.913 0.207 -5.992 742 HB3 ASN 114 3HB ASN 114 -8.924 0.872 -4.685 743 HD21 ASN 114 1HD2 ASN 114 -11.490 0.608 -6.106 744 HD22 ASN 114 2HD2 ASN 114 -11.812 -1.125 -6.147 745 H ILE 115 H ILE 115 -9.472 4.351 -6.848 746 HA ILE 115 HA ILE 115 -6.569 4.944 -6.431 747 HB ILE 115 HB ILE 115 -6.905 7.054 -7.573 748 HG12 ILE 115 2HG1 ILE 115 -9.402 7.194 -7.216 749 HG13 ILE 115 3HG1 ILE 115 -8.772 7.714 -8.738 750 HG21 ILE 115 1HG2 ILE 115 -5.850 5.283 -8.760 751 HG22 ILE 115 2HG2 ILE 115 -7.394 4.525 -9.166 752 HG23 ILE 115 3HG2 ILE 115 -6.962 6.093 -9.883 753 HD11 ILE 115 1HD1 ILE 115 -10.228 5.109 -8.243 754 HD12 ILE 115 2HD1 ILE 115 -10.789 6.540 -9.145 755 HD13 ILE 115 3HD1 ILE 115 -9.465 5.564 -9.771 756 H ASN 116 H ASN 116 -5.923 6.649 -5.170 757 HA ASN 116 HA ASN 116 -8.020 7.926 -3.501 758 HB2 ASN 116 2HB ASN 116 -5.150 8.584 -3.044 759 HB3 ASN 116 3HB ASN 116 -6.530 8.553 -1.939 760 HD21 ASN 116 1HD2 ASN 116 -7.408 5.833 -2.106 761 HD22 ASN 116 2HD2 ASN 116 -6.082 4.847 -1.558 762 H LEU 117 H LEU 117 -8.682 9.911 -4.037 763 HA LEU 117 HA LEU 117 -7.051 11.651 -5.865 764 HB2 LEU 117 2HB LEU 117 -9.824 12.136 -4.712 765 HB3 LEU 117 3HB LEU 117 -8.953 13.168 -5.847 766 HG LEU 117 HG LEU 117 -10.034 10.350 -6.390 767 HD11 LEU 117 1HD1 LEU 117 -10.958 13.071 -7.414 768 HD12 LEU 117 2HD1 LEU 117 -11.787 12.063 -6.206 769 HD13 LEU 117 3HD1 LEU 117 -11.627 11.489 -7.871 770 HD21 LEU 117 1HD2 LEU 117 -8.010 10.694 -7.769 771 HD22 LEU 117 2HD2 LEU 117 -8.616 12.285 -8.277 772 HD23 LEU 117 3HD2 LEU 117 -9.454 10.793 -8.774 773 H THR 118 H THR 118 -5.510 12.641 -4.759 774 HA THR 118 HA THR 118 -6.057 13.754 -2.047 775 HB THR 118 HB THR 118 -3.623 12.112 -2.873 776 HG1 THR 118 HG1 THR 118 -4.441 10.740 -1.268 777 HG21 THR 118 1HG2 THR 118 -4.307 13.675 -0.330 778 HG22 THR 118 2HG2 THR 118 -2.893 13.889 -1.376 779 HG23 THR 118 3HG2 THR 118 -3.036 12.423 -0.408 780 H VAL 119 H VAL 119 -5.603 15.801 -1.973 781 HA VAL 119 HA VAL 119 -3.764 17.038 -3.973 782 HB VAL 119 HB VAL 119 -5.313 18.661 -4.525 783 HG11 VAL 119 1HG1 VAL 119 -7.236 17.535 -5.484 784 HG12 VAL 119 2HG1 VAL 119 -5.814 16.475 -5.615 785 HG13 VAL 119 3HG1 VAL 119 -7.043 16.173 -4.364 786 HG21 VAL 119 1HG2 VAL 119 -7.250 17.739 -2.380 787 HG22 VAL 119 2HG2 VAL 119 -6.302 19.246 -2.364 788 HG23 VAL 119 3HG2 VAL 119 -7.519 19.019 -3.597 789 H ALA 120 H ALA 120 -2.739 18.887 -3.401 790 HA ALA 120 HA ALA 120 -3.280 20.403 -0.967 791 HB1 ALA 120 1HB ALA 120 -0.652 18.848 -1.132 792 HB2 ALA 120 2HB ALA 120 -1.210 19.884 0.199 793 HB3 ALA 120 3HB ALA 120 -2.022 18.347 -0.137 794 HA PRO 121 HA PRO 121 -0.596 22.367 -4.429 795 HB2 PRO 121 2HB PRO 121 -2.353 23.836 -5.921 796 HB3 PRO 121 3HB PRO 121 -1.992 22.108 -6.243 797 HG2 PRO 121 2HG PRO 121 -4.322 23.251 -4.681 798 HG3 PRO 121 3HG PRO 121 -4.361 22.017 -5.979 799 HD2 PRO 121 2HD PRO 121 -4.391 21.328 -3.348 800 HD3 PRO 121 3HD PRO 121 -3.512 20.362 -4.563 801 H GLU 122 H GLU 122 0.306 24.365 -4.090 802 HA GLU 122 HA GLU 122 0.922 26.156 -2.863 803 HB2 GLU 122 2HB GLU 122 -1.970 26.993 -3.308 804 HB3 GLU 122 3HB GLU 122 -0.689 28.030 -2.677 805 HG2 GLU 122 2HG GLU 122 0.654 27.511 -4.777 806 HG3 GLU 122 3HG GLU 122 -0.803 26.761 -5.441 Start of MODEL 10 1 H1 ALA 22 H ALA 22 14.008 -3.864 -12.030 2 HA ALA 22 HA ALA 22 12.195 -4.791 -14.081 3 HB1 ALA 22 1HB ALA 22 11.837 -5.941 -11.298 4 HB2 ALA 22 2HB ALA 22 10.526 -5.828 -12.501 5 HB3 ALA 22 3HB ALA 22 11.969 -6.768 -12.848 6 H ALA 23 H ALA 23 10.951 -1.817 -11.581 7 HA ALA 23 HA ALA 23 12.350 -4.097 -10.252 8 HB1 ALA 23 1HB ALA 23 12.891 -1.814 -9.561 9 HB2 ALA 23 2HB ALA 23 11.173 -1.493 -9.178 10 HB3 ALA 23 3HB ALA 23 12.100 -2.689 -8.247 11 H ARG 24 H ARG 24 9.138 -2.489 -10.195 12 HA ARG 24 HA ARG 24 7.071 -3.241 -10.122 13 HB2 ARG 24 2HB ARG 24 8.243 -6.055 -10.315 14 HB3 ARG 24 3HB ARG 24 6.543 -5.667 -10.511 15 HG2 ARG 24 2HG ARG 24 8.700 -4.438 -12.285 16 HG3 ARG 24 3HG ARG 24 7.870 -5.955 -12.659 17 HD2 ARG 24 2HD ARG 24 5.747 -4.881 -12.837 18 HD3 ARG 24 3HD ARG 24 6.333 -3.390 -12.123 19 HE ARG 24 HE ARG 24 6.712 -4.311 -14.883 20 HH11 ARG 24 1HH1 ARG 24 7.738 -1.930 -12.471 21 HH12 ARG 24 2HH1 ARG 24 8.476 -0.901 -13.665 22 HH21 ARG 24 1HH2 ARG 24 7.569 -2.864 -16.371 23 HH22 ARG 24 2HH2 ARG 24 8.251 -1.362 -15.840 24 H GLN 25 H GLN 25 8.946 -3.436 -7.562 25 HA GLN 25 HA GLN 25 7.124 -4.975 -5.809 26 HB2 GLN 25 2HB GLN 25 9.559 -3.405 -4.943 27 HB3 GLN 25 3HB GLN 25 8.751 -4.696 -4.082 28 HG2 GLN 25 2HG GLN 25 10.464 -4.933 -6.580 29 HG3 GLN 25 3HG GLN 25 10.834 -5.540 -4.974 30 HE21 GLN 25 1HE2 GLN 25 9.662 -6.442 -8.023 31 HE22 GLN 25 2HE2 GLN 25 8.885 -7.945 -7.539 32 H GLN 26 H GLN 26 7.615 -1.734 -6.759 33 HA GLN 26 HA GLN 26 5.780 -0.618 -4.704 34 HB2 GLN 26 2HB GLN 26 7.354 0.992 -4.008 35 HB3 GLN 26 3HB GLN 26 8.106 -0.587 -3.834 36 HG2 GLN 26 2HG GLN 26 8.613 1.420 -6.075 37 HG3 GLN 26 3HG GLN 26 9.677 1.103 -4.705 38 HE21 GLN 26 1HE2 GLN 26 10.826 -0.977 -4.621 39 HE22 GLN 26 2HE2 GLN 26 11.046 -1.883 -6.108 40 H PHE 27 H PHE 27 7.298 -0.254 -7.845 41 HA PHE 27 HA PHE 27 6.965 2.344 -8.404 42 HB2 PHE 27 2HB PHE 27 7.598 1.770 -10.501 43 HB3 PHE 27 3HB PHE 27 7.931 0.205 -9.752 44 HD1 PHE 27 HD1 PHE 27 5.897 -1.484 -9.705 45 HD2 PHE 27 HD2 PHE 27 6.137 1.914 -12.351 46 HE1 PHE 27 HE1 PHE 27 4.156 -2.493 -11.144 47 HE2 PHE 27 HE2 PHE 27 4.377 0.922 -13.788 48 HZ PHE 27 HZ PHE 27 3.404 -1.302 -13.210 49 H VAL 28 H VAL 28 4.269 0.271 -8.116 50 HA VAL 28 HA VAL 28 2.371 1.425 -9.911 51 HB VAL 28 HB VAL 28 0.638 0.670 -8.224 52 HG11 VAL 28 1HG1 VAL 28 0.947 -1.703 -8.766 53 HG12 VAL 28 2HG1 VAL 28 1.358 -0.694 -10.165 54 HG13 VAL 28 3HG1 VAL 28 2.651 -1.414 -9.174 55 HG21 VAL 28 1HG2 VAL 28 2.002 0.747 -6.149 56 HG22 VAL 28 2HG2 VAL 28 1.290 -0.848 -6.428 57 HG23 VAL 28 3HG2 VAL 28 3.006 -0.590 -6.773 58 H THR 29 H THR 29 3.537 2.564 -6.806 59 HA THR 29 HA THR 29 1.657 4.641 -6.323 60 HB THR 29 HB THR 29 3.335 3.784 -4.734 61 HG1 THR 29 HG1 THR 29 2.299 5.678 -4.252 62 HG21 THR 29 1HG2 THR 29 5.343 5.670 -6.015 63 HG22 THR 29 2HG2 THR 29 5.362 3.931 -6.316 64 HG23 THR 29 3HG2 THR 29 5.583 4.541 -4.668 65 H SER 30 H SER 30 4.682 4.720 -8.301 66 HA SER 30 HA SER 30 4.440 7.465 -9.058 67 HB2 SER 30 2HB SER 30 5.720 5.200 -10.633 68 HB3 SER 30 3HB SER 30 6.085 6.929 -10.747 69 HG SER 30 HG SER 30 7.646 5.922 -9.452 70 H GLU 31 H GLU 31 2.953 4.510 -10.328 71 HA GLU 31 HA GLU 31 1.840 5.796 -12.683 72 HB2 GLU 31 2HB GLU 31 1.018 3.191 -11.363 73 HB3 GLU 31 3HB GLU 31 0.488 3.789 -12.928 74 HG2 GLU 31 2HG GLU 31 3.296 3.030 -12.109 75 HG3 GLU 31 3HG GLU 31 2.231 2.176 -13.237 76 H VAL 32 H VAL 32 0.825 5.860 -9.273 77 HA VAL 32 HA VAL 32 -1.981 6.319 -9.786 78 HB VAL 32 HB VAL 32 -0.290 7.394 -7.499 79 HG11 VAL 32 1HG1 VAL 32 -3.316 7.186 -7.849 80 HG12 VAL 32 2HG1 VAL 32 -2.508 7.504 -6.299 81 HG13 VAL 32 3HG1 VAL 32 -2.360 8.673 -7.611 82 HG21 VAL 32 1HG2 VAL 32 -1.270 5.493 -6.215 83 HG22 VAL 32 2HG2 VAL 32 -2.057 4.907 -7.705 84 HG23 VAL 32 3HG2 VAL 32 -0.285 4.933 -7.555 85 H GLY 33 H GLY 33 0.872 8.319 -10.226 86 HA2 GLY 33 HA2 GLY 33 -0.380 10.884 -10.557 87 HA3 GLY 33 HA3 GLY 33 1.191 10.378 -11.202 88 H ARG 34 H ARG 34 -0.424 8.044 -12.615 89 HA ARG 34 HA ARG 34 -1.747 9.670 -14.777 90 HB2 ARG 34 2HB ARG 34 -0.670 6.832 -14.859 91 HB3 ARG 34 3HB ARG 34 -1.390 7.743 -16.198 92 HG2 ARG 34 2HG ARG 34 0.471 9.393 -16.046 93 HG3 ARG 34 3HG ARG 34 1.174 8.465 -14.692 94 HD2 ARG 34 2HD ARG 34 1.436 6.497 -16.128 95 HD3 ARG 34 3HD ARG 34 0.781 7.405 -17.499 96 HE ARG 34 HE ARG 34 2.669 9.028 -17.134 97 HH11 ARG 34 1HH1 ARG 34 3.226 5.718 -15.888 98 HH12 ARG 34 2HH1 ARG 34 4.927 5.873 -16.093 99 HH21 ARG 34 1HH2 ARG 34 4.885 9.103 -17.370 100 HH22 ARG 34 2HH2 ARG 34 5.864 7.751 -16.907 101 H TYR 35 H TYR 35 -2.051 6.527 -13.133 102 HA TYR 35 HA TYR 35 -4.587 5.755 -14.030 103 HB2 TYR 35 2HB TYR 35 -2.817 4.984 -11.687 104 HB3 TYR 35 3HB TYR 35 -4.430 4.306 -11.858 105 HD1 TYR 35 HD1 TYR 35 -1.333 4.862 -13.990 106 HD2 TYR 35 HD2 TYR 35 -4.695 2.379 -13.058 107 HE1 TYR 35 HE1 TYR 35 -0.732 3.372 -15.866 108 HE2 TYR 35 HE2 TYR 35 -4.252 0.996 -15.034 109 HH TYR 35 HH TYR 35 -1.350 1.558 -17.132 110 H GLY 36 H GLY 36 -3.849 7.519 -11.043 111 HA2 GLY 36 HA2 GLY 36 -6.696 7.930 -10.380 112 HA3 GLY 36 HA3 GLY 36 -5.296 8.579 -9.518 113 H ALA 37 H ALA 37 -4.373 9.558 -12.433 114 HA ALA 37 HA ALA 37 -5.510 12.189 -12.117 115 HB1 ALA 37 1HB ALA 37 -3.973 12.837 -13.880 116 HB2 ALA 37 2HB ALA 37 -3.136 11.871 -12.654 117 HB3 ALA 37 3HB ALA 37 -3.584 11.142 -14.218 118 H ILE 38 H ILE 38 -6.099 9.380 -14.221 119 HA ILE 38 HA ILE 38 -7.674 10.782 -16.191 120 HB ILE 38 HB ILE 38 -8.434 8.645 -16.901 121 HG12 ILE 38 2HG1 ILE 38 -7.937 7.720 -14.075 122 HG13 ILE 38 3HG1 ILE 38 -9.446 7.715 -14.971 123 HG21 ILE 38 1HG2 ILE 38 -5.865 9.078 -16.950 124 HG22 ILE 38 2HG2 ILE 38 -5.770 7.840 -15.678 125 HG23 ILE 38 3HG2 ILE 38 -6.440 7.437 -17.262 126 HD11 ILE 38 1HD1 ILE 38 -8.435 5.942 -16.486 127 HD12 ILE 38 2HD1 ILE 38 -7.094 5.838 -15.300 128 HD13 ILE 38 3HD1 ILE 38 -8.759 5.463 -14.814 129 H TYR 39 H TYR 39 -8.433 9.716 -12.981 130 HA TYR 39 HA TYR 39 -11.312 10.124 -13.176 131 HB2 TYR 39 2HB TYR 39 -9.471 9.720 -10.780 132 HB3 TYR 39 3HB TYR 39 -11.227 9.755 -10.719 133 HD1 TYR 39 HD1 TYR 39 -8.309 7.724 -11.607 134 HD2 TYR 39 HD2 TYR 39 -12.588 7.960 -11.713 135 HE1 TYR 39 HE1 TYR 39 -8.375 5.285 -12.272 136 HE2 TYR 39 HE2 TYR 39 -12.655 5.618 -12.570 137 HH TYR 39 HH TYR 39 -9.839 3.592 -12.987 138 H THR 40 H THR 40 -8.626 11.836 -11.485 139 HA THR 40 HA THR 40 -10.144 14.049 -10.566 140 HB THR 40 HB THR 40 -7.754 13.227 -9.984 141 HG1 THR 40 HG1 THR 40 -7.399 15.326 -9.157 142 HG21 THR 40 1HG2 THR 40 -6.856 13.725 -12.303 143 HG22 THR 40 2HG2 THR 40 -5.902 14.273 -10.932 144 HG23 THR 40 3HG2 THR 40 -6.904 15.432 -11.865 145 H GLN 41 H GLN 41 -8.648 13.539 -13.706 146 HA GLN 41 HA GLN 41 -8.995 16.218 -14.730 147 HB2 GLN 41 2HB GLN 41 -8.406 13.547 -15.981 148 HB3 GLN 41 3HB GLN 41 -8.698 14.992 -16.962 149 HG2 GLN 41 2HG GLN 41 -6.863 16.194 -15.858 150 HG3 GLN 41 3HG GLN 41 -6.560 14.799 -14.814 151 HE21 GLN 41 1HE2 GLN 41 -6.141 12.729 -15.948 152 HE22 GLN 41 2HE2 GLN 41 -5.119 12.773 -17.400 153 H LEU 42 H LEU 42 -11.044 13.307 -14.692 154 HA LEU 42 HA LEU 42 -13.034 14.611 -16.444 155 HB2 LEU 42 2HB LEU 42 -12.624 12.120 -16.398 156 HB3 LEU 42 3HB LEU 42 -13.283 12.119 -14.751 157 HG LEU 42 HG LEU 42 -15.471 12.867 -15.584 158 HD11 LEU 42 1HD1 LEU 42 -14.874 14.212 -17.551 159 HD12 LEU 42 2HD1 LEU 42 -15.948 12.910 -18.054 160 HD13 LEU 42 3HD1 LEU 42 -14.199 12.782 -18.361 161 HD21 LEU 42 1HD2 LEU 42 -15.126 10.513 -15.428 162 HD22 LEU 42 2HD2 LEU 42 -14.331 10.445 -17.020 163 HD23 LEU 42 3HD2 LEU 42 -16.068 10.836 -16.886 164 H ILE 43 H ILE 43 -12.578 14.162 -12.939 165 HA ILE 43 HA ILE 43 -15.190 15.125 -12.203 166 HB ILE 43 HB ILE 43 -12.571 14.608 -10.783 167 HG12 ILE 43 2HG1 ILE 43 -14.142 13.324 -9.295 168 HG13 ILE 43 3HG1 ILE 43 -15.496 13.844 -10.316 169 HG21 ILE 43 1HG2 ILE 43 -14.890 16.131 -9.532 170 HG22 ILE 43 2HG2 ILE 43 -13.522 15.412 -8.650 171 HG23 ILE 43 3HG2 ILE 43 -13.228 16.746 -9.763 172 HD11 ILE 43 1HD1 ILE 43 -14.921 11.600 -10.883 173 HD12 ILE 43 2HD1 ILE 43 -14.369 12.603 -12.237 174 HD13 ILE 43 3HD1 ILE 43 -13.206 11.981 -11.035 175 H ARG 44 H ARG 44 -12.099 16.811 -12.525 176 HA ARG 44 HA ARG 44 -13.044 19.388 -11.678 177 HB2 ARG 44 2HB ARG 44 -10.946 20.250 -12.495 178 HB3 ARG 44 3HB ARG 44 -10.719 18.681 -11.724 179 HG2 ARG 44 2HG ARG 44 -9.355 18.455 -13.545 180 HG3 ARG 44 3HG ARG 44 -10.835 17.695 -14.099 181 HD2 ARG 44 2HD ARG 44 -11.352 20.028 -15.206 182 HD3 ARG 44 3HD ARG 44 -9.643 20.361 -14.893 183 HE ARG 44 HE ARG 44 -10.382 17.834 -16.272 184 HH11 ARG 44 1HH1 ARG 44 -9.099 21.098 -16.759 185 HH12 ARG 44 2HH1 ARG 44 -8.485 20.706 -18.340 186 HH21 ARG 44 1HH2 ARG 44 -9.574 17.406 -18.279 187 HH22 ARG 44 2HH2 ARG 44 -8.763 18.644 -19.190 188 H GLN 45 H GLN 45 -13.459 17.736 -14.683 189 HA GLN 45 HA GLN 45 -14.081 19.966 -16.446 190 HB2 GLN 45 2HB GLN 45 -15.146 17.121 -16.328 191 HB3 GLN 45 3HB GLN 45 -15.527 18.232 -17.628 192 HG2 GLN 45 2HG GLN 45 -12.631 17.799 -17.019 193 HG3 GLN 45 3HG GLN 45 -13.521 16.443 -17.729 194 HE21 GLN 45 1HE2 GLN 45 -14.312 16.628 -19.914 195 HE22 GLN 45 2HE2 GLN 45 -13.769 17.928 -20.951 196 H ASN 46 H ASN 46 -15.946 18.163 -13.981 197 HA ASN 46 HA ASN 46 -18.382 19.790 -14.455 198 HB2 ASN 46 2HB ASN 46 -17.709 18.084 -12.040 199 HB3 ASN 46 3HB ASN 46 -19.296 18.648 -12.557 200 HD21 ASN 46 1HD2 ASN 46 -16.930 16.155 -12.868 201 HD22 ASN 46 2HD2 ASN 46 -17.906 15.176 -13.949 202 H LEU 47 H LEU 47 -15.747 19.549 -12.038 203 HA LEU 47 HA LEU 47 -16.797 21.793 -10.489 204 HB2 LEU 47 2HB LEU 47 -14.350 20.069 -10.083 205 HB3 LEU 47 3HB LEU 47 -15.161 21.118 -8.929 206 HG LEU 47 HG LEU 47 -16.235 18.579 -10.038 207 HD11 LEU 47 1HD1 LEU 47 -15.857 17.869 -7.751 208 HD12 LEU 47 2HD1 LEU 47 -15.282 19.513 -7.345 209 HD13 LEU 47 3HD1 LEU 47 -14.378 18.517 -8.508 210 HD21 LEU 47 1HD2 LEU 47 -18.051 18.926 -8.242 211 HD22 LEU 47 2HD2 LEU 47 -18.213 19.938 -9.696 212 HD23 LEU 47 3HD2 LEU 47 -17.548 20.630 -8.209 213 H LEU 48 H LEU 48 -16.463 23.195 -12.206 214 HA LEU 48 HA LEU 48 -13.823 24.173 -12.905 215 HB2 LEU 48 2HB LEU 48 -15.116 25.998 -14.099 216 HB3 LEU 48 3HB LEU 48 -15.422 24.352 -14.589 217 HG LEU 48 HG LEU 48 -17.549 24.303 -13.430 218 HD11 LEU 48 1HD1 LEU 48 -17.022 27.189 -12.617 219 HD12 LEU 48 2HD1 LEU 48 -17.200 25.797 -11.514 220 HD13 LEU 48 3HD1 LEU 48 -18.580 26.357 -12.472 221 HD21 LEU 48 1HD2 LEU 48 -18.738 25.880 -14.879 222 HD22 LEU 48 2HD2 LEU 48 -17.406 25.111 -15.751 223 HD23 LEU 48 3HD2 LEU 48 -17.239 26.788 -15.165 224 H VAL 49 H VAL 49 -14.116 24.128 -10.132 225 HA VAL 49 HA VAL 49 -14.828 26.858 -9.262 226 HB VAL 49 HB VAL 49 -14.170 24.602 -7.392 227 HG11 VAL 49 1HG1 VAL 49 -14.212 26.839 -6.372 228 HG12 VAL 49 2HG1 VAL 49 -15.794 27.176 -7.107 229 HG13 VAL 49 3HG1 VAL 49 -15.637 25.925 -5.863 230 HG21 VAL 49 1HG2 VAL 49 -16.633 24.203 -7.235 231 HG22 VAL 49 2HG2 VAL 49 -16.882 25.317 -8.602 232 HG23 VAL 49 3HG2 VAL 49 -15.991 23.795 -8.830 233 H GLU 50 H GLU 50 -12.211 24.747 -8.080 234 HA GLU 50 HA GLU 50 -9.990 24.945 -7.904 235 HB2 GLU 50 2HB GLU 50 -10.100 27.447 -9.620 236 HB3 GLU 50 3HB GLU 50 -8.718 26.416 -9.280 237 HG2 GLU 50 2HG GLU 50 -9.917 24.498 -10.394 238 HG3 GLU 50 3HG GLU 50 -11.193 25.622 -10.865 239 H ASP 51 H ASP 51 -11.443 28.211 -7.425 240 HA ASP 51 HA ASP 51 -9.354 29.259 -5.794 241 HB2 ASP 51 2HB ASP 51 -11.118 30.556 -6.963 242 HB3 ASP 51 3HB ASP 51 -12.325 29.930 -5.849 243 H SER 52 H SER 52 -12.290 27.439 -4.849 244 HA SER 52 HA SER 52 -11.509 27.501 -1.990 245 HB2 SER 52 2HB SER 52 -13.653 26.405 -1.605 246 HB3 SER 52 3HB SER 52 -13.850 27.877 -2.565 247 HG SER 52 HG SER 52 -15.062 26.102 -3.405 248 H PHE 53 H PHE 53 -10.450 25.661 -4.559 249 HA PHE 53 HA PHE 53 -10.332 23.065 -3.122 250 HB2 PHE 53 2HB PHE 53 -9.589 23.876 -5.939 251 HB3 PHE 53 3HB PHE 53 -9.464 22.262 -5.271 252 HD1 PHE 53 HD1 PHE 53 -10.903 22.733 -7.768 253 HD2 PHE 53 HD2 PHE 53 -12.395 22.936 -3.709 254 HE1 PHE 53 HE1 PHE 53 -13.095 21.938 -8.513 255 HE2 PHE 53 HE2 PHE 53 -14.593 22.206 -4.472 256 HZ PHE 53 HZ PHE 53 -14.962 21.656 -6.879 257 H ARG 54 H ARG 54 -8.572 25.935 -3.637 258 HA ARG 54 HA ARG 54 -5.902 24.713 -3.141 259 HB2 ARG 54 2HB ARG 54 -6.763 27.319 -4.433 260 HB3 ARG 54 3HB ARG 54 -5.076 26.879 -4.102 261 HG2 ARG 54 2HG ARG 54 -5.294 24.844 -5.477 262 HG3 ARG 54 3HG ARG 54 -6.962 25.197 -5.838 263 HD2 ARG 54 2HD ARG 54 -4.683 27.076 -6.577 264 HD3 ARG 54 3HD ARG 54 -5.389 25.864 -7.664 265 HE ARG 54 HE ARG 54 -7.557 27.264 -6.653 266 HH11 ARG 54 1HH1 ARG 54 -4.755 28.138 -8.639 267 HH12 ARG 54 2HH1 ARG 54 -5.607 29.401 -9.470 268 HH21 ARG 54 1HH2 ARG 54 -8.596 28.945 -7.746 269 HH22 ARG 54 2HH2 ARG 54 -7.742 29.874 -8.943 270 H GLY 55 H GLY 55 -4.451 25.831 -1.726 271 HA2 GLY 55 HA2 GLY 55 -3.814 27.069 0.170 272 HA3 GLY 55 HA3 GLY 55 -5.452 27.751 0.280 273 H LYS 56 H LYS 56 -6.646 24.985 0.190 274 HA LYS 56 HA LYS 56 -5.894 23.870 2.845 275 HB2 LYS 56 2HB LYS 56 -8.170 22.965 2.931 276 HB3 LYS 56 3HB LYS 56 -8.139 24.708 2.840 277 HG2 LYS 56 2HG LYS 56 -9.927 24.001 1.540 278 HG3 LYS 56 3HG LYS 56 -8.731 24.596 0.404 279 HD2 LYS 56 2HD LYS 56 -8.148 22.384 -0.312 280 HD3 LYS 56 3HD LYS 56 -9.014 21.608 1.024 281 HE2 LYS 56 2HE LYS 56 -10.148 23.161 -1.294 282 HE3 LYS 56 3HE LYS 56 -10.177 21.391 -1.127 283 HZ1 LYS 56 HZ1 LYS 56 -11.589 23.254 0.719 284 HZ2 LYS 56 HZ2 LYS 56 -11.744 21.629 0.687 285 HZ3 LYS 56 HZ3 LYS 56 -12.289 22.560 -0.560 286 H GLN 57 H GLN 57 -6.780 21.335 2.670 287 HA GLN 57 HA GLN 57 -5.690 20.127 0.176 288 HB2 GLN 57 2HB GLN 57 -4.050 18.964 1.273 289 HB3 GLN 57 3HB GLN 57 -4.075 20.387 2.233 290 HG2 GLN 57 2HG GLN 57 -4.138 18.939 3.943 291 HG3 GLN 57 3HG GLN 57 -5.870 18.998 3.662 292 HE21 GLN 57 1HE2 GLN 57 -4.309 17.161 1.198 293 HE22 GLN 57 2HE2 GLN 57 -4.782 15.617 1.897 294 H CYS 58 H CYS 58 -6.396 17.806 -0.073 295 HA CYS 58 HA CYS 58 -8.125 16.745 1.943 296 HB2 CYS 58 2HB CYS 58 -10.145 16.478 0.877 297 HB3 CYS 58 3HB CYS 58 -9.678 18.054 0.230 298 HG CYS 58 HG CYS 58 -10.882 16.485 -1.577 299 H ARG 59 H ARG 59 -8.462 14.489 1.768 300 HA ARG 59 HA ARG 59 -7.264 13.085 -0.508 301 HB2 ARG 59 2HB ARG 59 -6.357 11.327 0.894 302 HB3 ARG 59 3HB ARG 59 -5.492 12.832 1.060 303 HG2 ARG 59 2HG ARG 59 -7.586 12.353 3.135 304 HG3 ARG 59 3HG ARG 59 -6.264 11.199 3.093 305 HD2 ARG 59 2HD ARG 59 -4.752 13.357 3.132 306 HD3 ARG 59 3HD ARG 59 -6.254 14.152 3.665 307 HE ARG 59 HE ARG 59 -5.620 11.693 5.108 308 HH11 ARG 59 1HH1 ARG 59 -5.035 15.198 5.186 309 HH12 ARG 59 2HH1 ARG 59 -4.462 15.129 6.836 310 HH21 ARG 59 1HH2 ARG 59 -4.966 11.711 7.230 311 HH22 ARG 59 2HH2 ARG 59 -4.466 13.198 7.977 312 H VAL 60 H VAL 60 -8.746 11.757 -1.369 313 HA VAL 60 HA VAL 60 -10.768 10.430 0.358 314 HB VAL 60 HB VAL 60 -12.622 11.054 -1.054 315 HG11 VAL 60 1HG1 VAL 60 -12.899 13.366 -0.469 316 HG12 VAL 60 2HG1 VAL 60 -11.978 12.588 0.837 317 HG13 VAL 60 3HG1 VAL 60 -11.150 13.611 -0.336 318 HG21 VAL 60 1HG2 VAL 60 -11.472 11.263 -3.231 319 HG22 VAL 60 2HG2 VAL 60 -12.510 12.659 -2.870 320 HG23 VAL 60 3HG2 VAL 60 -10.755 12.804 -2.682 321 H ASN 61 H ASN 61 -11.903 8.645 -1.030 322 HA ASN 61 HA ASN 61 -10.006 7.650 -3.066 323 HB2 ASN 61 2HB ASN 61 -9.303 6.709 -0.966 324 HB3 ASN 61 3HB ASN 61 -10.945 6.281 -0.519 325 HD21 ASN 61 1HD2 ASN 61 -12.054 4.615 -1.922 326 HD22 ASN 61 2HD2 ASN 61 -11.030 3.369 -2.637 327 H LEU 62 H LEU 62 -10.807 6.684 -4.760 328 HA LEU 62 HA LEU 62 -13.797 6.349 -4.951 329 HB2 LEU 62 2HB LEU 62 -11.587 7.085 -6.855 330 HB3 LEU 62 3HB LEU 62 -13.013 6.265 -7.482 331 HG LEU 62 HG LEU 62 -14.462 8.058 -6.736 332 HD11 LEU 62 1HD1 LEU 62 -13.363 8.927 -4.727 333 HD12 LEU 62 2HD1 LEU 62 -13.491 10.233 -5.909 334 HD13 LEU 62 3HD1 LEU 62 -11.940 9.399 -5.666 335 HD21 LEU 62 1HD2 LEU 62 -13.370 8.152 -8.948 336 HD22 LEU 62 2HD2 LEU 62 -11.992 9.022 -8.257 337 HD23 LEU 62 3HD2 LEU 62 -13.585 9.787 -8.301 338 H LYS 63 H LYS 63 -14.626 4.414 -5.168 339 HA LYS 63 HA LYS 63 -12.939 2.103 -6.043 340 HB2 LYS 63 2HB LYS 63 -15.456 2.079 -4.332 341 HB3 LYS 63 3HB LYS 63 -14.516 0.670 -4.841 342 HG2 LYS 63 2HG LYS 63 -12.556 1.566 -3.554 343 HG3 LYS 63 3HG LYS 63 -13.591 2.900 -2.983 344 HD2 LYS 63 2HD LYS 63 -15.143 1.269 -1.957 345 HD3 LYS 63 3HD LYS 63 -14.092 -0.061 -2.488 346 HE2 LYS 63 2HE LYS 63 -12.229 0.893 -1.151 347 HE3 LYS 63 3HE LYS 63 -13.290 2.216 -0.619 348 HZ1 LYS 63 HZ1 LYS 63 -14.707 0.571 0.453 349 HZ2 LYS 63 HZ2 LYS 63 -13.181 0.452 1.029 350 HZ3 LYS 63 HZ3 LYS 63 -13.735 -0.657 -0.026 351 H LEU 64 H LEU 64 -13.312 1.926 -8.268 352 HA LEU 64 HA LEU 64 -16.089 2.345 -9.242 353 HB2 LEU 64 2HB LEU 64 -13.568 1.990 -10.879 354 HB3 LEU 64 3HB LEU 64 -15.142 2.512 -11.423 355 HG LEU 64 HG LEU 64 -14.024 4.419 -11.514 356 HD11 LEU 64 1HD1 LEU 64 -15.138 4.645 -8.704 357 HD12 LEU 64 2HD1 LEU 64 -15.974 4.902 -10.263 358 HD13 LEU 64 3HD1 LEU 64 -14.683 5.990 -9.767 359 HD21 LEU 64 1HD2 LEU 64 -12.580 3.868 -8.899 360 HD22 LEU 64 2HD2 LEU 64 -12.382 5.275 -9.953 361 HD23 LEU 64 3HD2 LEU 64 -11.954 3.668 -10.566 362 H ILE 65 H ILE 65 -16.920 0.978 -10.813 363 HA ILE 65 HA ILE 65 -16.103 -1.908 -10.741 364 HB ILE 65 HB ILE 65 -18.386 -2.269 -11.770 365 HG12 ILE 65 2HG1 ILE 65 -19.130 0.444 -10.589 366 HG13 ILE 65 3HG1 ILE 65 -18.705 0.251 -12.286 367 HG21 ILE 65 1HG2 ILE 65 -19.511 -2.318 -9.590 368 HG22 ILE 65 2HG2 ILE 65 -17.828 -2.825 -9.422 369 HG23 ILE 65 3HG2 ILE 65 -18.315 -1.193 -8.911 370 HD11 ILE 65 1HD1 ILE 65 -21.006 -1.132 -10.896 371 HD12 ILE 65 2HD1 ILE 65 -21.071 0.207 -12.064 372 HD13 ILE 65 3HD1 ILE 65 -20.496 -1.386 -12.591 373 HA PRO 66 HA PRO 66 -14.923 -1.177 -15.011 374 HB2 PRO 66 2HB PRO 66 -14.892 -3.688 -16.070 375 HB3 PRO 66 3HB PRO 66 -13.682 -3.133 -14.868 376 HG2 PRO 66 2HG PRO 66 -16.199 -4.756 -14.350 377 HG3 PRO 66 3HG PRO 66 -14.537 -5.072 -13.762 378 HD2 PRO 66 2HD PRO 66 -16.429 -3.792 -12.246 379 HD3 PRO 66 3HD PRO 66 -14.691 -3.368 -12.143 380 H THR 67 H THR 67 -16.060 -0.592 -16.818 381 HA THR 67 HA THR 67 -18.661 -1.841 -17.522 382 HB THR 67 HB THR 67 -18.354 1.100 -16.836 383 HG1 THR 67 HG1 THR 67 -18.770 -0.719 -15.233 384 HG21 THR 67 1HG2 THR 67 -20.809 1.203 -17.322 385 HG22 THR 67 2HG2 THR 67 -20.726 -0.457 -17.959 386 HG23 THR 67 3HG2 THR 67 -19.865 0.871 -18.764 387 H GLY 68 H GLY 68 -17.708 -2.547 -19.390 388 HA2 GLY 68 HA2 GLY 68 -17.151 -2.470 -21.643 389 HA3 GLY 68 HA3 GLY 68 -17.877 -0.859 -21.645 390 H THR 69 H THR 69 -16.610 0.763 -22.164 391 HA THR 69 HA THR 69 -13.718 0.468 -22.565 392 HB THR 69 HB THR 69 -13.997 2.762 -23.569 393 HG1 THR 69 HG1 THR 69 -16.165 3.417 -23.884 394 HG21 THR 69 1HG2 THR 69 -15.169 1.989 -25.560 395 HG22 THR 69 2HG2 THR 69 -15.883 0.630 -24.662 396 HG23 THR 69 3HG2 THR 69 -14.130 0.695 -24.942 397 H GLY 70 H GLY 70 -15.480 1.375 -19.836 398 HA2 GLY 70 HA2 GLY 70 -13.128 2.851 -18.751 399 HA3 GLY 70 HA3 GLY 70 -14.705 3.632 -18.705 400 H ALA 71 H ALA 71 -14.074 3.647 -16.341 401 HA ALA 71 HA ALA 71 -15.364 1.294 -15.051 402 HB1 ALA 71 1HB ALA 71 -13.628 3.329 -13.623 403 HB2 ALA 71 2HB ALA 71 -14.101 1.693 -13.112 404 HB3 ALA 71 3HB ALA 71 -12.952 1.888 -14.412 405 H LEU 72 H LEU 72 -16.844 1.892 -13.241 406 HA LEU 72 HA LEU 72 -18.130 4.587 -13.423 407 HB2 LEU 72 2HB LEU 72 -19.198 2.045 -14.236 408 HB3 LEU 72 3HB LEU 72 -19.957 2.411 -12.695 409 HG LEU 72 HG LEU 72 -20.674 4.629 -13.620 410 HD11 LEU 72 1HD1 LEU 72 -19.432 3.484 -16.167 411 HD12 LEU 72 2HD1 LEU 72 -18.993 4.981 -15.325 412 HD13 LEU 72 3HD1 LEU 72 -20.562 4.861 -16.135 413 HD21 LEU 72 1HD2 LEU 72 -22.437 3.694 -15.081 414 HD22 LEU 72 2HD2 LEU 72 -22.186 2.674 -13.655 415 HD23 LEU 72 3HD2 LEU 72 -21.528 2.179 -15.219 416 H LEU 73 H LEU 73 -18.948 5.449 -11.485 417 HA LEU 73 HA LEU 73 -17.644 4.710 -9.111 418 HB2 LEU 73 2HB LEU 73 -18.560 6.936 -9.819 419 HB3 LEU 73 3HB LEU 73 -20.159 6.396 -9.362 420 HG LEU 73 HG LEU 73 -18.919 7.886 -7.743 421 HD11 LEU 73 1HD1 LEU 73 -19.741 5.225 -6.516 422 HD12 LEU 73 2HD1 LEU 73 -20.842 6.522 -6.994 423 HD13 LEU 73 3HD1 LEU 73 -19.655 6.805 -5.712 424 HD21 LEU 73 1HD2 LEU 73 -17.143 7.036 -6.351 425 HD22 LEU 73 2HD2 LEU 73 -16.673 6.733 -8.025 426 HD23 LEU 73 3HD2 LEU 73 -17.298 5.404 -7.018 427 H GLY 74 H GLY 74 -17.778 2.951 -8.020 428 HA2 GLY 74 HA2 GLY 74 -20.358 1.547 -7.533 429 HA3 GLY 74 HA3 GLY 74 -18.711 0.937 -7.228 430 H SER 75 H SER 75 -17.678 3.252 -5.835 431 HA SER 75 HA SER 75 -19.425 4.065 -3.680 432 HB2 SER 75 2HB SER 75 -17.398 1.858 -3.187 433 HB3 SER 75 3HB SER 75 -17.719 3.047 -1.930 434 HG SER 75 HG SER 75 -19.765 1.524 -3.198 435 H LEU 76 H LEU 76 -18.452 5.633 -2.311 436 HA LEU 76 HA LEU 76 -15.723 6.540 -3.028 437 HB2 LEU 76 2HB LEU 76 -17.515 7.795 -4.292 438 HB3 LEU 76 3HB LEU 76 -18.147 8.393 -2.781 439 HG LEU 76 HG LEU 76 -15.207 8.808 -3.344 440 HD11 LEU 76 1HD1 LEU 76 -15.775 10.885 -4.658 441 HD12 LEU 76 2HD1 LEU 76 -17.454 10.281 -4.758 442 HD13 LEU 76 3HD1 LEU 76 -16.142 9.360 -5.492 443 HD21 LEU 76 1HD2 LEU 76 -17.339 10.623 -2.127 444 HD22 LEU 76 2HD2 LEU 76 -15.597 10.975 -2.241 445 HD23 LEU 76 3HD2 LEU 76 -16.169 9.655 -1.211 446 H THR 77 H THR 77 -14.523 6.906 -1.370 447 HA THR 77 HA THR 77 -15.614 7.012 1.424 448 HB THR 77 HB THR 77 -12.964 6.022 0.284 449 HG1 THR 77 HG1 THR 77 -13.819 4.044 1.216 450 HG21 THR 77 1HG2 THR 77 -12.518 5.205 2.607 451 HG22 THR 77 2HG2 THR 77 -13.934 6.099 3.181 452 HG23 THR 77 3HG2 THR 77 -12.531 6.968 2.508 453 H VAL 78 H VAL 78 -14.998 8.812 2.660 454 HA VAL 78 HA VAL 78 -12.964 10.675 1.513 455 HB VAL 78 HB VAL 78 -13.707 12.362 3.081 456 HG11 VAL 78 1HG1 VAL 78 -14.602 12.350 0.784 457 HG12 VAL 78 2HG1 VAL 78 -15.948 11.310 1.298 458 HG13 VAL 78 3HG1 VAL 78 -15.808 12.956 1.923 459 HG21 VAL 78 1HG2 VAL 78 -14.725 11.025 4.871 460 HG22 VAL 78 2HG2 VAL 78 -15.874 12.208 4.236 461 HG23 VAL 78 3HG2 VAL 78 -16.021 10.501 3.770 462 H LEU 79 H LEU 79 -11.016 10.903 2.533 463 HA LEU 79 HA LEU 79 -10.559 9.214 4.974 464 HB2 LEU 79 2HB LEU 79 -8.564 10.320 2.978 465 HB3 LEU 79 3HB LEU 79 -8.207 9.253 4.315 466 HG LEU 79 HG LEU 79 -9.983 8.517 1.922 467 HD11 LEU 79 1HD1 LEU 79 -8.039 7.210 1.151 468 HD12 LEU 79 2HD1 LEU 79 -7.054 7.869 2.478 469 HD13 LEU 79 3HD1 LEU 79 -7.672 8.941 1.200 470 HD21 LEU 79 1HD2 LEU 79 -8.760 6.798 4.126 471 HD22 LEU 79 2HD2 LEU 79 -9.673 6.190 2.720 472 HD23 LEU 79 3HD2 LEU 79 -10.488 7.179 3.936 473 H ASP 80 H ASP 80 -9.936 12.437 3.566 474 HA ASP 80 HA ASP 80 -10.664 13.811 5.911 475 HB2 ASP 80 2HB ASP 80 -8.081 12.912 6.301 476 HB3 ASP 80 3HB ASP 80 -7.766 14.439 5.505 477 H GLY 81 H GLY 81 -10.174 16.229 5.706 478 HA2 GLY 81 HA2 GLY 81 -8.993 17.689 3.850 479 HA3 GLY 81 HA3 GLY 81 -10.346 17.132 2.883 480 H ASP 82 H ASP 82 -10.303 19.599 2.849 481 HA ASP 82 HA ASP 82 -12.095 20.769 4.919 482 HB2 ASP 82 2HB ASP 82 -10.260 22.164 4.210 483 HB3 ASP 82 3HB ASP 82 -10.645 21.916 2.519 484 H SER 83 H SER 83 -14.140 20.337 4.669 485 HA SER 83 HA SER 83 -15.059 18.488 2.957 486 HB2 SER 83 2HB SER 83 -16.813 20.521 4.369 487 HB3 SER 83 3HB SER 83 -17.247 18.862 3.907 488 HG SER 83 HG SER 83 -16.619 19.001 6.136 489 H ARG 84 H ARG 84 -14.982 21.842 2.074 490 HA ARG 84 HA ARG 84 -17.162 21.908 0.209 491 HB2 ARG 84 2HB ARG 84 -14.622 23.550 0.498 492 HB3 ARG 84 3HB ARG 84 -15.691 23.755 -0.877 493 HG2 ARG 84 2HG ARG 84 -16.328 25.407 0.675 494 HG3 ARG 84 3HG ARG 84 -17.606 24.211 0.627 495 HD2 ARG 84 2HD ARG 84 -17.333 24.871 2.897 496 HD3 ARG 84 3HD ARG 84 -16.686 23.247 2.790 497 HE ARG 84 HE ARG 84 -14.428 24.124 2.920 498 HH11 ARG 84 1HH1 ARG 84 -16.793 26.751 3.256 499 HH12 ARG 84 2HH1 ARG 84 -15.648 27.777 4.061 500 HH21 ARG 84 1HH2 ARG 84 -13.104 25.390 4.106 501 HH22 ARG 84 2HH2 ARG 84 -13.556 27.031 4.502 502 H LEU 85 H LEU 85 -13.857 20.554 -0.125 503 HA LEU 85 HA LEU 85 -14.322 20.130 -3.033 504 HB2 LEU 85 2HB LEU 85 -12.109 20.757 -2.365 505 HB3 LEU 85 3HB LEU 85 -12.015 19.422 -1.204 506 HG LEU 85 HG LEU 85 -11.951 17.786 -2.969 507 HD11 LEU 85 1HD1 LEU 85 -11.891 18.313 -5.367 508 HD12 LEU 85 2HD1 LEU 85 -12.208 20.027 -5.028 509 HD13 LEU 85 3HD1 LEU 85 -13.446 18.797 -4.709 510 HD21 LEU 85 1HD2 LEU 85 -9.834 18.388 -4.008 511 HD22 LEU 85 2HD2 LEU 85 -9.868 19.001 -2.340 512 HD23 LEU 85 3HD2 LEU 85 -10.131 20.116 -3.699 513 H CYS 86 H CYS 86 -13.951 18.016 -0.082 514 HA CYS 86 HA CYS 86 -14.622 15.599 -1.183 515 HB2 CYS 86 2HB CYS 86 -15.612 16.646 1.510 516 HB3 CYS 86 3HB CYS 86 -15.370 14.956 1.024 517 HG CYS 86 HG CYS 86 -13.427 15.636 2.665 518 H ALA 87 H ALA 87 -17.040 18.088 -0.161 519 HA ALA 87 HA ALA 87 -19.342 16.545 -0.905 520 HB1 ALA 87 1HB ALA 87 -20.494 18.739 -0.720 521 HB2 ALA 87 2HB ALA 87 -19.400 18.458 0.647 522 HB3 ALA 87 3HB ALA 87 -18.919 19.562 -0.657 523 H ALA 88 H ALA 88 -17.446 19.002 -2.733 524 HA ALA 88 HA ALA 88 -19.126 19.030 -5.038 525 HB1 ALA 88 1HB ALA 88 -17.529 20.819 -4.415 526 HB2 ALA 88 2HB ALA 88 -16.161 19.720 -4.712 527 HB3 ALA 88 3HB ALA 88 -17.215 20.216 -6.046 528 H THR 89 H THR 89 -16.026 17.285 -4.515 529 HA THR 89 HA THR 89 -16.048 15.885 -7.011 530 HB THR 89 HB THR 89 -14.061 16.180 -5.552 531 HG1 THR 89 HG1 THR 89 -13.309 14.103 -6.160 532 HG21 THR 89 1HG2 THR 89 -13.555 14.678 -3.774 533 HG22 THR 89 2HG2 THR 89 -15.007 13.680 -4.082 534 HG23 THR 89 3HG2 THR 89 -15.179 15.307 -3.410 535 H LYS 90 H LYS 90 -17.363 14.904 -3.827 536 HA LYS 90 HA LYS 90 -18.125 12.265 -4.474 537 HB2 LYS 90 2HB LYS 90 -18.084 13.175 -2.243 538 HB3 LYS 90 3HB LYS 90 -19.319 14.371 -2.660 539 HG2 LYS 90 2HG LYS 90 -20.690 12.042 -3.153 540 HG3 LYS 90 3HG LYS 90 -19.566 11.491 -1.902 541 HD2 LYS 90 2HD LYS 90 -21.307 13.979 -1.713 542 HD3 LYS 90 3HD LYS 90 -21.779 12.389 -1.071 543 HE2 LYS 90 2HE LYS 90 -19.711 12.392 0.365 544 HE3 LYS 90 3HE LYS 90 -19.344 14.025 -0.216 545 HZ1 LYS 90 HZ1 LYS 90 -21.799 13.260 1.279 546 HZ2 LYS 90 HZ2 LYS 90 -21.463 14.772 0.756 547 HZ3 LYS 90 HZ3 LYS 90 -20.542 14.079 1.908 548 H ARG 91 H ARG 91 -19.867 15.309 -4.956 549 HA ARG 91 HA ARG 91 -22.156 14.079 -6.222 550 HB2 ARG 91 2HB ARG 91 -21.154 16.961 -6.169 551 HB3 ARG 91 3HB ARG 91 -22.669 16.471 -6.946 552 HG2 ARG 91 2HG ARG 91 -23.612 15.683 -4.862 553 HG3 ARG 91 3HG ARG 91 -22.085 15.934 -3.997 554 HD2 ARG 91 2HD ARG 91 -22.202 18.357 -4.428 555 HD3 ARG 91 3HD ARG 91 -23.730 18.132 -5.299 556 HE ARG 91 HE ARG 91 -24.056 16.955 -2.766 557 HH11 ARG 91 1HH1 ARG 91 -23.603 20.223 -4.046 558 HH12 ARG 91 2HH1 ARG 91 -24.413 20.967 -2.703 559 HH21 ARG 91 1HH2 ARG 91 -25.078 17.994 -1.042 560 HH22 ARG 91 2HH2 ARG 91 -25.218 19.726 -1.029 561 H ALA 92 H ALA 92 -19.297 15.740 -7.639 562 HA ALA 92 HA ALA 92 -20.028 15.462 -10.370 563 HB1 ALA 92 1HB ALA 92 -17.606 15.775 -10.789 564 HB2 ALA 92 2HB ALA 92 -18.240 16.927 -9.610 565 HB3 ALA 92 3HB ALA 92 -17.274 15.536 -9.066 566 H VAL 93 H VAL 93 -18.033 13.250 -8.368 567 HA VAL 93 HA VAL 93 -17.655 11.284 -10.369 568 HB VAL 93 HB VAL 93 -17.780 10.608 -7.425 569 HG11 VAL 93 1HG1 VAL 93 -16.019 9.055 -7.971 570 HG12 VAL 93 2HG1 VAL 93 -17.283 8.826 -9.182 571 HG13 VAL 93 3HG1 VAL 93 -15.828 9.743 -9.593 572 HG21 VAL 93 1HG2 VAL 93 -15.089 11.419 -8.239 573 HG22 VAL 93 2HG2 VAL 93 -16.188 12.753 -8.421 574 HG23 VAL 93 3HG2 VAL 93 -16.087 11.944 -6.861 575 H ALA 94 H ALA 94 -20.419 11.928 -8.361 576 HA ALA 94 HA ALA 94 -21.670 9.281 -8.770 577 HB1 ALA 94 1HB ALA 94 -22.761 11.831 -7.523 578 HB2 ALA 94 2HB ALA 94 -23.547 10.244 -7.518 579 HB3 ALA 94 3HB ALA 94 -22.016 10.475 -6.652 580 H GLN 95 H GLN 95 -21.231 12.034 -10.715 581 HA GLN 95 HA GLN 95 -23.647 11.367 -12.361 582 HB2 GLN 95 2HB GLN 95 -24.080 13.696 -12.737 583 HB3 GLN 95 3HB GLN 95 -24.067 13.335 -11.013 584 HG2 GLN 95 2HG GLN 95 -22.845 15.354 -11.081 585 HG3 GLN 95 3HG GLN 95 -21.640 14.164 -11.022 586 HE21 GLN 95 1HE2 GLN 95 -20.060 14.271 -12.688 587 HE22 GLN 95 2HE2 GLN 95 -20.251 15.366 -14.065 588 H VAL 96 H VAL 96 -20.205 11.806 -12.414 589 HA VAL 96 HA VAL 96 -19.803 12.438 -15.143 590 HB VAL 96 HB VAL 96 -17.703 11.074 -14.941 591 HG11 VAL 96 1HG1 VAL 96 -17.812 13.494 -14.364 592 HG12 VAL 96 2HG1 VAL 96 -17.990 13.032 -12.653 593 HG13 VAL 96 3HG1 VAL 96 -16.541 12.589 -13.515 594 HG21 VAL 96 1HG2 VAL 96 -17.120 10.516 -12.515 595 HG22 VAL 96 2HG2 VAL 96 -18.840 10.457 -12.209 596 HG23 VAL 96 3HG2 VAL 96 -18.136 9.354 -13.407 597 H ASN 97 H ASN 97 -19.582 11.264 -17.033 598 HA ASN 97 HA ASN 97 -21.516 9.244 -17.407 599 HB2 ASN 97 2HB ASN 97 -19.274 10.213 -19.228 600 HB3 ASN 97 3HB ASN 97 -20.610 9.186 -19.741 601 HD21 ASN 97 1HD2 ASN 97 -22.856 10.075 -19.598 602 HD22 ASN 97 2HD2 ASN 97 -23.063 11.815 -19.654 603 H SER 98 H SER 98 -17.984 8.943 -17.270 604 HA SER 98 HA SER 98 -17.597 6.423 -16.274 605 HB2 SER 98 2HB SER 98 -16.947 5.090 -18.321 606 HB3 SER 98 3HB SER 98 -18.689 5.267 -18.084 607 HG SER 98 HG SER 98 -18.103 5.638 -20.259 608 H PHE 99 H PHE 99 -15.446 5.949 -16.075 609 HA PHE 99 HA PHE 99 -13.611 8.131 -16.811 610 HB2 PHE 99 2HB PHE 99 -13.099 5.668 -15.099 611 HB3 PHE 99 3HB PHE 99 -12.171 7.170 -15.148 612 HD1 PHE 99 HD1 PHE 99 -14.934 5.408 -13.607 613 HD2 PHE 99 HD2 PHE 99 -13.348 9.355 -14.394 614 HE1 PHE 99 HE1 PHE 99 -16.448 6.360 -11.909 615 HE2 PHE 99 HE2 PHE 99 -14.843 10.285 -12.656 616 HZ PHE 99 HZ PHE 99 -16.390 8.762 -11.411 617 HA PRO 100 HA PRO 100 -12.402 5.322 -20.156 618 HB2 PRO 100 2HB PRO 100 -10.854 7.000 -21.680 619 HB3 PRO 100 3HB PRO 100 -12.645 7.088 -21.650 620 HG2 PRO 100 2HG PRO 100 -10.656 8.771 -20.087 621 HG3 PRO 100 3HG PRO 100 -12.090 9.317 -21.015 622 HD2 PRO 100 2HD PRO 100 -12.157 8.943 -18.309 623 HD3 PRO 100 3HD PRO 100 -13.573 8.595 -19.342 624 H LEU 101 H LEU 101 -10.712 3.899 -20.248 625 HA LEU 101 HA LEU 101 -8.705 4.159 -18.188 626 HB2 LEU 101 2HB LEU 101 -8.779 1.958 -20.262 627 HB3 LEU 101 3HB LEU 101 -8.172 1.901 -18.611 628 HG LEU 101 HG LEU 101 -11.062 2.020 -19.498 629 HD11 LEU 101 1HD1 LEU 101 -10.007 -0.149 -19.867 630 HD12 LEU 101 2HD1 LEU 101 -11.172 -0.254 -18.535 631 HD13 LEU 101 3HD1 LEU 101 -9.435 -0.169 -18.185 632 HD21 LEU 101 1HD2 LEU 101 -11.698 1.706 -17.130 633 HD22 LEU 101 2HD2 LEU 101 -10.836 3.232 -17.334 634 HD23 LEU 101 3HD2 LEU 101 -10.007 1.822 -16.661 635 HA PRO 102 HA PRO 102 -5.285 5.411 -20.891 636 HB2 PRO 102 2HB PRO 102 -3.133 4.836 -19.356 637 HB3 PRO 102 3HB PRO 102 -4.288 6.123 -18.920 638 HG2 PRO 102 2HG PRO 102 -4.199 3.291 -17.840 639 HG3 PRO 102 3HG PRO 102 -4.325 4.821 -16.929 640 HD2 PRO 102 2HD PRO 102 -6.509 3.310 -17.600 641 HD3 PRO 102 3HD PRO 102 -6.571 5.094 -17.487 642 H LYS 103 H LYS 103 -5.463 2.154 -19.454 643 HA LYS 103 HA LYS 103 -4.620 0.880 -21.949 644 HB2 LYS 103 2HB LYS 103 -3.201 0.529 -19.287 645 HB3 LYS 103 3HB LYS 103 -3.252 -0.752 -20.477 646 HG2 LYS 103 2HG LYS 103 -1.290 0.156 -21.152 647 HG3 LYS 103 3HG LYS 103 -2.385 1.128 -22.145 648 HD2 LYS 103 2HD LYS 103 -2.373 2.676 -19.969 649 HD3 LYS 103 3HD LYS 103 -0.858 1.855 -19.636 650 HE2 LYS 103 2HE LYS 103 -1.581 3.383 -22.180 651 HE3 LYS 103 3HE LYS 103 -0.603 4.036 -20.854 652 HZ1 LYS 103 HZ1 LYS 103 0.800 3.199 -22.655 653 HZ2 LYS 103 HZ2 LYS 103 0.156 1.700 -22.537 654 HZ3 LYS 103 HZ3 LYS 103 1.059 2.313 -21.308 655 H ASP 104 H ASP 104 -5.233 -1.496 -21.892 656 HA ASP 104 HA ASP 104 -7.844 -1.735 -20.490 657 HB2 ASP 104 2HB ASP 104 -7.835 -0.853 -22.821 658 HB3 ASP 104 3HB ASP 104 -7.111 -2.368 -23.372 659 H GLN 105 H GLN 105 -5.447 -3.116 -19.520 660 HA GLN 105 HA GLN 105 -6.001 -5.928 -20.271 661 HB2 GLN 105 2HB GLN 105 -3.573 -4.770 -18.881 662 HB3 GLN 105 3HB GLN 105 -3.929 -6.480 -19.026 663 HG2 GLN 105 2HG GLN 105 -2.406 -5.924 -20.776 664 HG3 GLN 105 3HG GLN 105 -3.968 -6.304 -21.518 665 HE21 GLN 105 1HE2 GLN 105 -2.508 -3.371 -20.050 666 HE22 GLN 105 2HE2 GLN 105 -2.819 -2.331 -21.434 667 HA PRO 106 HA PRO 106 -8.104 -6.392 -16.347 668 HB2 PRO 106 2HB PRO 106 -7.779 -9.079 -15.823 669 HB3 PRO 106 3HB PRO 106 -8.855 -8.431 -17.101 670 HG2 PRO 106 2HG PRO 106 -6.008 -9.439 -17.404 671 HG3 PRO 106 3HG PRO 106 -7.456 -9.900 -18.364 672 HD2 PRO 106 2HD PRO 106 -5.719 -8.019 -19.236 673 HD3 PRO 106 3HD PRO 106 -7.479 -7.803 -19.479 674 H ASP 107 H ASP 107 -4.710 -6.712 -16.653 675 HA ASP 107 HA ASP 107 -4.165 -7.083 -13.774 676 HB2 ASP 107 2HB ASP 107 -2.580 -7.970 -15.412 677 HB3 ASP 107 3HB ASP 107 -2.387 -6.363 -16.129 678 H VAL 108 H VAL 108 -4.439 -4.441 -16.133 679 HA VAL 108 HA VAL 108 -3.562 -2.437 -14.115 680 HB VAL 108 HB VAL 108 -3.510 -0.823 -15.834 681 HG11 VAL 108 1HG1 VAL 108 -1.685 -1.685 -17.235 682 HG12 VAL 108 2HG1 VAL 108 -1.533 -2.298 -15.579 683 HG13 VAL 108 3HG1 VAL 108 -2.161 -3.361 -16.853 684 HG21 VAL 108 1HG2 VAL 108 -4.512 -2.867 -17.819 685 HG22 VAL 108 2HG2 VAL 108 -5.421 -1.460 -17.219 686 HG23 VAL 108 3HG2 VAL 108 -3.967 -1.233 -18.180 687 H VAL 109 H VAL 109 -6.524 -3.482 -15.802 688 HA VAL 109 HA VAL 109 -8.281 -1.418 -14.975 689 HB VAL 109 HB VAL 109 -8.680 -4.415 -15.232 690 HG11 VAL 109 1HG1 VAL 109 -10.834 -2.307 -14.749 691 HG12 VAL 109 2HG1 VAL 109 -11.148 -3.965 -15.314 692 HG13 VAL 109 3HG1 VAL 109 -10.464 -3.706 -13.718 693 HG21 VAL 109 1HG2 VAL 109 -9.662 -2.112 -16.972 694 HG22 VAL 109 2HG2 VAL 109 -8.192 -3.016 -17.313 695 HG23 VAL 109 3HG2 VAL 109 -9.754 -3.851 -17.344 696 H GLU 110 H GLU 110 -6.652 -3.877 -13.087 697 HA GLU 110 HA GLU 110 -8.276 -3.581 -10.707 698 HB2 GLU 110 2HB GLU 110 -5.739 -5.026 -11.241 699 HB3 GLU 110 3HB GLU 110 -6.541 -5.042 -9.681 700 HG2 GLU 110 2HG GLU 110 -7.944 -5.883 -12.266 701 HG3 GLU 110 3HG GLU 110 -7.054 -6.974 -11.220 702 H LYS 111 H LYS 111 -5.845 -1.632 -12.018 703 HA LYS 111 HA LYS 111 -4.930 -0.670 -9.353 704 HB2 LYS 111 2HB LYS 111 -3.861 -0.302 -12.162 705 HB3 LYS 111 3HB LYS 111 -3.467 0.862 -10.903 706 HG2 LYS 111 2HG LYS 111 -1.733 -0.847 -11.129 707 HG3 LYS 111 3HG LYS 111 -2.436 -0.825 -9.504 708 HD2 LYS 111 2HD LYS 111 -3.677 -2.832 -9.891 709 HD3 LYS 111 3HD LYS 111 -3.410 -2.725 -11.643 710 HE2 LYS 111 2HE LYS 111 -0.946 -3.021 -11.206 711 HE3 LYS 111 3HE LYS 111 -1.335 -3.284 -9.494 712 HZ1 LYS 111 HZ1 LYS 111 -1.128 -5.378 -10.846 713 HZ2 LYS 111 HZ2 LYS 111 -2.441 -4.937 -11.707 714 HZ3 LYS 111 HZ3 LYS 111 -2.587 -5.238 -10.109 715 H LEU 112 H LEU 112 -6.415 0.513 -12.303 716 HA LEU 112 HA LEU 112 -6.906 3.167 -11.309 717 HB2 LEU 112 2HB LEU 112 -8.173 3.450 -13.456 718 HB3 LEU 112 3HB LEU 112 -6.593 2.844 -13.607 719 HG LEU 112 HG LEU 112 -7.574 0.556 -13.660 720 HD11 LEU 112 1HD1 LEU 112 -9.785 0.848 -12.996 721 HD12 LEU 112 2HD1 LEU 112 -9.802 0.271 -14.641 722 HD13 LEU 112 3HD1 LEU 112 -10.110 1.994 -14.317 723 HD21 LEU 112 1HD2 LEU 112 -7.918 2.431 -15.988 724 HD22 LEU 112 2HD2 LEU 112 -7.904 0.646 -16.111 725 HD23 LEU 112 3HD2 LEU 112 -6.470 1.486 -15.546 726 H LYS 113 H LYS 113 -8.802 0.164 -10.945 727 HA LYS 113 HA LYS 113 -11.270 1.495 -10.482 728 HB2 LYS 113 2HB LYS 113 -11.970 -0.676 -9.644 729 HB3 LYS 113 3HB LYS 113 -11.067 -0.847 -11.158 730 HG2 LYS 113 2HG LYS 113 -8.998 -1.424 -9.832 731 HG3 LYS 113 3HG LYS 113 -9.947 -1.299 -8.338 732 HD2 LYS 113 2HD LYS 113 -10.288 -3.261 -10.597 733 HD3 LYS 113 3HD LYS 113 -9.706 -3.580 -8.932 734 HE2 LYS 113 2HE LYS 113 -12.022 -2.831 -8.175 735 HE3 LYS 113 3HE LYS 113 -12.452 -2.757 -9.890 736 HZ1 LYS 113 HZ1 LYS 113 -11.627 -5.178 -9.956 737 HZ2 LYS 113 HZ2 LYS 113 -13.073 -4.942 -9.183 738 HZ3 LYS 113 HZ3 LYS 113 -11.693 -5.175 -8.334 739 H ASN 114 H ASN 114 -8.579 0.920 -8.349 740 HA ASN 114 HA ASN 114 -10.107 2.186 -6.096 741 HB2 ASN 114 2HB ASN 114 -7.904 0.120 -5.832 742 HB3 ASN 114 3HB ASN 114 -8.801 0.893 -4.512 743 HD21 ASN 114 1HD2 ASN 114 -11.460 0.688 -5.366 744 HD22 ASN 114 2HD2 ASN 114 -11.867 -1.013 -5.506 745 H ILE 115 H ILE 115 -9.427 4.280 -6.633 746 HA ILE 115 HA ILE 115 -6.514 4.842 -6.290 747 HB ILE 115 HB ILE 115 -6.815 6.881 -7.516 748 HG12 ILE 115 2HG1 ILE 115 -9.269 7.168 -7.084 749 HG13 ILE 115 3HG1 ILE 115 -8.701 7.567 -8.655 750 HG21 ILE 115 1HG2 ILE 115 -6.993 5.826 -9.784 751 HG22 ILE 115 2HG2 ILE 115 -5.878 5.024 -8.665 752 HG23 ILE 115 3HG2 ILE 115 -7.475 4.317 -8.980 753 HD11 ILE 115 1HD1 ILE 115 -10.228 5.052 -7.968 754 HD12 ILE 115 2HD1 ILE 115 -10.786 6.461 -8.887 755 HD13 ILE 115 3HD1 ILE 115 -9.522 5.422 -9.544 756 H ASN 116 H ASN 116 -5.848 6.616 -5.116 757 HA ASN 116 HA ASN 116 -7.925 7.953 -3.453 758 HB2 ASN 116 2HB ASN 116 -5.013 8.589 -3.161 759 HB3 ASN 116 3HB ASN 116 -6.363 8.756 -2.035 760 HD21 ASN 116 1HD2 ASN 116 -7.374 6.003 -2.050 761 HD22 ASN 116 2HD2 ASN 116 -6.117 5.052 -1.300 762 H LEU 117 H LEU 117 -8.560 9.936 -3.966 763 HA LEU 117 HA LEU 117 -6.966 11.639 -5.863 764 HB2 LEU 117 2HB LEU 117 -9.703 12.167 -4.652 765 HB3 LEU 117 3HB LEU 117 -8.832 13.208 -5.772 766 HG LEU 117 HG LEU 117 -9.954 10.424 -6.375 767 HD11 LEU 117 1HD1 LEU 117 -10.850 13.192 -7.287 768 HD12 LEU 117 2HD1 LEU 117 -11.672 12.157 -6.096 769 HD13 LEU 117 3HD1 LEU 117 -11.561 11.648 -7.794 770 HD21 LEU 117 1HD2 LEU 117 -7.982 10.759 -7.774 771 HD22 LEU 117 2HD2 LEU 117 -8.507 12.402 -8.170 772 HD23 LEU 117 3HD2 LEU 117 -9.429 11.002 -8.773 773 H THR 118 H THR 118 -5.453 12.771 -4.824 774 HA THR 118 HA THR 118 -5.976 13.840 -2.101 775 HB THR 118 HB THR 118 -3.430 12.403 -2.980 776 HG1 THR 118 HG1 THR 118 -4.100 10.966 -1.363 777 HG21 THR 118 1HG2 THR 118 -4.214 13.889 -0.433 778 HG22 THR 118 2HG2 THR 118 -2.828 14.210 -1.491 779 HG23 THR 118 3HG2 THR 118 -2.859 12.737 -0.515 780 H VAL 119 H VAL 119 -5.529 15.908 -1.945 781 HA VAL 119 HA VAL 119 -3.795 17.273 -3.940 782 HB VAL 119 HB VAL 119 -5.386 18.894 -4.427 783 HG11 VAL 119 1HG1 VAL 119 -5.725 16.772 -5.691 784 HG12 VAL 119 2HG1 VAL 119 -7.009 16.326 -4.530 785 HG13 VAL 119 3HG1 VAL 119 -7.184 17.762 -5.558 786 HG21 VAL 119 1HG2 VAL 119 -7.652 19.050 -3.542 787 HG22 VAL 119 2HG2 VAL 119 -7.317 17.729 -2.399 788 HG23 VAL 119 3HG2 VAL 119 -6.459 19.280 -2.277 789 H ALA 120 H ALA 120 -3.083 19.385 -3.309 790 HA ALA 120 HA ALA 120 -3.495 20.489 -0.681 791 HB1 ALA 120 1HB ALA 120 -1.192 19.999 0.189 792 HB2 ALA 120 2HB ALA 120 -2.063 18.494 -0.114 793 HB3 ALA 120 3HB ALA 120 -0.851 19.047 -1.270 794 HA PRO 121 HA PRO 121 -1.834 24.102 -2.606 795 HB2 PRO 121 2HB PRO 121 0.000 24.577 -0.265 796 HB3 PRO 121 3HB PRO 121 -1.206 25.681 -1.007 797 HG2 PRO 121 2HG PRO 121 -1.750 24.438 1.345 798 HG3 PRO 121 3HG PRO 121 -3.010 24.522 0.073 799 HD2 PRO 121 2HD PRO 121 -1.088 22.244 0.649 800 HD3 PRO 121 3HD PRO 121 -2.868 22.184 0.480 801 H GLU 122 H GLU 122 0.055 25.104 -3.607 802 HA GLU 122 HA GLU 122 2.055 23.215 -4.489 803 HB2 GLU 122 2HB GLU 122 1.145 24.939 -5.970 804 HB3 GLU 122 3HB GLU 122 1.775 26.210 -4.919 805 HG2 GLU 122 2HG GLU 122 3.175 25.946 -6.896 806 HG3 GLU 122 3HG GLU 122 4.075 25.579 -5.433 Start of MODEL 11 1 H1 ALA 22 H ALA 22 15.490 0.185 -18.124 2 HA ALA 22 HA ALA 22 18.098 -1.143 -17.577 3 HB1 ALA 22 1HB ALA 22 17.387 1.792 -17.096 4 HB2 ALA 22 2HB ALA 22 18.907 1.009 -16.628 5 HB3 ALA 22 3HB ALA 22 18.500 1.194 -18.344 6 H ALA 23 H ALA 23 14.983 -1.146 -16.679 7 HA ALA 23 HA ALA 23 15.348 -1.745 -13.869 8 HB1 ALA 23 1HB ALA 23 13.997 0.180 -13.042 9 HB2 ALA 23 2HB ALA 23 15.556 0.678 -13.706 10 HB3 ALA 23 3HB ALA 23 14.086 0.928 -14.660 11 H ARG 24 H ARG 24 12.367 -0.206 -14.740 12 HA ARG 24 HA ARG 24 10.267 -0.892 -14.779 13 HB2 ARG 24 2HB ARG 24 11.416 -3.222 -16.322 14 HB3 ARG 24 3HB ARG 24 9.693 -3.122 -15.941 15 HG2 ARG 24 2HG ARG 24 9.487 -0.963 -17.019 16 HG3 ARG 24 3HG ARG 24 11.214 -0.952 -17.430 17 HD2 ARG 24 2HD ARG 24 10.995 -2.734 -18.956 18 HD3 ARG 24 3HD ARG 24 9.453 -3.274 -18.275 19 HE ARG 24 HE ARG 24 8.781 -0.808 -19.141 20 HH11 ARG 24 1HH1 ARG 24 10.284 -3.527 -20.845 21 HH12 ARG 24 2HH1 ARG 24 9.605 -3.033 -22.369 22 HH21 ARG 24 1HH2 ARG 24 7.924 -0.270 -21.136 23 HH22 ARG 24 2HH2 ARG 24 8.308 -1.265 -22.522 24 H GLN 25 H GLN 25 11.832 -1.383 -12.403 25 HA GLN 25 HA GLN 25 10.490 -3.769 -11.184 26 HB2 GLN 25 2HB GLN 25 12.778 -2.130 -10.055 27 HB3 GLN 25 3HB GLN 25 12.181 -3.686 -9.500 28 HG2 GLN 25 2HG GLN 25 13.575 -3.113 -12.150 29 HG3 GLN 25 3HG GLN 25 14.300 -3.889 -10.767 30 HE21 GLN 25 1HE2 GLN 25 12.925 -4.563 -13.764 31 HE22 GLN 25 2HE2 GLN 25 12.393 -6.200 -13.420 32 H GLN 26 H GLN 26 10.478 -0.317 -11.080 33 HA GLN 26 HA GLN 26 8.762 -0.236 -8.637 34 HB2 GLN 26 2HB GLN 26 10.126 1.527 -7.770 35 HB3 GLN 26 3HB GLN 26 11.126 0.121 -8.082 36 HG2 GLN 26 2HG GLN 26 10.922 2.560 -9.899 37 HG3 GLN 26 3HG GLN 26 12.185 2.294 -8.702 38 HE21 GLN 26 1HE2 GLN 26 13.638 0.361 -9.042 39 HE22 GLN 26 2HE2 GLN 26 13.920 -0.159 -10.687 40 H PHE 27 H PHE 27 9.232 0.922 -11.847 41 HA PHE 27 HA PHE 27 8.506 3.594 -11.693 42 HB2 PHE 27 2HB PHE 27 8.546 3.567 -13.970 43 HB3 PHE 27 3HB PHE 27 9.575 2.189 -13.584 44 HD1 PHE 27 HD1 PHE 27 6.479 3.349 -15.114 45 HD2 PHE 27 HD2 PHE 27 8.545 -0.161 -13.761 46 HE1 PHE 27 HE1 PHE 27 4.906 1.950 -16.414 47 HE2 PHE 27 HE2 PHE 27 7.001 -1.586 -15.090 48 HZ PHE 27 HZ PHE 27 5.192 -0.537 -16.430 49 H VAL 28 H VAL 28 6.334 1.024 -11.238 50 HA VAL 28 HA VAL 28 3.929 1.961 -12.397 51 HB VAL 28 HB VAL 28 2.767 0.722 -10.518 52 HG11 VAL 28 1HG1 VAL 28 4.892 -0.794 -12.118 53 HG12 VAL 28 2HG1 VAL 28 3.438 -1.498 -11.409 54 HG13 VAL 28 3HG1 VAL 28 3.289 -0.307 -12.706 55 HG21 VAL 28 1HG2 VAL 28 4.484 0.883 -8.753 56 HG22 VAL 28 2HG2 VAL 28 4.063 -0.794 -9.097 57 HG23 VAL 28 3HG2 VAL 28 5.583 -0.118 -9.715 58 H THR 29 H THR 29 5.536 3.042 -9.461 59 HA THR 29 HA THR 29 3.466 4.616 -8.326 60 HB THR 29 HB THR 29 5.592 4.063 -7.246 61 HG1 THR 29 HG1 THR 29 5.675 6.049 -6.190 62 HG21 THR 29 1HG2 THR 29 7.590 5.348 -7.591 63 HG22 THR 29 2HG2 THR 29 6.818 6.364 -8.825 64 HG23 THR 29 3HG2 THR 29 7.150 4.647 -9.164 65 H SER 30 H SER 30 5.665 5.395 -11.040 66 HA SER 30 HA SER 30 4.638 8.084 -11.373 67 HB2 SER 30 2HB SER 30 6.191 6.271 -13.287 68 HB3 SER 30 3HB SER 30 5.900 8.002 -13.510 69 HG SER 30 HG SER 30 7.961 7.612 -12.561 70 H GLU 31 H GLU 31 3.586 4.930 -12.567 71 HA GLU 31 HA GLU 31 1.654 6.019 -14.450 72 HB2 GLU 31 2HB GLU 31 1.895 3.312 -13.105 73 HB3 GLU 31 3HB GLU 31 0.573 3.727 -14.179 74 HG2 GLU 31 2HG GLU 31 3.363 4.239 -15.168 75 HG3 GLU 31 3HG GLU 31 2.825 2.562 -15.017 76 H VAL 32 H VAL 32 1.626 5.453 -10.883 77 HA VAL 32 HA VAL 32 -1.221 5.583 -10.561 78 HB VAL 32 HB VAL 32 0.958 6.347 -8.610 79 HG11 VAL 32 1HG1 VAL 32 -2.024 6.058 -8.111 80 HG12 VAL 32 2HG1 VAL 32 -0.783 6.132 -6.843 81 HG13 VAL 32 3HG1 VAL 32 -1.044 7.526 -7.881 82 HG21 VAL 32 1HG2 VAL 32 -0.845 3.891 -8.791 83 HG22 VAL 32 2HG2 VAL 32 0.884 3.936 -9.221 84 HG23 VAL 32 3HG2 VAL 32 0.394 4.195 -7.549 85 H GLY 33 H GLY 33 1.193 8.062 -11.038 86 HA2 GLY 33 HA2 GLY 33 -0.437 10.388 -10.405 87 HA3 GLY 33 HA3 GLY 33 1.094 10.362 -11.316 88 H ARG 34 H ARG 34 -0.455 8.266 -13.122 89 HA ARG 34 HA ARG 34 -1.926 10.251 -14.825 90 HB2 ARG 34 2HB ARG 34 -0.860 7.476 -15.468 91 HB3 ARG 34 3HB ARG 34 -1.613 8.589 -16.610 92 HG2 ARG 34 2HG ARG 34 0.248 10.181 -16.352 93 HG3 ARG 34 3HG ARG 34 0.957 9.181 -15.071 94 HD2 ARG 34 2HD ARG 34 1.132 7.306 -16.754 95 HD3 ARG 34 3HD ARG 34 0.794 8.500 -18.016 96 HE ARG 34 HE ARG 34 2.743 9.814 -16.976 97 HH11 ARG 34 1HH1 ARG 34 2.783 6.241 -16.951 98 HH12 ARG 34 2HH1 ARG 34 4.502 6.220 -16.694 99 HH21 ARG 34 1HH2 ARG 34 4.930 9.656 -16.625 100 HH22 ARG 34 2HH2 ARG 34 5.692 8.102 -16.574 101 H TYR 35 H TYR 35 -2.100 6.951 -13.552 102 HA TYR 35 HA TYR 35 -4.625 6.113 -14.333 103 HB2 TYR 35 2HB TYR 35 -2.824 5.495 -11.964 104 HB3 TYR 35 3HB TYR 35 -4.423 4.798 -12.051 105 HD1 TYR 35 HD1 TYR 35 -1.968 5.346 -14.895 106 HD2 TYR 35 HD2 TYR 35 -4.083 2.550 -12.380 107 HE1 TYR 35 HE1 TYR 35 -1.335 3.505 -16.418 108 HE2 TYR 35 HE2 TYR 35 -3.568 0.738 -13.954 109 HH TYR 35 HH TYR 35 -1.386 1.286 -16.788 110 H GLY 36 H GLY 36 -3.849 7.888 -11.336 111 HA2 GLY 36 HA2 GLY 36 -6.672 8.145 -10.581 112 HA3 GLY 36 HA3 GLY 36 -5.283 8.884 -9.762 113 H ALA 37 H ALA 37 -4.556 9.926 -12.688 114 HA ALA 37 HA ALA 37 -5.815 12.477 -12.309 115 HB1 ALA 37 1HB ALA 37 -4.489 13.209 -14.215 116 HB2 ALA 37 2HB ALA 37 -3.480 12.301 -13.069 117 HB3 ALA 37 3HB ALA 37 -4.032 11.545 -14.590 118 H ILE 38 H ILE 38 -6.348 9.675 -14.430 119 HA ILE 38 HA ILE 38 -8.068 10.957 -16.316 120 HB ILE 38 HB ILE 38 -8.700 8.805 -17.029 121 HG12 ILE 38 2HG1 ILE 38 -8.123 7.895 -14.212 122 HG13 ILE 38 3HG1 ILE 38 -9.630 7.790 -15.121 123 HG21 ILE 38 1HG2 ILE 38 -6.173 9.407 -17.128 124 HG22 ILE 38 2HG2 ILE 38 -5.965 8.152 -15.895 125 HG23 ILE 38 3HG2 ILE 38 -6.656 7.746 -17.475 126 HD11 ILE 38 1HD1 ILE 38 -8.800 5.579 -14.990 127 HD12 ILE 38 2HD1 ILE 38 -8.505 6.127 -16.634 128 HD13 ILE 38 3HD1 ILE 38 -7.157 6.079 -15.450 129 H TYR 39 H TYR 39 -8.647 9.875 -13.102 130 HA TYR 39 HA TYR 39 -11.564 10.121 -13.218 131 HB2 TYR 39 2HB TYR 39 -9.714 9.767 -10.845 132 HB3 TYR 39 3HB TYR 39 -11.456 9.647 -10.822 133 HD1 TYR 39 HD1 TYR 39 -12.637 7.788 -11.899 134 HD2 TYR 39 HD2 TYR 39 -8.370 7.847 -11.640 135 HE1 TYR 39 HE1 TYR 39 -12.520 5.469 -12.792 136 HE2 TYR 39 HE2 TYR 39 -8.248 5.406 -12.361 137 HH TYR 39 HH TYR 39 -9.537 3.643 -13.115 138 H THR 40 H THR 40 -8.906 11.883 -11.544 139 HA THR 40 HA THR 40 -10.540 13.933 -10.455 140 HB THR 40 HB THR 40 -8.158 13.130 -9.877 141 HG1 THR 40 HG1 THR 40 -7.868 15.143 -8.855 142 HG21 THR 40 1HG2 THR 40 -7.219 13.898 -12.132 143 HG22 THR 40 2HG2 THR 40 -6.291 14.296 -10.696 144 HG23 THR 40 3HG2 THR 40 -7.290 15.542 -11.487 145 H GLN 41 H GLN 41 -8.923 13.767 -13.591 146 HA GLN 41 HA GLN 41 -9.426 16.525 -14.358 147 HB2 GLN 41 2HB GLN 41 -8.663 14.011 -15.881 148 HB3 GLN 41 3HB GLN 41 -8.839 15.586 -16.653 149 HG2 GLN 41 2HG GLN 41 -6.833 14.928 -14.451 150 HG3 GLN 41 3HG GLN 41 -6.466 15.075 -16.165 151 HE21 GLN 41 1HE2 GLN 41 -5.380 16.661 -13.845 152 HE22 GLN 41 2HE2 GLN 41 -5.830 18.323 -14.189 153 H LEU 42 H LEU 42 -11.288 13.486 -14.619 154 HA LEU 42 HA LEU 42 -13.248 14.718 -16.419 155 HB2 LEU 42 2HB LEU 42 -12.802 12.235 -16.298 156 HB3 LEU 42 3HB LEU 42 -13.520 12.256 -14.677 157 HG LEU 42 HG LEU 42 -15.665 13.053 -15.631 158 HD11 LEU 42 1HD1 LEU 42 -16.047 12.922 -18.102 159 HD12 LEU 42 2HD1 LEU 42 -14.299 12.695 -18.336 160 HD13 LEU 42 3HD1 LEU 42 -14.933 14.216 -17.685 161 HD21 LEU 42 1HD2 LEU 42 -16.259 10.937 -16.830 162 HD22 LEU 42 2HD2 LEU 42 -15.419 10.712 -15.296 163 HD23 LEU 42 3HD2 LEU 42 -14.521 10.518 -16.819 164 H ILE 43 H ILE 43 -12.890 14.286 -12.907 165 HA ILE 43 HA ILE 43 -15.496 15.147 -12.169 166 HB ILE 43 HB ILE 43 -12.834 14.710 -10.807 167 HG12 ILE 43 2HG1 ILE 43 -14.305 13.373 -9.311 168 HG13 ILE 43 3HG1 ILE 43 -15.716 13.904 -10.243 169 HG21 ILE 43 1HG2 ILE 43 -15.116 16.191 -9.472 170 HG22 ILE 43 2HG2 ILE 43 -13.710 15.471 -8.650 171 HG23 ILE 43 3HG2 ILE 43 -13.466 16.826 -9.747 172 HD11 ILE 43 1HD1 ILE 43 -15.200 11.687 -10.915 173 HD12 ILE 43 2HD1 ILE 43 -14.673 12.718 -12.255 174 HD13 ILE 43 3HD1 ILE 43 -13.484 12.040 -11.095 175 H ARG 44 H ARG 44 -12.514 16.955 -12.604 176 HA ARG 44 HA ARG 44 -13.585 19.491 -11.651 177 HB2 ARG 44 2HB ARG 44 -11.512 20.434 -12.207 178 HB3 ARG 44 3HB ARG 44 -11.257 18.819 -11.551 179 HG2 ARG 44 2HG ARG 44 -9.708 18.914 -13.231 180 HG3 ARG 44 3HG ARG 44 -11.043 18.027 -13.968 181 HD2 ARG 44 2HD ARG 44 -11.703 19.989 -15.261 182 HD3 ARG 44 3HD ARG 44 -10.554 21.006 -14.367 183 HE ARG 44 HE ARG 44 -9.047 18.919 -15.485 184 HH11 ARG 44 1HH1 ARG 44 -10.931 21.609 -16.829 185 HH12 ARG 44 2HH1 ARG 44 -9.942 21.672 -18.258 186 HH21 ARG 44 1HH2 ARG 44 -7.869 19.055 -17.259 187 HH22 ARG 44 2HH2 ARG 44 -8.191 20.233 -18.507 188 H GLN 45 H GLN 45 -13.909 17.832 -14.607 189 HA GLN 45 HA GLN 45 -14.563 20.019 -16.427 190 HB2 GLN 45 2HB GLN 45 -15.949 17.329 -16.177 191 HB3 GLN 45 3HB GLN 45 -16.072 18.425 -17.542 192 HG2 GLN 45 2HG GLN 45 -13.688 16.804 -16.668 193 HG3 GLN 45 3HG GLN 45 -14.652 16.552 -18.110 194 HE21 GLN 45 1HE2 GLN 45 -11.680 17.362 -17.348 195 HE22 GLN 45 2HE2 GLN 45 -11.344 18.490 -18.652 196 H ASN 46 H ASN 46 -16.337 18.336 -13.801 197 HA ASN 46 HA ASN 46 -18.822 19.810 -14.369 198 HB2 ASN 46 2HB ASN 46 -18.101 18.237 -11.876 199 HB3 ASN 46 3HB ASN 46 -19.705 18.688 -12.438 200 HD21 ASN 46 1HD2 ASN 46 -17.209 16.324 -12.622 201 HD22 ASN 46 2HD2 ASN 46 -18.137 15.253 -13.675 202 H LEU 47 H LEU 47 -16.112 20.063 -12.099 203 HA LEU 47 HA LEU 47 -17.507 22.004 -10.410 204 HB2 LEU 47 2HB LEU 47 -14.822 20.606 -10.117 205 HB3 LEU 47 3HB LEU 47 -15.731 21.490 -8.898 206 HG LEU 47 HG LEU 47 -16.579 18.916 -10.101 207 HD11 LEU 47 1HD1 LEU 47 -15.426 19.717 -7.429 208 HD12 LEU 47 2HD1 LEU 47 -14.609 18.819 -8.726 209 HD13 LEU 47 3HD1 LEU 47 -15.974 18.070 -7.861 210 HD21 LEU 47 1HD2 LEU 47 -17.892 20.659 -7.994 211 HD22 LEU 47 2HD2 LEU 47 -18.248 18.926 -8.172 212 HD23 LEU 47 3HD2 LEU 47 -18.604 20.054 -9.498 213 H LEU 48 H LEU 48 -17.426 23.903 -11.154 214 HA LEU 48 HA LEU 48 -15.021 25.045 -12.385 215 HB2 LEU 48 2HB LEU 48 -16.591 26.869 -13.125 216 HB3 LEU 48 3HB LEU 48 -16.932 25.253 -13.700 217 HG LEU 48 HG LEU 48 -18.784 24.995 -12.151 218 HD11 LEU 48 1HD1 LEU 48 -19.648 26.934 -10.830 219 HD12 LEU 48 2HD1 LEU 48 -18.163 27.836 -11.199 220 HD13 LEU 48 3HD1 LEU 48 -18.100 26.356 -10.216 221 HD21 LEU 48 1HD2 LEU 48 -20.289 26.653 -13.193 222 HD22 LEU 48 2HD2 LEU 48 -19.151 25.985 -14.374 223 HD23 LEU 48 3HD2 LEU 48 -18.894 27.619 -13.704 224 H VAL 49 H VAL 49 -15.108 24.670 -9.545 225 HA VAL 49 HA VAL 49 -15.751 27.255 -8.392 226 HB VAL 49 HB VAL 49 -14.670 24.995 -6.734 227 HG11 VAL 49 1HG1 VAL 49 -14.933 27.188 -5.626 228 HG12 VAL 49 2HG1 VAL 49 -16.619 27.284 -6.185 229 HG13 VAL 49 3HG1 VAL 49 -16.152 26.043 -5.018 230 HG21 VAL 49 1HG2 VAL 49 -17.550 25.394 -7.685 231 HG22 VAL 49 2HG2 VAL 49 -16.510 23.994 -8.033 232 HG23 VAL 49 3HG2 VAL 49 -17.051 24.289 -6.384 233 H GLU 50 H GLU 50 -12.789 25.289 -8.275 234 HA GLU 50 HA GLU 50 -10.611 25.744 -8.449 235 HB2 GLU 50 2HB GLU 50 -11.357 28.584 -9.224 236 HB3 GLU 50 3HB GLU 50 -9.803 27.782 -9.448 237 HG2 GLU 50 2HG GLU 50 -10.916 26.081 -10.905 238 HG3 GLU 50 3HG GLU 50 -12.411 27.018 -10.795 239 H ASP 51 H ASP 51 -11.929 28.747 -6.909 240 HA ASP 51 HA ASP 51 -9.609 29.167 -5.217 241 HB2 ASP 51 2HB ASP 51 -11.209 30.942 -5.917 242 HB3 ASP 51 3HB ASP 51 -12.468 30.169 -4.941 243 H SER 52 H SER 52 -12.709 27.485 -4.702 244 HA SER 52 HA SER 52 -12.168 26.777 -1.936 245 HB2 SER 52 2HB SER 52 -14.136 25.610 -3.925 246 HB3 SER 52 3HB SER 52 -14.131 25.328 -2.179 247 HG SER 52 HG SER 52 -15.610 27.007 -2.798 248 H PHE 53 H PHE 53 -10.589 25.616 -4.674 249 HA PHE 53 HA PHE 53 -10.170 22.882 -3.569 250 HB2 PHE 53 2HB PHE 53 -9.806 23.952 -6.388 251 HB3 PHE 53 3HB PHE 53 -9.610 22.285 -5.850 252 HD1 PHE 53 HD1 PHE 53 -12.208 22.393 -4.001 253 HD2 PHE 53 HD2 PHE 53 -11.441 23.353 -8.140 254 HE1 PHE 53 HE1 PHE 53 -14.529 21.848 -4.542 255 HE2 PHE 53 HE2 PHE 53 -13.748 22.730 -8.693 256 HZ PHE 53 HZ PHE 53 -15.312 21.953 -6.910 257 H ARG 54 H ARG 54 -8.757 25.940 -3.965 258 HA ARG 54 HA ARG 54 -5.950 24.936 -3.964 259 HB2 ARG 54 2HB ARG 54 -7.165 27.605 -4.723 260 HB3 ARG 54 3HB ARG 54 -5.420 27.295 -4.634 261 HG2 ARG 54 2HG ARG 54 -5.582 25.518 -6.312 262 HG3 ARG 54 3HG ARG 54 -7.321 25.682 -6.418 263 HD2 ARG 54 2HD ARG 54 -5.338 27.905 -7.083 264 HD3 ARG 54 3HD ARG 54 -6.114 26.832 -8.280 265 HE ARG 54 HE ARG 54 -8.234 27.780 -6.860 266 HH11 ARG 54 1HH1 ARG 54 -5.689 29.397 -8.724 267 HH12 ARG 54 2HH1 ARG 54 -6.683 30.783 -9.072 268 HH21 ARG 54 1HH2 ARG 54 -9.463 29.626 -7.336 269 HH22 ARG 54 2HH2 ARG 54 -8.777 30.907 -8.300 270 H GLY 55 H GLY 55 -4.396 25.919 -2.590 271 HA2 GLY 55 HA2 GLY 55 -3.542 27.001 -0.700 272 HA3 GLY 55 HA3 GLY 55 -5.156 27.700 -0.390 273 H LYS 56 H LYS 56 -5.574 24.401 -0.666 274 HA LYS 56 HA LYS 56 -4.953 23.683 2.134 275 HB2 LYS 56 2HB LYS 56 -7.295 22.911 2.468 276 HB3 LYS 56 3HB LYS 56 -7.107 24.636 2.325 277 HG2 LYS 56 2HG LYS 56 -9.090 24.014 1.187 278 HG3 LYS 56 3HG LYS 56 -7.948 24.604 -0.002 279 HD2 LYS 56 2HD LYS 56 -7.508 22.408 -0.850 280 HD3 LYS 56 3HD LYS 56 -8.308 21.610 0.524 281 HE2 LYS 56 2HE LYS 56 -9.599 23.336 -1.611 282 HE3 LYS 56 3HE LYS 56 -9.611 21.553 -1.556 283 HZ1 LYS 56 HZ1 LYS 56 -10.837 23.249 0.561 284 HZ2 LYS 56 HZ2 LYS 56 -11.047 21.640 0.343 285 HZ3 LYS 56 HZ3 LYS 56 -11.642 22.734 -0.753 286 H GLN 57 H GLN 57 -5.934 21.236 2.382 287 HA GLN 57 HA GLN 57 -4.955 19.681 0.025 288 HB2 GLN 57 2HB GLN 57 -3.466 18.521 1.294 289 HB3 GLN 57 3HB GLN 57 -3.475 19.985 2.202 290 HG2 GLN 57 2HG GLN 57 -3.738 18.601 3.938 291 HG3 GLN 57 3HG GLN 57 -5.451 18.760 3.559 292 HE21 GLN 57 1HE2 GLN 57 -3.891 16.742 1.244 293 HE22 GLN 57 2HE2 GLN 57 -4.468 15.255 1.967 294 H CYS 58 H CYS 58 -5.858 17.480 -0.131 295 HA CYS 58 HA CYS 58 -7.966 16.668 1.691 296 HB2 CYS 58 2HB CYS 58 -9.244 18.185 0.247 297 HB3 CYS 58 3HB CYS 58 -8.566 17.415 -1.196 298 HG CYS 58 HG CYS 58 -10.358 15.868 1.137 299 H ARG 59 H ARG 59 -8.328 14.467 1.614 300 HA ARG 59 HA ARG 59 -7.261 12.896 -0.617 301 HB2 ARG 59 2HB ARG 59 -6.689 11.033 0.887 302 HB3 ARG 59 3HB ARG 59 -5.592 12.391 0.963 303 HG2 ARG 59 2HG ARG 59 -7.753 12.427 3.016 304 HG3 ARG 59 3HG ARG 59 -6.633 11.084 3.135 305 HD2 ARG 59 2HD ARG 59 -5.834 13.998 3.010 306 HD3 ARG 59 3HD ARG 59 -6.061 13.073 4.501 307 HE ARG 59 HE ARG 59 -4.257 11.621 2.883 308 HH11 ARG 59 1HH1 ARG 59 -4.198 14.702 4.636 309 HH12 ARG 59 2HH1 ARG 59 -2.528 14.493 5.102 310 HH21 ARG 59 1HH2 ARG 59 -2.098 11.485 3.427 311 HH22 ARG 59 2HH2 ARG 59 -1.344 12.745 4.362 312 H VAL 60 H VAL 60 -8.809 11.689 -1.500 313 HA VAL 60 HA VAL 60 -10.833 10.408 0.241 314 HB VAL 60 HB VAL 60 -12.701 10.922 -1.223 315 HG11 VAL 60 1HG1 VAL 60 -11.354 13.540 -0.466 316 HG12 VAL 60 2HG1 VAL 60 -13.081 13.264 -0.673 317 HG13 VAL 60 3HG1 VAL 60 -12.200 12.515 0.683 318 HG21 VAL 60 1HG2 VAL 60 -10.831 12.738 -2.797 319 HG22 VAL 60 2HG2 VAL 60 -11.500 11.195 -3.377 320 HG23 VAL 60 3HG2 VAL 60 -12.574 12.573 -3.033 321 H ASN 61 H ASN 61 -11.961 8.592 -1.090 322 HA ASN 61 HA ASN 61 -10.078 7.572 -3.127 323 HB2 ASN 61 2HB ASN 61 -9.487 6.594 -1.005 324 HB3 ASN 61 3HB ASN 61 -11.156 6.197 -0.638 325 HD21 ASN 61 1HD2 ASN 61 -12.236 4.556 -2.074 326 HD22 ASN 61 2HD2 ASN 61 -11.221 3.311 -2.784 327 H LEU 62 H LEU 62 -10.865 6.629 -4.859 328 HA LEU 62 HA LEU 62 -13.859 6.361 -5.112 329 HB2 LEU 62 2HB LEU 62 -11.601 7.040 -6.987 330 HB3 LEU 62 3HB LEU 62 -13.021 6.232 -7.627 331 HG LEU 62 HG LEU 62 -14.464 8.060 -6.897 332 HD11 LEU 62 1HD1 LEU 62 -13.419 10.236 -6.120 333 HD12 LEU 62 2HD1 LEU 62 -11.896 9.351 -5.878 334 HD13 LEU 62 3HD1 LEU 62 -13.334 8.941 -4.919 335 HD21 LEU 62 1HD2 LEU 62 -13.445 8.117 -9.129 336 HD22 LEU 62 2HD2 LEU 62 -12.009 8.940 -8.484 337 HD23 LEU 62 3HD2 LEU 62 -13.575 9.758 -8.490 338 H LYS 63 H LYS 63 -14.700 4.404 -5.276 339 HA LYS 63 HA LYS 63 -12.997 2.103 -6.148 340 HB2 LYS 63 2HB LYS 63 -15.477 2.085 -4.394 341 HB3 LYS 63 3HB LYS 63 -14.616 0.657 -4.995 342 HG2 LYS 63 2HG LYS 63 -12.533 1.554 -3.820 343 HG3 LYS 63 3HG LYS 63 -13.575 2.764 -3.052 344 HD2 LYS 63 2HD LYS 63 -13.876 -0.262 -2.800 345 HD3 LYS 63 3HD LYS 63 -13.125 0.816 -1.603 346 HE2 LYS 63 2HE LYS 63 -15.293 2.062 -1.402 347 HE3 LYS 63 3HE LYS 63 -16.044 0.900 -2.510 348 HZ1 LYS 63 HZ1 LYS 63 -15.566 -0.856 -0.921 349 HZ2 LYS 63 HZ2 LYS 63 -16.441 0.317 -0.200 350 HZ3 LYS 63 HZ3 LYS 63 -14.849 0.202 0.108 351 H LEU 64 H LEU 64 -13.326 1.957 -8.354 352 HA LEU 64 HA LEU 64 -16.063 2.370 -9.404 353 HB2 LEU 64 2HB LEU 64 -13.463 2.022 -10.913 354 HB3 LEU 64 3HB LEU 64 -15.017 2.530 -11.549 355 HG LEU 64 HG LEU 64 -13.926 4.458 -11.567 356 HD11 LEU 64 1HD1 LEU 64 -15.136 4.652 -8.805 357 HD12 LEU 64 2HD1 LEU 64 -15.924 4.903 -10.379 358 HD13 LEU 64 3HD1 LEU 64 -14.657 6.003 -9.841 359 HD21 LEU 64 1HD2 LEU 64 -12.582 3.961 -8.905 360 HD22 LEU 64 2HD2 LEU 64 -12.347 5.339 -9.986 361 HD23 LEU 64 3HD2 LEU 64 -11.868 3.728 -10.532 362 H ILE 65 H ILE 65 -16.873 1.003 -10.993 363 HA ILE 65 HA ILE 65 -16.123 -1.904 -10.800 364 HB ILE 65 HB ILE 65 -18.405 -2.257 -11.851 365 HG12 ILE 65 2HG1 ILE 65 -19.099 0.523 -10.829 366 HG13 ILE 65 3HG1 ILE 65 -18.591 0.260 -12.501 367 HG21 ILE 65 1HG2 ILE 65 -18.330 -1.010 -9.068 368 HG22 ILE 65 2HG2 ILE 65 -19.561 -2.145 -9.683 369 HG23 ILE 65 3HG2 ILE 65 -17.885 -2.688 -9.473 370 HD11 ILE 65 1HD1 ILE 65 -20.986 0.317 -12.371 371 HD12 ILE 65 2HD1 ILE 65 -20.430 -1.291 -12.874 372 HD13 ILE 65 3HD1 ILE 65 -21.000 -1.018 -11.194 373 HA PRO 66 HA PRO 66 -14.887 -1.503 -15.108 374 HB2 PRO 66 2HB PRO 66 -14.970 -4.061 -16.007 375 HB3 PRO 66 3HB PRO 66 -13.775 -3.517 -14.788 376 HG2 PRO 66 2HG PRO 66 -16.405 -4.943 -14.313 377 HG3 PRO 66 3HG PRO 66 -14.795 -5.330 -13.613 378 HD2 PRO 66 2HD PRO 66 -16.667 -3.842 -12.255 379 HD3 PRO 66 3HD PRO 66 -14.909 -3.542 -12.103 380 H THR 67 H THR 67 -15.802 -1.230 -17.109 381 HA THR 67 HA THR 67 -18.427 -2.257 -17.941 382 HB THR 67 HB THR 67 -17.910 0.690 -17.309 383 HG1 THR 67 HG1 THR 67 -18.811 -1.140 -15.844 384 HG21 THR 67 1HG2 THR 67 -20.280 -0.542 -18.785 385 HG22 THR 67 2HG2 THR 67 -19.169 0.703 -19.396 386 HG23 THR 67 3HG2 THR 67 -20.266 1.086 -18.074 387 H GLY 68 H GLY 68 -18.818 -1.625 -20.247 388 HA2 GLY 68 HA2 GLY 68 -16.495 -2.084 -21.831 389 HA3 GLY 68 HA3 GLY 68 -18.089 -1.627 -22.441 390 H THR 69 H THR 69 -17.617 0.939 -20.633 391 HA THR 69 HA THR 69 -16.223 2.579 -22.689 392 HB THR 69 HB THR 69 -17.336 4.474 -21.434 393 HG1 THR 69 HG1 THR 69 -18.999 3.791 -19.992 394 HG21 THR 69 1HG2 THR 69 -19.570 4.060 -22.323 395 HG22 THR 69 2HG2 THR 69 -19.254 2.314 -22.428 396 HG23 THR 69 3HG2 THR 69 -18.360 3.451 -23.469 397 H GLY 70 H GLY 70 -15.369 1.074 -19.834 398 HA2 GLY 70 HA2 GLY 70 -13.079 1.656 -18.898 399 HA3 GLY 70 HA3 GLY 70 -13.679 3.318 -18.812 400 H ALA 71 H ALA 71 -13.511 3.375 -16.436 401 HA ALA 71 HA ALA 71 -15.046 1.313 -14.986 402 HB1 ALA 71 1HB ALA 71 -13.765 1.854 -13.151 403 HB2 ALA 71 2HB ALA 71 -12.627 2.114 -14.451 404 HB3 ALA 71 3HB ALA 71 -13.430 3.520 -13.714 405 H LEU 72 H LEU 72 -16.641 1.866 -13.397 406 HA LEU 72 HA LEU 72 -18.026 4.512 -13.702 407 HB2 LEU 72 2HB LEU 72 -18.958 1.811 -14.337 408 HB3 LEU 72 3HB LEU 72 -19.867 2.391 -12.960 409 HG LEU 72 HG LEU 72 -20.565 4.398 -14.205 410 HD11 LEU 72 1HD1 LEU 72 -18.727 4.758 -15.679 411 HD12 LEU 72 2HD1 LEU 72 -20.124 4.399 -16.714 412 HD13 LEU 72 3HD1 LEU 72 -18.890 3.154 -16.441 413 HD21 LEU 72 1HD2 LEU 72 -21.055 1.784 -15.693 414 HD22 LEU 72 2HD2 LEU 72 -22.068 3.246 -15.780 415 HD23 LEU 72 3HD2 LEU 72 -21.941 2.346 -14.258 416 H LEU 73 H LEU 73 -18.861 5.431 -11.818 417 HA LEU 73 HA LEU 73 -17.656 4.711 -9.357 418 HB2 LEU 73 2HB LEU 73 -18.525 6.952 -10.047 419 HB3 LEU 73 3HB LEU 73 -20.156 6.398 -9.703 420 HG LEU 73 HG LEU 73 -19.023 7.845 -7.967 421 HD11 LEU 73 1HD1 LEU 73 -19.948 5.156 -6.884 422 HD12 LEU 73 2HD1 LEU 73 -20.995 6.495 -7.396 423 HD13 LEU 73 3HD1 LEU 73 -19.901 6.699 -6.022 424 HD21 LEU 73 1HD2 LEU 73 -17.379 6.965 -6.475 425 HD22 LEU 73 2HD2 LEU 73 -16.763 6.698 -8.116 426 HD23 LEU 73 3HD2 LEU 73 -17.457 5.352 -7.190 427 H GLY 74 H GLY 74 -17.823 3.008 -8.251 428 HA2 GLY 74 HA2 GLY 74 -20.397 1.572 -7.811 429 HA3 GLY 74 HA3 GLY 74 -18.758 0.996 -7.419 430 H SER 75 H SER 75 -17.771 3.313 -6.055 431 HA SER 75 HA SER 75 -19.584 4.230 -3.985 432 HB2 SER 75 2HB SER 75 -17.613 2.020 -3.383 433 HB3 SER 75 3HB SER 75 -18.010 3.226 -2.153 434 HG SER 75 HG SER 75 -19.997 1.716 -3.511 435 H LEU 76 H LEU 76 -18.654 5.872 -2.675 436 HA LEU 76 HA LEU 76 -15.834 6.621 -3.255 437 HB2 LEU 76 2HB LEU 76 -17.475 8.030 -4.515 438 HB3 LEU 76 3HB LEU 76 -18.149 8.597 -2.995 439 HG LEU 76 HG LEU 76 -15.163 8.861 -3.347 440 HD11 LEU 76 1HD1 LEU 76 -15.501 10.991 -4.645 441 HD12 LEU 76 2HD1 LEU 76 -17.197 10.515 -4.877 442 HD13 LEU 76 3HD1 LEU 76 -15.915 9.509 -5.544 443 HD21 LEU 76 1HD2 LEU 76 -17.275 10.785 -2.269 444 HD22 LEU 76 2HD2 LEU 76 -15.514 11.015 -2.202 445 HD23 LEU 76 3HD2 LEU 76 -16.263 9.708 -1.276 446 H THR 77 H THR 77 -14.670 7.029 -1.568 447 HA THR 77 HA THR 77 -15.841 7.022 1.193 448 HB THR 77 HB THR 77 -13.208 5.950 0.089 449 HG1 THR 77 HG1 THR 77 -14.165 3.969 0.771 450 HG21 THR 77 1HG2 THR 77 -12.861 5.025 2.386 451 HG22 THR 77 2HG2 THR 77 -14.260 5.974 2.954 452 HG23 THR 77 3HG2 THR 77 -12.805 6.794 2.349 453 H VAL 78 H VAL 78 -15.563 9.009 2.189 454 HA VAL 78 HA VAL 78 -13.379 10.802 1.295 455 HB VAL 78 HB VAL 78 -14.180 12.416 2.934 456 HG11 VAL 78 1HG1 VAL 78 -16.203 13.062 1.703 457 HG12 VAL 78 2HG1 VAL 78 -14.942 12.517 0.601 458 HG13 VAL 78 3HG1 VAL 78 -16.311 11.447 0.975 459 HG21 VAL 78 1HG2 VAL 78 -16.493 10.480 3.398 460 HG22 VAL 78 2HG2 VAL 78 -15.271 10.959 4.599 461 HG23 VAL 78 3HG2 VAL 78 -16.404 12.160 3.977 462 H LEU 79 H LEU 79 -11.433 11.069 2.370 463 HA LEU 79 HA LEU 79 -11.025 9.379 4.815 464 HB2 LEU 79 2HB LEU 79 -8.978 10.392 2.816 465 HB3 LEU 79 3HB LEU 79 -8.656 9.370 4.206 466 HG LEU 79 HG LEU 79 -10.425 8.562 1.833 467 HD11 LEU 79 1HD1 LEU 79 -8.133 8.941 1.081 468 HD12 LEU 79 2HD1 LEU 79 -8.480 7.200 1.120 469 HD13 LEU 79 3HD1 LEU 79 -7.499 7.927 2.403 470 HD21 LEU 79 1HD2 LEU 79 -10.923 7.293 3.909 471 HD22 LEU 79 2HD2 LEU 79 -9.200 6.913 4.088 472 HD23 LEU 79 3HD2 LEU 79 -10.116 6.269 2.709 473 H ASP 80 H ASP 80 -10.094 12.531 3.357 474 HA ASP 80 HA ASP 80 -10.843 14.032 5.634 475 HB2 ASP 80 2HB ASP 80 -8.542 12.913 6.381 476 HB3 ASP 80 3HB ASP 80 -7.852 14.099 5.281 477 H GLY 81 H GLY 81 -10.128 16.359 5.423 478 HA2 GLY 81 HA2 GLY 81 -8.565 17.625 3.677 479 HA3 GLY 81 HA3 GLY 81 -9.943 17.296 2.621 480 H ASP 82 H ASP 82 -9.635 19.721 2.598 481 HA ASP 82 HA ASP 82 -11.250 21.084 4.682 482 HB2 ASP 82 2HB ASP 82 -9.353 22.302 3.869 483 HB3 ASP 82 3HB ASP 82 -9.806 22.074 2.202 484 H SER 83 H SER 83 -13.294 20.644 4.589 485 HA SER 83 HA SER 83 -14.294 18.750 3.005 486 HB2 SER 83 2HB SER 83 -16.037 20.803 4.416 487 HB3 SER 83 3HB SER 83 -16.412 19.095 4.102 488 HG SER 83 HG SER 83 -15.687 19.429 6.274 489 H ARG 84 H ARG 84 -14.378 22.066 2.036 490 HA ARG 84 HA ARG 84 -16.550 22.170 0.223 491 HB2 ARG 84 2HB ARG 84 -13.779 23.374 -0.127 492 HB3 ARG 84 3HB ARG 84 -15.264 23.877 -0.947 493 HG2 ARG 84 2HG ARG 84 -16.245 24.596 1.208 494 HG3 ARG 84 3HG ARG 84 -14.767 24.089 2.060 495 HD2 ARG 84 2HD ARG 84 -13.435 25.701 0.712 496 HD3 ARG 84 3HD ARG 84 -14.926 26.228 -0.080 497 HE ARG 84 HE ARG 84 -15.561 27.400 1.796 498 HH11 ARG 84 1HH1 ARG 84 -12.721 25.439 2.702 499 HH12 ARG 84 2HH1 ARG 84 -12.523 26.285 4.194 500 HH21 ARG 84 1HH2 ARG 84 -15.181 28.474 3.733 501 HH22 ARG 84 2HH2 ARG 84 -13.859 27.992 4.757 502 H LEU 85 H LEU 85 -13.328 20.600 -0.182 503 HA LEU 85 HA LEU 85 -13.888 20.018 -3.025 504 HB2 LEU 85 2HB LEU 85 -11.656 20.586 -2.338 505 HB3 LEU 85 3HB LEU 85 -11.597 19.252 -1.186 506 HG LEU 85 HG LEU 85 -11.539 17.609 -2.907 507 HD11 LEU 85 1HD1 LEU 85 -11.531 18.126 -5.342 508 HD12 LEU 85 2HD1 LEU 85 -11.937 19.813 -4.985 509 HD13 LEU 85 3HD1 LEU 85 -13.092 18.518 -4.619 510 HD21 LEU 85 1HD2 LEU 85 -9.446 18.180 -3.995 511 HD22 LEU 85 2HD2 LEU 85 -9.438 18.952 -2.393 512 HD23 LEU 85 3HD2 LEU 85 -9.762 19.926 -3.831 513 H CYS 86 H CYS 86 -13.584 17.977 -0.015 514 HA CYS 86 HA CYS 86 -14.493 15.568 -0.953 515 HB2 CYS 86 2HB CYS 86 -15.475 16.863 1.640 516 HB3 CYS 86 3HB CYS 86 -15.316 15.141 1.284 517 HG CYS 86 HG CYS 86 -12.686 15.176 0.938 518 H ALA 87 H ALA 87 -16.667 18.291 -0.019 519 HA ALA 87 HA ALA 87 -19.103 16.888 -0.588 520 HB1 ALA 87 1HB ALA 87 -18.497 19.891 -0.519 521 HB2 ALA 87 2HB ALA 87 -20.108 19.152 -0.433 522 HB3 ALA 87 3HB ALA 87 -18.935 18.887 0.873 523 H ALA 88 H ALA 88 -17.117 19.071 -2.624 524 HA ALA 88 HA ALA 88 -18.995 19.129 -4.805 525 HB1 ALA 88 1HB ALA 88 -17.150 20.329 -5.933 526 HB2 ALA 88 2HB ALA 88 -17.370 20.925 -4.285 527 HB3 ALA 88 3HB ALA 88 -16.016 19.832 -4.672 528 H THR 89 H THR 89 -15.876 17.353 -4.423 529 HA THR 89 HA THR 89 -15.955 16.012 -6.939 530 HB THR 89 HB THR 89 -13.961 16.221 -5.467 531 HG1 THR 89 HG1 THR 89 -13.243 14.147 -6.095 532 HG21 THR 89 1HG2 THR 89 -15.133 15.318 -3.332 533 HG22 THR 89 2HG2 THR 89 -13.496 14.739 -3.686 534 HG23 THR 89 3HG2 THR 89 -14.916 13.713 -4.035 535 H LYS 90 H LYS 90 -17.182 14.965 -3.772 536 HA LYS 90 HA LYS 90 -18.040 12.366 -4.351 537 HB2 LYS 90 2HB LYS 90 -17.911 13.364 -2.140 538 HB3 LYS 90 3HB LYS 90 -19.112 14.590 -2.583 539 HG2 LYS 90 2HG LYS 90 -20.694 12.460 -2.876 540 HG3 LYS 90 3HG LYS 90 -19.488 11.709 -1.815 541 HD2 LYS 90 2HD LYS 90 -20.946 14.326 -1.280 542 HD3 LYS 90 3HD LYS 90 -21.428 12.741 -0.616 543 HE2 LYS 90 2HE LYS 90 -19.162 12.568 0.469 544 HE3 LYS 90 3HE LYS 90 -18.777 14.195 -0.108 545 HZ1 LYS 90 HZ1 LYS 90 -19.606 14.244 2.177 546 HZ2 LYS 90 HZ2 LYS 90 -20.998 13.498 1.754 547 HZ3 LYS 90 HZ3 LYS 90 -20.684 15.007 1.210 548 H ARG 91 H ARG 91 -19.831 15.395 -4.761 549 HA ARG 91 HA ARG 91 -22.177 14.181 -5.900 550 HB2 ARG 91 2HB ARG 91 -21.115 17.023 -5.992 551 HB3 ARG 91 3HB ARG 91 -22.704 16.569 -6.619 552 HG2 ARG 91 2HG ARG 91 -23.479 15.886 -4.443 553 HG3 ARG 91 3HG ARG 91 -21.864 16.054 -3.731 554 HD2 ARG 91 2HD ARG 91 -21.895 18.486 -4.201 555 HD3 ARG 91 3HD ARG 91 -23.532 18.338 -4.879 556 HE ARG 91 HE ARG 91 -23.647 17.214 -2.323 557 HH11 ARG 91 1HH1 ARG 91 -22.949 20.438 -3.584 558 HH12 ARG 91 2HH1 ARG 91 -23.484 21.231 -2.133 559 HH21 ARG 91 1HH2 ARG 91 -24.343 18.292 -0.480 560 HH22 ARG 91 2HH2 ARG 91 -24.289 20.021 -0.415 561 H ALA 92 H ALA 92 -19.334 15.732 -7.460 562 HA ALA 92 HA ALA 92 -20.191 15.471 -10.159 563 HB1 ALA 92 1HB ALA 92 -17.776 15.796 -10.656 564 HB2 ALA 92 2HB ALA 92 -18.400 16.951 -9.482 565 HB3 ALA 92 3HB ALA 92 -17.406 15.588 -8.929 566 H VAL 93 H VAL 93 -18.102 13.275 -8.236 567 HA VAL 93 HA VAL 93 -17.815 11.345 -10.275 568 HB VAL 93 HB VAL 93 -17.843 10.450 -7.383 569 HG11 VAL 93 1HG1 VAL 93 -15.887 9.843 -9.617 570 HG12 VAL 93 2HG1 VAL 93 -16.099 8.991 -8.065 571 HG13 VAL 93 3HG1 VAL 93 -17.340 8.876 -9.312 572 HG21 VAL 93 1HG2 VAL 93 -15.205 11.290 -7.833 573 HG22 VAL 93 2HG2 VAL 93 -16.180 12.618 -8.450 574 HG23 VAL 93 3HG2 VAL 93 -16.410 12.037 -6.792 575 H ALA 94 H ALA 94 -20.491 11.924 -8.159 576 HA ALA 94 HA ALA 94 -21.794 9.315 -8.563 577 HB1 ALA 94 1HB ALA 94 -23.596 10.293 -7.213 578 HB2 ALA 94 2HB ALA 94 -22.039 10.581 -6.440 579 HB3 ALA 94 3HB ALA 94 -22.845 11.896 -7.319 580 H GLN 95 H GLN 95 -21.374 12.039 -10.529 581 HA GLN 95 HA GLN 95 -23.832 11.376 -12.113 582 HB2 GLN 95 2HB GLN 95 -24.309 13.712 -12.417 583 HB3 GLN 95 3HB GLN 95 -24.228 13.307 -10.703 584 HG2 GLN 95 2HG GLN 95 -23.028 15.341 -10.755 585 HG3 GLN 95 3HG GLN 95 -21.814 14.163 -10.766 586 HE21 GLN 95 1HE2 GLN 95 -20.279 14.309 -12.426 587 HE22 GLN 95 2HE2 GLN 95 -20.491 15.421 -13.793 588 H VAL 96 H VAL 96 -20.401 11.856 -12.242 589 HA VAL 96 HA VAL 96 -20.104 12.509 -14.993 590 HB VAL 96 HB VAL 96 -17.953 11.232 -14.861 591 HG11 VAL 96 1HG1 VAL 96 -18.201 13.118 -12.510 592 HG12 VAL 96 2HG1 VAL 96 -16.809 12.797 -13.518 593 HG13 VAL 96 3HG1 VAL 96 -18.195 13.658 -14.209 594 HG21 VAL 96 1HG2 VAL 96 -18.940 10.580 -12.078 595 HG22 VAL 96 2HG2 VAL 96 -18.301 9.478 -13.323 596 HG23 VAL 96 3HG2 VAL 96 -17.246 10.644 -12.488 597 H ASN 97 H ASN 97 -19.815 11.256 -16.879 598 HA ASN 97 HA ASN 97 -21.636 9.083 -17.111 599 HB2 ASN 97 2HB ASN 97 -21.044 10.811 -18.863 600 HB3 ASN 97 3HB ASN 97 -19.538 9.950 -19.142 601 HD21 ASN 97 1HD2 ASN 97 -19.688 7.660 -20.031 602 HD22 ASN 97 2HD2 ASN 97 -21.142 7.245 -20.903 603 H SER 98 H SER 98 -18.046 9.070 -17.253 604 HA SER 98 HA SER 98 -17.537 6.438 -16.370 605 HB2 SER 98 2HB SER 98 -16.919 5.398 -18.610 606 HB3 SER 98 3HB SER 98 -18.645 5.520 -18.296 607 HG SER 98 HG SER 98 -17.101 7.320 -19.899 608 H PHE 99 H PHE 99 -15.390 6.030 -16.185 609 HA PHE 99 HA PHE 99 -13.567 8.244 -16.888 610 HB2 PHE 99 2HB PHE 99 -13.044 5.835 -15.121 611 HB3 PHE 99 3HB PHE 99 -12.159 7.350 -15.189 612 HD1 PHE 99 HD1 PHE 99 -14.853 5.517 -13.620 613 HD2 PHE 99 HD2 PHE 99 -13.428 9.511 -14.473 614 HE1 PHE 99 HE1 PHE 99 -16.407 6.440 -11.932 615 HE2 PHE 99 HE2 PHE 99 -14.964 10.412 -12.762 616 HZ PHE 99 HZ PHE 99 -16.456 8.847 -11.493 617 HA PRO 100 HA PRO 100 -12.232 5.306 -20.114 618 HB2 PRO 100 2HB PRO 100 -10.862 6.999 -21.760 619 HB3 PRO 100 3HB PRO 100 -12.647 6.965 -21.667 620 HG2 PRO 100 2HG PRO 100 -10.746 8.868 -20.254 621 HG3 PRO 100 3HG PRO 100 -12.228 9.269 -21.173 622 HD2 PRO 100 2HD PRO 100 -12.195 9.026 -18.444 623 HD3 PRO 100 3HD PRO 100 -13.616 8.559 -19.431 624 H LEU 101 H LEU 101 -10.477 3.975 -19.995 625 HA LEU 101 HA LEU 101 -8.409 4.576 -18.105 626 HB2 LEU 101 2HB LEU 101 -8.484 2.182 -19.940 627 HB3 LEU 101 3HB LEU 101 -7.757 2.305 -18.346 628 HG LEU 101 HG LEU 101 -10.682 2.171 -19.095 629 HD11 LEU 101 1HD1 LEU 101 -10.679 0.076 -17.822 630 HD12 LEU 101 2HD1 LEU 101 -8.967 0.294 -17.442 631 HD13 LEU 101 3HD1 LEU 101 -9.479 0.048 -19.120 632 HD21 LEU 101 1HD2 LEU 101 -11.175 2.153 -16.609 633 HD22 LEU 101 2HD2 LEU 101 -10.635 3.713 -17.217 634 HD23 LEU 101 3HD2 LEU 101 -9.496 2.691 -16.350 635 HA PRO 102 HA PRO 102 -5.165 5.684 -21.057 636 HB2 PRO 102 2HB PRO 102 -2.907 5.129 -19.599 637 HB3 PRO 102 3HB PRO 102 -3.958 6.535 -19.265 638 HG2 PRO 102 2HG PRO 102 -3.884 3.868 -17.845 639 HG3 PRO 102 3HG PRO 102 -4.007 5.504 -17.134 640 HD2 PRO 102 2HD PRO 102 -6.175 3.842 -17.551 641 HD3 PRO 102 3HD PRO 102 -6.292 5.612 -17.584 642 H LYS 103 H LYS 103 -5.037 2.574 -19.313 643 HA LYS 103 HA LYS 103 -3.837 1.143 -21.628 644 HB2 LYS 103 2HB LYS 103 -3.614 0.533 -18.654 645 HB3 LYS 103 3HB LYS 103 -2.735 -0.260 -19.966 646 HG2 LYS 103 2HG LYS 103 -2.302 2.484 -18.779 647 HG3 LYS 103 3HG LYS 103 -1.207 1.104 -18.817 648 HD2 LYS 103 2HD LYS 103 -0.877 1.377 -21.235 649 HD3 LYS 103 3HD LYS 103 -2.106 2.648 -21.254 650 HE2 LYS 103 2HE LYS 103 0.031 3.709 -21.369 651 HE3 LYS 103 3HE LYS 103 -0.712 4.081 -19.816 652 HZ1 LYS 103 HZ1 LYS 103 1.340 1.956 -20.130 653 HZ2 LYS 103 HZ2 LYS 103 0.746 2.562 -18.711 654 HZ3 LYS 103 HZ3 LYS 103 1.657 3.496 -19.650 655 H ASP 104 H ASP 104 -4.276 -1.344 -21.285 656 HA ASP 104 HA ASP 104 -7.051 -1.902 -20.460 657 HB2 ASP 104 2HB ASP 104 -7.173 -0.770 -22.679 658 HB3 ASP 104 3HB ASP 104 -6.168 -2.038 -23.371 659 H GLN 105 H GLN 105 -5.011 -3.076 -19.205 660 HA GLN 105 HA GLN 105 -5.052 -5.861 -20.256 661 HB2 GLN 105 2HB GLN 105 -2.957 -4.650 -18.444 662 HB3 GLN 105 3HB GLN 105 -3.143 -6.347 -18.788 663 HG2 GLN 105 2HG GLN 105 -1.408 -5.511 -20.198 664 HG3 GLN 105 3HG GLN 105 -2.780 -5.964 -21.219 665 HE21 GLN 105 1HE2 GLN 105 -1.978 -3.004 -19.317 666 HE22 GLN 105 2HE2 GLN 105 -2.059 -1.924 -20.704 667 HA PRO 106 HA PRO 106 -7.764 -6.604 -16.705 668 HB2 PRO 106 2HB PRO 106 -6.517 -9.353 -16.896 669 HB3 PRO 106 3HB PRO 106 -8.233 -8.908 -16.645 670 HG2 PRO 106 2HG PRO 106 -7.393 -9.646 -19.104 671 HG3 PRO 106 3HG PRO 106 -8.465 -8.220 -18.927 672 HD2 PRO 106 2HD PRO 106 -5.456 -8.263 -19.279 673 HD3 PRO 106 3HD PRO 106 -6.688 -7.234 -20.073 674 H ASP 107 H ASP 107 -4.312 -6.830 -16.573 675 HA ASP 107 HA ASP 107 -4.152 -7.413 -13.677 676 HB2 ASP 107 2HB ASP 107 -2.379 -8.191 -15.194 677 HB3 ASP 107 3HB ASP 107 -2.100 -6.537 -15.728 678 H VAL 108 H VAL 108 -4.120 -4.591 -15.860 679 HA VAL 108 HA VAL 108 -3.482 -2.775 -13.586 680 HB VAL 108 HB VAL 108 -3.146 -1.041 -15.137 681 HG11 VAL 108 1HG1 VAL 108 -1.674 -3.520 -16.111 682 HG12 VAL 108 2HG1 VAL 108 -1.132 -1.852 -16.279 683 HG13 VAL 108 3HG1 VAL 108 -1.259 -2.576 -14.659 684 HG21 VAL 108 1HG2 VAL 108 -4.775 -1.442 -16.871 685 HG22 VAL 108 2HG2 VAL 108 -3.151 -1.368 -17.589 686 HG23 VAL 108 3HG2 VAL 108 -3.931 -2.922 -17.379 687 H VAL 109 H VAL 109 -6.174 -3.630 -15.723 688 HA VAL 109 HA VAL 109 -7.984 -1.549 -15.049 689 HB VAL 109 HB VAL 109 -8.427 -4.523 -15.510 690 HG11 VAL 109 1HG1 VAL 109 -10.558 -2.338 -15.317 691 HG12 VAL 109 2HG1 VAL 109 -10.807 -3.951 -16.022 692 HG13 VAL 109 3HG1 VAL 109 -10.409 -3.806 -14.315 693 HG21 VAL 109 1HG2 VAL 109 -9.018 -2.142 -17.322 694 HG22 VAL 109 2HG2 VAL 109 -7.535 -3.078 -17.434 695 HG23 VAL 109 3HG2 VAL 109 -9.094 -3.857 -17.754 696 H GLU 110 H GLU 110 -6.640 -4.118 -13.082 697 HA GLU 110 HA GLU 110 -8.569 -3.861 -10.894 698 HB2 GLU 110 2HB GLU 110 -5.961 -5.354 -11.162 699 HB3 GLU 110 3HB GLU 110 -7.028 -5.456 -9.764 700 HG2 GLU 110 2HG GLU 110 -7.824 -6.166 -12.623 701 HG3 GLU 110 3HG GLU 110 -7.355 -7.292 -11.374 702 H LYS 111 H LYS 111 -5.917 -1.948 -11.819 703 HA LYS 111 HA LYS 111 -5.222 -1.183 -9.013 704 HB2 LYS 111 2HB LYS 111 -3.887 -0.746 -11.689 705 HB3 LYS 111 3HB LYS 111 -3.554 0.348 -10.361 706 HG2 LYS 111 2HG LYS 111 -1.888 -1.419 -10.502 707 HG3 LYS 111 3HG LYS 111 -2.712 -1.422 -8.948 708 HD2 LYS 111 2HD LYS 111 -4.020 -3.369 -9.515 709 HD3 LYS 111 3HD LYS 111 -3.586 -3.207 -11.225 710 HE2 LYS 111 2HE LYS 111 -1.190 -3.635 -10.570 711 HE3 LYS 111 3HE LYS 111 -1.745 -3.928 -8.913 712 HZ1 LYS 111 HZ1 LYS 111 -2.658 -5.471 -11.287 713 HZ2 LYS 111 HZ2 LYS 111 -3.035 -5.804 -9.734 714 HZ3 LYS 111 HZ3 LYS 111 -1.497 -5.995 -10.266 715 H LEU 112 H LEU 112 -6.348 0.207 -12.047 716 HA LEU 112 HA LEU 112 -6.688 2.866 -10.983 717 HB2 LEU 112 2HB LEU 112 -7.653 3.403 -13.241 718 HB3 LEU 112 3HB LEU 112 -6.080 2.680 -13.205 719 HG LEU 112 HG LEU 112 -7.065 0.547 -13.662 720 HD11 LEU 112 1HD1 LEU 112 -9.313 0.606 -13.143 721 HD12 LEU 112 2HD1 LEU 112 -9.222 0.350 -14.875 722 HD13 LEU 112 3HD1 LEU 112 -9.612 1.957 -14.253 723 HD21 LEU 112 1HD2 LEU 112 -5.847 1.665 -15.363 724 HD22 LEU 112 2HD2 LEU 112 -7.315 2.573 -15.859 725 HD23 LEU 112 3HD2 LEU 112 -7.185 0.812 -16.095 726 H LYS 113 H LYS 113 -8.777 0.126 -10.950 727 HA LYS 113 HA LYS 113 -11.270 1.463 -10.565 728 HB2 LYS 113 2HB LYS 113 -11.926 -0.679 -9.444 729 HB3 LYS 113 3HB LYS 113 -11.219 -0.899 -11.051 730 HG2 LYS 113 2HG LYS 113 -9.188 -1.705 -10.194 731 HG3 LYS 113 3HG LYS 113 -9.470 -1.107 -8.569 732 HD2 LYS 113 2HD LYS 113 -9.629 -3.595 -8.868 733 HD3 LYS 113 3HD LYS 113 -10.971 -2.813 -8.019 734 HE2 LYS 113 2HE LYS 113 -12.368 -2.891 -9.993 735 HE3 LYS 113 3HE LYS 113 -11.023 -3.498 -10.988 736 HZ1 LYS 113 HZ1 LYS 113 -11.006 -5.509 -9.625 737 HZ2 LYS 113 HZ2 LYS 113 -12.476 -5.312 -10.302 738 HZ3 LYS 113 HZ3 LYS 113 -12.262 -4.969 -8.715 739 H ASN 114 H ASN 114 -8.574 1.068 -8.395 740 HA ASN 114 HA ASN 114 -10.195 2.135 -6.126 741 HB2 ASN 114 2HB ASN 114 -8.017 0.073 -5.834 742 HB3 ASN 114 3HB ASN 114 -9.074 0.738 -4.584 743 HD21 ASN 114 1HD2 ASN 114 -11.565 0.476 -6.245 744 HD22 ASN 114 2HD2 ASN 114 -11.895 -1.245 -6.201 745 H ILE 115 H ILE 115 -9.426 4.227 -6.776 746 HA ILE 115 HA ILE 115 -6.536 4.739 -6.293 747 HB ILE 115 HB ILE 115 -6.762 6.836 -7.433 748 HG12 ILE 115 2HG1 ILE 115 -9.238 7.131 -7.102 749 HG13 ILE 115 3HG1 ILE 115 -8.572 7.586 -8.620 750 HG21 ILE 115 1HG2 ILE 115 -5.810 4.968 -8.586 751 HG22 ILE 115 2HG2 ILE 115 -7.407 4.359 -9.067 752 HG23 ILE 115 3HG2 ILE 115 -6.796 5.879 -9.737 753 HD11 ILE 115 1HD1 ILE 115 -9.395 5.465 -9.630 754 HD12 ILE 115 2HD1 ILE 115 -10.194 5.089 -8.090 755 HD13 ILE 115 3HD1 ILE 115 -10.663 6.525 -9.026 756 H ASN 116 H ASN 116 -5.879 6.363 -4.947 757 HA ASN 116 HA ASN 116 -7.990 7.757 -3.369 758 HB2 ASN 116 2HB ASN 116 -5.113 8.286 -2.773 759 HB3 ASN 116 3HB ASN 116 -6.543 8.280 -1.740 760 HD21 ASN 116 1HD2 ASN 116 -7.495 5.623 -1.918 761 HD22 ASN 116 2HD2 ASN 116 -6.233 4.590 -1.300 762 H LEU 117 H LEU 117 -8.563 9.680 -4.106 763 HA LEU 117 HA LEU 117 -6.719 11.283 -5.843 764 HB2 LEU 117 2HB LEU 117 -9.524 11.971 -4.896 765 HB3 LEU 117 3HB LEU 117 -8.512 12.891 -6.004 766 HG LEU 117 HG LEU 117 -9.779 10.141 -6.483 767 HD11 LEU 117 1HD1 LEU 117 -11.018 11.311 -8.251 768 HD12 LEU 117 2HD1 LEU 117 -10.213 12.836 -7.833 769 HD13 LEU 117 3HD1 LEU 117 -11.311 12.051 -6.668 770 HD21 LEU 117 1HD2 LEU 117 -8.870 10.312 -8.809 771 HD22 LEU 117 2HD2 LEU 117 -7.621 10.049 -7.584 772 HD23 LEU 117 3HD2 LEU 117 -7.857 11.672 -8.265 773 H THR 118 H THR 118 -5.194 12.192 -4.719 774 HA THR 118 HA THR 118 -5.769 13.431 -2.084 775 HB THR 118 HB THR 118 -3.372 11.695 -2.760 776 HG1 THR 118 HG1 THR 118 -4.308 10.401 -1.136 777 HG21 THR 118 1HG2 THR 118 -4.108 13.365 -0.311 778 HG22 THR 118 2HG2 THR 118 -2.632 13.469 -1.275 779 HG23 THR 118 3HG2 THR 118 -2.911 12.042 -0.271 780 H VAL 119 H VAL 119 -5.151 15.419 -1.967 781 HA VAL 119 HA VAL 119 -3.288 16.618 -3.963 782 HB VAL 119 HB VAL 119 -4.815 18.352 -4.429 783 HG11 VAL 119 1HG1 VAL 119 -6.616 17.237 -5.613 784 HG12 VAL 119 2HG1 VAL 119 -5.154 16.221 -5.711 785 HG13 VAL 119 3HG1 VAL 119 -6.465 15.810 -4.579 786 HG21 VAL 119 1HG2 VAL 119 -7.110 18.518 -3.583 787 HG22 VAL 119 2HG2 VAL 119 -6.809 17.153 -2.485 788 HG23 VAL 119 3HG2 VAL 119 -5.938 18.694 -2.287 789 H ALA 120 H ALA 120 -2.319 18.585 -3.360 790 HA ALA 120 HA ALA 120 -2.709 19.833 -0.801 791 HB1 ALA 120 1HB ALA 120 -1.495 17.797 -0.049 792 HB2 ALA 120 2HB ALA 120 -0.208 18.126 -1.221 793 HB3 ALA 120 3HB ALA 120 -0.468 19.219 0.156 794 HA PRO 121 HA PRO 121 -0.684 23.156 -2.949 795 HB2 PRO 121 2HB PRO 121 0.807 23.855 -0.439 796 HB3 PRO 121 3HB PRO 121 -0.229 24.886 -1.468 797 HG2 PRO 121 2HG PRO 121 -1.161 23.966 0.903 798 HG3 PRO 121 3HG PRO 121 -2.218 23.953 -0.552 799 HD2 PRO 121 2HD PRO 121 -0.583 21.656 0.586 800 HD3 PRO 121 3HD PRO 121 -2.301 21.683 0.110 801 H GLU 122 H GLU 122 1.478 21.166 -0.919 802 HA GLU 122 HA GLU 122 3.631 20.480 -1.071 803 HB2 GLU 122 2HB GLU 122 3.111 20.616 -4.067 804 HB3 GLU 122 3HB GLU 122 4.458 19.798 -3.279 805 HG2 GLU 122 2HG GLU 122 2.760 18.395 -2.017 806 HG3 GLU 122 3HG GLU 122 1.502 19.107 -3.031 Start of MODEL 12 1 H1 ALA 22 H ALA 22 12.571 5.403 -19.054 2 HA ALA 22 HA ALA 22 10.037 6.079 -17.885 3 HB1 ALA 22 1HB ALA 22 9.198 3.747 -17.534 4 HB2 ALA 22 2HB ALA 22 9.200 4.166 -19.250 5 HB3 ALA 22 3HB ALA 22 10.469 3.118 -18.601 6 H ALA 23 H ALA 23 12.465 3.520 -17.736 7 HA ALA 23 HA ALA 23 14.141 2.981 -16.414 8 HB1 ALA 23 1HB ALA 23 13.434 5.115 -14.433 9 HB2 ALA 23 2HB ALA 23 14.897 4.132 -14.564 10 HB3 ALA 23 3HB ALA 23 14.502 5.317 -15.855 11 H ARG 24 H ARG 24 13.813 1.146 -15.822 12 HA ARG 24 HA ARG 24 11.308 0.226 -14.803 13 HB2 ARG 24 2HB ARG 24 13.946 -1.152 -15.418 14 HB3 ARG 24 3HB ARG 24 12.513 -2.068 -14.962 15 HG2 ARG 24 2HG ARG 24 12.687 -0.237 -17.391 16 HG3 ARG 24 3HG ARG 24 12.988 -1.972 -17.394 17 HD2 ARG 24 2HD ARG 24 10.625 -2.251 -16.413 18 HD3 ARG 24 3HD ARG 24 10.343 -0.562 -16.847 19 HE ARG 24 HE ARG 24 11.342 -1.548 -19.166 20 HH11 ARG 24 1HH1 ARG 24 8.876 -3.122 -17.131 21 HH12 ARG 24 2HH1 ARG 24 8.341 -4.096 -18.494 22 HH21 ARG 24 1HH2 ARG 24 10.384 -2.689 -20.848 23 HH22 ARG 24 2HH2 ARG 24 9.120 -3.845 -20.466 24 H GLN 25 H GLN 25 13.469 1.604 -12.957 25 HA GLN 25 HA GLN 25 13.670 -0.299 -10.679 26 HB2 GLN 25 2HB GLN 25 14.781 2.517 -10.912 27 HB3 GLN 25 3HB GLN 25 15.241 1.263 -9.762 28 HG2 GLN 25 2HG GLN 25 15.802 1.377 -12.753 29 HG3 GLN 25 3HG GLN 25 16.973 1.517 -11.458 30 HE21 GLN 25 1HE2 GLN 25 15.728 -0.656 -13.732 31 HE22 GLN 25 2HE2 GLN 25 16.209 -2.134 -12.922 32 H GLN 26 H GLN 26 11.795 2.493 -11.709 33 HA GLN 26 HA GLN 26 10.096 2.216 -9.343 34 HB2 GLN 26 2HB GLN 26 10.289 4.445 -8.517 35 HB3 GLN 26 3HB GLN 26 11.833 3.616 -8.401 36 HG2 GLN 26 2HG GLN 26 11.134 5.533 -10.666 37 HG3 GLN 26 3HG GLN 26 11.828 6.073 -9.136 38 HE21 GLN 26 1HE2 GLN 26 13.971 4.795 -8.493 39 HE22 GLN 26 2HE2 GLN 26 15.073 4.559 -9.840 40 H PHE 27 H PHE 27 10.298 3.111 -12.623 41 HA PHE 27 HA PHE 27 8.704 5.252 -13.043 42 HB2 PHE 27 2HB PHE 27 8.620 4.577 -15.214 43 HB3 PHE 27 3HB PHE 27 9.938 3.574 -14.655 44 HD1 PHE 27 HD1 PHE 27 6.529 3.598 -15.912 45 HD2 PHE 27 HD2 PHE 27 9.538 1.227 -13.971 46 HE1 PHE 27 HE1 PHE 27 5.249 1.545 -16.477 47 HE2 PHE 27 HE2 PHE 27 8.282 -0.856 -14.546 48 HZ PHE 27 HZ PHE 27 6.134 -0.700 -15.810 49 H VAL 28 H VAL 28 7.369 2.290 -11.810 50 HA VAL 28 HA VAL 28 4.643 2.538 -12.625 51 HB VAL 28 HB VAL 28 4.116 1.359 -10.434 52 HG11 VAL 28 1HG1 VAL 28 5.018 -0.799 -11.237 53 HG12 VAL 28 2HG1 VAL 28 4.434 0.183 -12.600 54 HG13 VAL 28 3HG1 VAL 28 6.170 0.057 -12.283 55 HG21 VAL 28 1HG2 VAL 28 6.071 2.080 -9.086 56 HG22 VAL 28 2HG2 VAL 28 5.910 0.324 -9.164 57 HG23 VAL 28 3HG2 VAL 28 7.145 1.138 -10.143 58 H THR 29 H THR 29 6.448 4.274 -10.135 59 HA THR 29 HA THR 29 4.267 5.589 -8.859 60 HB THR 29 HB THR 29 6.651 5.537 -8.127 61 HG1 THR 29 HG1 THR 29 5.205 6.913 -7.155 62 HG21 THR 29 1HG2 THR 29 7.069 7.934 -9.962 63 HG22 THR 29 2HG2 THR 29 7.662 6.316 -10.355 64 HG23 THR 29 3HG2 THR 29 8.250 7.137 -8.897 65 H SER 30 H SER 30 5.925 6.300 -11.920 66 HA SER 30 HA SER 30 4.358 8.700 -12.425 67 HB2 SER 30 2HB SER 30 5.997 6.989 -14.361 68 HB3 SER 30 3HB SER 30 5.443 8.652 -14.617 69 HG SER 30 HG SER 30 7.621 8.639 -13.918 70 H GLU 31 H GLU 31 4.025 5.262 -13.248 71 HA GLU 31 HA GLU 31 1.732 5.631 -14.962 72 HB2 GLU 31 2HB GLU 31 2.484 3.271 -13.209 73 HB3 GLU 31 3HB GLU 31 1.125 3.293 -14.312 74 HG2 GLU 31 2HG GLU 31 3.981 3.802 -15.194 75 HG3 GLU 31 3HG GLU 31 3.191 2.205 -15.226 76 H VAL 32 H VAL 32 2.101 5.460 -11.382 77 HA VAL 32 HA VAL 32 -0.762 5.469 -10.849 78 HB VAL 32 HB VAL 32 1.617 6.238 -9.134 79 HG11 VAL 32 1HG1 VAL 32 0.050 6.236 -7.190 80 HG12 VAL 32 2HG1 VAL 32 -0.205 7.606 -8.264 81 HG13 VAL 32 3HG1 VAL 32 -1.323 6.218 -8.327 82 HG21 VAL 32 1HG2 VAL 32 1.053 4.166 -7.950 83 HG22 VAL 32 2HG2 VAL 32 -0.360 3.926 -9.003 84 HG23 VAL 32 3HG2 VAL 32 1.278 3.826 -9.672 85 H GLY 33 H GLY 33 1.592 7.933 -11.615 86 HA2 GLY 33 HA2 GLY 33 -0.036 10.276 -11.144 87 HA3 GLY 33 HA3 GLY 33 1.450 10.164 -12.124 88 H ARG 34 H ARG 34 -0.082 7.919 -13.768 89 HA ARG 34 HA ARG 34 -1.779 9.749 -15.412 90 HB2 ARG 34 2HB ARG 34 -1.008 6.875 -15.992 91 HB3 ARG 34 3HB ARG 34 -1.812 8.027 -17.056 92 HG2 ARG 34 2HG ARG 34 0.322 9.457 -16.862 93 HG3 ARG 34 3HG ARG 34 1.071 8.064 -16.066 94 HD2 ARG 34 2HD ARG 34 -0.024 8.199 -18.897 95 HD3 ARG 34 3HD ARG 34 1.661 8.084 -18.400 96 HE ARG 34 HE ARG 34 1.356 5.814 -17.725 97 HH11 ARG 34 1HH1 ARG 34 -1.436 7.041 -19.544 98 HH12 ARG 34 2HH1 ARG 34 -1.935 5.432 -19.977 99 HH21 ARG 34 1HH2 ARG 34 0.635 3.830 -18.262 100 HH22 ARG 34 2HH2 ARG 34 -0.766 3.638 -19.290 101 H TYR 35 H TYR 35 -1.905 6.576 -13.839 102 HA TYR 35 HA TYR 35 -4.470 5.720 -14.441 103 HB2 TYR 35 2HB TYR 35 -2.574 5.181 -12.146 104 HB3 TYR 35 3HB TYR 35 -4.185 4.488 -12.161 105 HD1 TYR 35 HD1 TYR 35 -1.742 4.932 -15.039 106 HD2 TYR 35 HD2 TYR 35 -3.926 2.243 -12.486 107 HE1 TYR 35 HE1 TYR 35 -1.039 3.059 -16.455 108 HE2 TYR 35 HE2 TYR 35 -3.472 0.395 -14.050 109 HH TYR 35 HH TYR 35 -1.237 0.823 -16.878 110 H GLY 36 H GLY 36 -3.567 7.632 -11.583 111 HA2 GLY 36 HA2 GLY 36 -6.338 7.994 -10.708 112 HA3 GLY 36 HA3 GLY 36 -4.889 8.726 -9.995 113 H ALA 37 H ALA 37 -4.282 9.648 -12.975 114 HA ALA 37 HA ALA 37 -5.440 12.258 -12.634 115 HB1 ALA 37 1HB ALA 37 -4.225 12.846 -14.653 116 HB2 ALA 37 2HB ALA 37 -3.183 11.957 -13.538 117 HB3 ALA 37 3HB ALA 37 -3.852 11.145 -14.976 118 H ILE 38 H ILE 38 -6.168 9.406 -14.651 119 HA ILE 38 HA ILE 38 -8.001 10.672 -16.437 120 HB ILE 38 HB ILE 38 -8.675 8.488 -17.067 121 HG12 ILE 38 2HG1 ILE 38 -7.933 7.650 -14.279 122 HG13 ILE 38 3HG1 ILE 38 -9.487 7.531 -15.084 123 HG21 ILE 38 1HG2 ILE 38 -5.867 7.865 -16.064 124 HG22 ILE 38 2HG2 ILE 38 -6.654 7.362 -17.565 125 HG23 ILE 38 3HG2 ILE 38 -6.156 9.047 -17.363 126 HD11 ILE 38 1HD1 ILE 38 -8.648 5.335 -14.909 127 HD12 ILE 38 2HD1 ILE 38 -8.492 5.783 -16.617 128 HD13 ILE 38 3HD1 ILE 38 -7.056 5.787 -15.549 129 H TYR 39 H TYR 39 -8.390 9.675 -13.181 130 HA TYR 39 HA TYR 39 -11.292 9.995 -13.136 131 HB2 TYR 39 2HB TYR 39 -9.292 9.640 -10.861 132 HB3 TYR 39 3HB TYR 39 -11.044 9.600 -10.710 133 HD1 TYR 39 HD1 TYR 39 -12.368 7.779 -11.765 134 HD2 TYR 39 HD2 TYR 39 -8.088 7.686 -11.656 135 HE1 TYR 39 HE1 TYR 39 -12.368 5.441 -12.630 136 HE2 TYR 39 HE2 TYR 39 -8.080 5.254 -12.350 137 HH TYR 39 HH TYR 39 -9.455 3.511 -12.993 138 H THR 40 H THR 40 -8.521 11.711 -11.635 139 HA THR 40 HA THR 40 -10.028 13.802 -10.467 140 HB THR 40 HB THR 40 -7.614 12.982 -10.038 141 HG1 THR 40 HG1 THR 40 -7.253 14.999 -9.058 142 HG21 THR 40 1HG2 THR 40 -5.814 14.117 -10.999 143 HG22 THR 40 2HG2 THR 40 -6.866 15.358 -11.759 144 HG23 THR 40 3HG2 THR 40 -6.835 13.695 -12.366 145 H GLN 41 H GLN 41 -8.598 13.633 -13.706 146 HA GLN 41 HA GLN 41 -9.157 16.378 -14.401 147 HB2 GLN 41 2HB GLN 41 -8.527 13.855 -15.995 148 HB3 GLN 41 3HB GLN 41 -8.746 15.434 -16.739 149 HG2 GLN 41 2HG GLN 41 -6.552 14.657 -14.759 150 HG3 GLN 41 3HG GLN 41 -6.374 15.028 -16.467 151 HE21 GLN 41 1HE2 GLN 41 -7.524 17.436 -16.924 152 HE22 GLN 41 2HE2 GLN 41 -7.018 18.630 -15.734 153 H LEU 42 H LEU 42 -11.051 13.348 -14.629 154 HA LEU 42 HA LEU 42 -13.157 14.653 -16.187 155 HB2 LEU 42 2HB LEU 42 -12.640 12.156 -16.161 156 HB3 LEU 42 3HB LEU 42 -13.291 12.142 -14.501 157 HG LEU 42 HG LEU 42 -15.495 12.877 -15.367 158 HD11 LEU 42 1HD1 LEU 42 -15.932 12.810 -17.841 159 HD12 LEU 42 2HD1 LEU 42 -14.171 12.722 -18.111 160 HD13 LEU 42 3HD1 LEU 42 -14.912 14.156 -17.362 161 HD21 LEU 42 1HD2 LEU 42 -15.177 10.524 -15.157 162 HD22 LEU 42 2HD2 LEU 42 -14.333 10.430 -16.723 163 HD23 LEU 42 3HD2 LEU 42 -16.073 10.804 -16.643 164 H ILE 43 H ILE 43 -12.481 14.213 -12.736 165 HA ILE 43 HA ILE 43 -15.097 15.099 -11.844 166 HB ILE 43 HB ILE 43 -12.444 14.485 -10.511 167 HG12 ILE 43 2HG1 ILE 43 -14.027 13.128 -9.095 168 HG13 ILE 43 3HG1 ILE 43 -15.365 13.689 -10.130 169 HG21 ILE 43 1HG2 ILE 43 -13.441 15.162 -8.338 170 HG22 ILE 43 2HG2 ILE 43 -13.134 16.563 -9.352 171 HG23 ILE 43 3HG2 ILE 43 -14.794 15.924 -9.191 172 HD11 ILE 43 1HD1 ILE 43 -14.255 12.529 -12.068 173 HD12 ILE 43 2HD1 ILE 43 -13.051 11.892 -10.896 174 HD13 ILE 43 3HD1 ILE 43 -14.755 11.467 -10.732 175 H ARG 44 H ARG 44 -11.916 16.726 -11.930 176 HA ARG 44 HA ARG 44 -12.905 19.239 -11.007 177 HB2 ARG 44 2HB ARG 44 -10.747 20.098 -11.462 178 HB3 ARG 44 3HB ARG 44 -10.560 18.423 -10.996 179 HG2 ARG 44 2HG ARG 44 -9.082 18.446 -12.702 180 HG3 ARG 44 3HG ARG 44 -10.537 17.893 -13.519 181 HD2 ARG 44 2HD ARG 44 -9.489 19.490 -14.925 182 HD3 ARG 44 3HD ARG 44 -10.948 20.230 -14.291 183 HE ARG 44 HE ARG 44 -8.148 20.828 -13.486 184 HH11 ARG 44 1HH1 ARG 44 -11.581 21.952 -13.241 185 HH12 ARG 44 2HH1 ARG 44 -10.986 23.560 -12.849 186 HH21 ARG 44 1HH2 ARG 44 -7.673 22.936 -12.875 187 HH22 ARG 44 2HH2 ARG 44 -9.010 24.062 -12.641 188 H GLN 45 H GLN 45 -13.101 17.777 -14.154 189 HA GLN 45 HA GLN 45 -13.564 20.324 -15.532 190 HB2 GLN 45 2HB GLN 45 -13.545 19.307 -17.459 191 HB3 GLN 45 3HB GLN 45 -12.512 18.274 -16.481 192 HG2 GLN 45 2HG GLN 45 -14.426 16.667 -16.297 193 HG3 GLN 45 3HG GLN 45 -15.411 17.717 -17.316 194 HE21 GLN 45 1HE2 GLN 45 -12.023 16.408 -17.345 195 HE22 GLN 45 2HE2 GLN 45 -12.031 16.139 -19.081 196 H ASN 46 H ASN 46 -15.626 18.209 -13.596 197 HA ASN 46 HA ASN 46 -18.071 19.558 -14.582 198 HB2 ASN 46 2HB ASN 46 -17.563 18.085 -11.975 199 HB3 ASN 46 3HB ASN 46 -19.116 18.620 -12.595 200 HD21 ASN 46 1HD2 ASN 46 -16.851 16.073 -12.563 201 HD22 ASN 46 2HD2 ASN 46 -17.834 15.035 -13.589 202 H LEU 47 H LEU 47 -15.641 19.890 -12.003 203 HA LEU 47 HA LEU 47 -17.298 21.748 -10.485 204 HB2 LEU 47 2HB LEU 47 -14.627 20.435 -9.925 205 HB3 LEU 47 3HB LEU 47 -15.623 21.343 -8.791 206 HG LEU 47 HG LEU 47 -16.432 18.764 -10.020 207 HD11 LEU 47 1HD1 LEU 47 -14.536 18.665 -8.521 208 HD12 LEU 47 2HD1 LEU 47 -15.958 17.919 -7.757 209 HD13 LEU 47 3HD1 LEU 47 -15.442 19.567 -7.287 210 HD21 LEU 47 1HD2 LEU 47 -18.485 19.921 -9.537 211 HD22 LEU 47 2HD2 LEU 47 -17.836 20.578 -8.026 212 HD23 LEU 47 3HD2 LEU 47 -18.205 18.845 -8.164 213 H LEU 48 H LEU 48 -17.276 23.598 -11.361 214 HA LEU 48 HA LEU 48 -14.851 24.914 -12.280 215 HB2 LEU 48 2HB LEU 48 -16.446 26.661 -13.148 216 HB3 LEU 48 3HB LEU 48 -16.648 25.033 -13.761 217 HG LEU 48 HG LEU 48 -18.605 24.656 -12.353 218 HD11 LEU 48 1HD1 LEU 48 -18.281 27.536 -11.404 219 HD12 LEU 48 2HD1 LEU 48 -18.170 26.070 -10.399 220 HD13 LEU 48 3HD1 LEU 48 -19.710 26.522 -11.132 221 HD21 LEU 48 1HD2 LEU 48 -18.751 27.250 -13.952 222 HD22 LEU 48 2HD2 LEU 48 -20.118 26.194 -13.546 223 HD23 LEU 48 3HD2 LEU 48 -18.836 25.612 -14.611 224 H VAL 49 H VAL 49 -15.014 24.499 -9.494 225 HA VAL 49 HA VAL 49 -15.763 27.070 -8.280 226 HB VAL 49 HB VAL 49 -14.773 24.720 -6.704 227 HG11 VAL 49 1HG1 VAL 49 -16.559 27.101 -6.033 228 HG12 VAL 49 2HG1 VAL 49 -16.136 25.778 -4.925 229 HG13 VAL 49 3HG1 VAL 49 -14.868 26.875 -5.520 230 HG21 VAL 49 1HG2 VAL 49 -17.638 25.313 -7.579 231 HG22 VAL 49 2HG2 VAL 49 -16.676 23.877 -8.013 232 HG23 VAL 49 3HG2 VAL 49 -17.180 24.131 -6.339 233 H GLU 50 H GLU 50 -12.963 25.036 -7.531 234 HA GLU 50 HA GLU 50 -10.756 25.282 -7.626 235 HB2 GLU 50 2HB GLU 50 -11.158 27.820 -9.223 236 HB3 GLU 50 3HB GLU 50 -9.702 26.832 -9.115 237 HG2 GLU 50 2HG GLU 50 -11.062 24.881 -10.028 238 HG3 GLU 50 3HG GLU 50 -12.359 26.023 -10.377 239 H ASP 51 H ASP 51 -12.069 28.570 -6.936 240 HA ASP 51 HA ASP 51 -9.906 29.367 -5.221 241 HB2 ASP 51 2HB ASP 51 -11.531 30.890 -6.304 242 HB3 ASP 51 3HB ASP 51 -12.806 30.274 -5.259 243 H SER 52 H SER 52 -12.984 27.702 -4.523 244 HA SER 52 HA SER 52 -12.418 27.397 -1.656 245 HB2 SER 52 2HB SER 52 -14.543 26.048 -3.357 246 HB3 SER 52 3HB SER 52 -14.488 26.128 -1.600 247 HG SER 52 HG SER 52 -15.908 27.723 -2.512 248 H PHE 53 H PHE 53 -11.062 25.865 -4.270 249 HA PHE 53 HA PHE 53 -10.691 23.248 -2.890 250 HB2 PHE 53 2HB PHE 53 -10.052 24.074 -5.732 251 HB3 PHE 53 3HB PHE 53 -9.851 22.479 -5.035 252 HD1 PHE 53 HD1 PHE 53 -11.406 23.131 -7.565 253 HD2 PHE 53 HD2 PHE 53 -12.722 22.785 -3.466 254 HE1 PHE 53 HE1 PHE 53 -13.582 22.307 -8.323 255 HE2 PHE 53 HE2 PHE 53 -14.918 22.042 -4.229 256 HZ PHE 53 HZ PHE 53 -15.368 21.752 -6.661 257 H ARG 54 H ARG 54 -9.084 26.180 -3.834 258 HA ARG 54 HA ARG 54 -6.359 25.290 -3.144 259 HB2 ARG 54 2HB ARG 54 -7.584 27.892 -4.143 260 HB3 ARG 54 3HB ARG 54 -5.884 27.742 -3.728 261 HG2 ARG 54 2HG ARG 54 -7.193 25.881 -5.752 262 HG3 ARG 54 3HG ARG 54 -6.596 27.458 -6.221 263 HD2 ARG 54 2HD ARG 54 -4.804 25.461 -4.794 264 HD3 ARG 54 3HD ARG 54 -5.067 25.404 -6.531 265 HE ARG 54 HE ARG 54 -3.917 27.769 -5.069 266 HH11 ARG 54 1HH1 ARG 54 -4.030 25.898 -8.084 267 HH12 ARG 54 2HH1 ARG 54 -2.807 26.895 -8.817 268 HH21 ARG 54 1HH2 ARG 54 -2.433 28.935 -6.004 269 HH22 ARG 54 2HH2 ARG 54 -1.917 28.654 -7.657 270 H GLY 55 H GLY 55 -5.101 26.603 -1.629 271 HA2 GLY 55 HA2 GLY 55 -4.699 27.762 0.357 272 HA3 GLY 55 HA3 GLY 55 -6.430 28.141 0.474 273 H LYS 56 H LYS 56 -6.499 24.918 0.134 274 HA LYS 56 HA LYS 56 -5.797 24.088 2.892 275 HB2 LYS 56 2HB LYS 56 -8.121 23.150 3.148 276 HB3 LYS 56 3HB LYS 56 -8.020 24.891 3.142 277 HG2 LYS 56 2HG LYS 56 -9.954 24.241 1.931 278 HG3 LYS 56 3HG LYS 56 -8.833 24.960 0.799 279 HD2 LYS 56 2HD LYS 56 -8.244 22.851 -0.155 280 HD3 LYS 56 3HD LYS 56 -9.054 21.927 1.132 281 HE2 LYS 56 2HE LYS 56 -10.312 23.724 -0.953 282 HE3 LYS 56 3HE LYS 56 -10.283 21.957 -1.015 283 HZ1 LYS 56 HZ1 LYS 56 -11.671 23.471 1.141 284 HZ2 LYS 56 HZ2 LYS 56 -11.812 21.876 0.806 285 HZ3 LYS 56 HZ3 LYS 56 -12.376 23.022 -0.250 286 H GLN 57 H GLN 57 -6.717 21.562 2.950 287 HA GLN 57 HA GLN 57 -5.674 20.230 0.472 288 HB2 GLN 57 2HB GLN 57 -4.136 19.011 1.619 289 HB3 GLN 57 3HB GLN 57 -4.125 20.427 2.600 290 HG2 GLN 57 2HG GLN 57 -4.313 18.944 4.276 291 HG3 GLN 57 3HG GLN 57 -6.038 19.095 3.950 292 HE21 GLN 57 1HE2 GLN 57 -4.499 17.232 1.494 293 HE22 GLN 57 2HE2 GLN 57 -5.055 15.695 2.144 294 H CYS 58 H CYS 58 -6.477 18.015 0.164 295 HA CYS 58 HA CYS 58 -8.537 16.987 1.950 296 HB2 CYS 58 2HB CYS 58 -9.856 18.501 0.519 297 HB3 CYS 58 3HB CYS 58 -9.130 17.782 -0.929 298 HG CYS 58 HG CYS 58 -10.846 16.090 1.382 299 H ARG 59 H ARG 59 -8.667 14.744 1.825 300 HA ARG 59 HA ARG 59 -7.517 13.400 -0.515 301 HB2 ARG 59 2HB ARG 59 -6.629 11.594 0.804 302 HB3 ARG 59 3HB ARG 59 -5.776 13.088 1.106 303 HG2 ARG 59 2HG ARG 59 -7.953 12.436 3.064 304 HG3 ARG 59 3HG ARG 59 -6.597 11.323 2.996 305 HD2 ARG 59 2HD ARG 59 -5.129 13.473 3.270 306 HD3 ARG 59 3HD ARG 59 -6.676 14.224 3.760 307 HE ARG 59 HE ARG 59 -6.081 11.685 5.076 308 HH11 ARG 59 1HH1 ARG 59 -5.552 15.186 5.412 309 HH12 ARG 59 2HH1 ARG 59 -5.218 15.035 7.113 310 HH21 ARG 59 1HH2 ARG 59 -5.645 11.592 7.256 311 HH22 ARG 59 2HH2 ARG 59 -5.222 13.038 8.125 312 H VAL 60 H VAL 60 -8.911 11.987 -1.419 313 HA VAL 60 HA VAL 60 -10.875 10.579 0.304 314 HB VAL 60 HB VAL 60 -12.779 11.005 -1.142 315 HG11 VAL 60 1HG1 VAL 60 -12.337 12.591 0.771 316 HG12 VAL 60 2HG1 VAL 60 -11.549 13.678 -0.371 317 HG13 VAL 60 3HG1 VAL 60 -13.264 13.319 -0.570 318 HG21 VAL 60 1HG2 VAL 60 -11.609 11.332 -3.294 319 HG22 VAL 60 2HG2 VAL 60 -12.762 12.641 -2.951 320 HG23 VAL 60 3HG2 VAL 60 -11.031 12.922 -2.734 321 H ASN 61 H ASN 61 -12.058 8.883 -1.234 322 HA ASN 61 HA ASN 61 -10.039 7.729 -3.005 323 HB2 ASN 61 2HB ASN 61 -9.431 6.829 -0.963 324 HB3 ASN 61 3HB ASN 61 -11.045 6.903 -0.291 325 HD21 ASN 61 1HD2 ASN 61 -10.327 5.256 -3.363 326 HD22 ASN 61 2HD2 ASN 61 -10.742 3.660 -2.749 327 H LEU 62 H LEU 62 -10.770 6.797 -4.759 328 HA LEU 62 HA LEU 62 -13.742 6.396 -5.083 329 HB2 LEU 62 2HB LEU 62 -11.478 7.183 -6.913 330 HB3 LEU 62 3HB LEU 62 -12.865 6.330 -7.566 331 HG LEU 62 HG LEU 62 -14.373 8.090 -6.847 332 HD11 LEU 62 1HD1 LEU 62 -11.878 9.494 -5.769 333 HD12 LEU 62 2HD1 LEU 62 -13.320 9.017 -4.846 334 HD13 LEU 62 3HD1 LEU 62 -13.433 10.305 -6.042 335 HD21 LEU 62 1HD2 LEU 62 -11.906 9.038 -8.375 336 HD22 LEU 62 2HD2 LEU 62 -13.478 9.845 -8.431 337 HD23 LEU 62 3HD2 LEU 62 -13.311 8.204 -9.058 338 H LYS 63 H LYS 63 -14.469 4.414 -5.259 339 HA LYS 63 HA LYS 63 -12.663 2.221 -6.211 340 HB2 LYS 63 2HB LYS 63 -14.940 2.109 -4.209 341 HB3 LYS 63 3HB LYS 63 -14.102 0.694 -4.867 342 HG2 LYS 63 2HG LYS 63 -11.934 1.604 -3.960 343 HG3 LYS 63 3HG LYS 63 -12.834 2.908 -3.192 344 HD2 LYS 63 2HD LYS 63 -13.260 -0.055 -2.625 345 HD3 LYS 63 3HD LYS 63 -12.255 1.050 -1.654 346 HE2 LYS 63 2HE LYS 63 -14.275 2.494 -1.252 347 HE3 LYS 63 3HE LYS 63 -15.254 1.307 -2.124 348 HZ1 LYS 63 HZ1 LYS 63 -15.344 0.972 0.280 349 HZ2 LYS 63 HZ2 LYS 63 -13.730 0.740 0.356 350 HZ3 LYS 63 HZ3 LYS 63 -14.675 -0.331 -0.435 351 H LEU 64 H LEU 64 -13.123 1.999 -8.375 352 HA LEU 64 HA LEU 64 -15.930 2.341 -9.265 353 HB2 LEU 64 2HB LEU 64 -13.406 2.050 -10.933 354 HB3 LEU 64 3HB LEU 64 -14.999 2.551 -11.470 355 HG LEU 64 HG LEU 64 -13.914 4.478 -11.537 356 HD11 LEU 64 1HD1 LEU 64 -15.048 4.620 -8.730 357 HD12 LEU 64 2HD1 LEU 64 -15.878 4.878 -10.279 358 HD13 LEU 64 3HD1 LEU 64 -14.614 6.000 -9.761 359 HD21 LEU 64 1HD2 LEU 64 -12.505 3.985 -8.910 360 HD22 LEU 64 2HD2 LEU 64 -12.298 5.368 -9.985 361 HD23 LEU 64 3HD2 LEU 64 -11.839 3.746 -10.552 362 H ILE 65 H ILE 65 -16.749 0.934 -10.886 363 HA ILE 65 HA ILE 65 -15.641 -1.840 -10.863 364 HB ILE 65 HB ILE 65 -18.042 -2.559 -11.437 365 HG12 ILE 65 2HG1 ILE 65 -19.786 -1.384 -10.143 366 HG13 ILE 65 3HG1 ILE 65 -18.706 -0.004 -9.910 367 HG21 ILE 65 1HG2 ILE 65 -18.447 -2.966 -9.047 368 HG22 ILE 65 2HG2 ILE 65 -16.743 -3.202 -9.447 369 HG23 ILE 65 3HG2 ILE 65 -17.253 -1.711 -8.621 370 HD11 ILE 65 1HD1 ILE 65 -20.393 0.320 -11.712 371 HD12 ILE 65 2HD1 ILE 65 -18.735 0.452 -12.304 372 HD13 ILE 65 3HD1 ILE 65 -19.670 -1.034 -12.620 373 HA PRO 66 HA PRO 66 -15.123 -1.204 -15.168 374 HB2 PRO 66 2HB PRO 66 -15.011 -3.729 -16.196 375 HB3 PRO 66 3HB PRO 66 -13.746 -3.051 -15.125 376 HG2 PRO 66 2HG PRO 66 -16.063 -4.864 -14.370 377 HG3 PRO 66 3HG PRO 66 -14.346 -5.017 -13.902 378 HD2 PRO 66 2HD PRO 66 -16.218 -3.870 -12.270 379 HD3 PRO 66 3HD PRO 66 -14.517 -3.296 -12.320 380 H THR 67 H THR 67 -16.435 -0.608 -16.776 381 HA THR 67 HA THR 67 -19.118 -1.912 -17.163 382 HB THR 67 HB THR 67 -18.253 0.993 -17.344 383 HG1 THR 67 HG1 THR 67 -18.829 -0.042 -15.338 384 HG21 THR 67 1HG2 THR 67 -19.820 0.629 -19.208 385 HG22 THR 67 2HG2 THR 67 -20.641 1.472 -17.888 386 HG23 THR 67 3HG2 THR 67 -20.932 -0.262 -18.141 387 H GLY 68 H GLY 68 -16.245 -0.573 -18.730 388 HA2 GLY 68 HA2 GLY 68 -16.286 -2.355 -20.935 389 HA3 GLY 68 HA3 GLY 68 -17.049 -0.861 -21.464 390 H THR 69 H THR 69 -15.650 0.442 -22.490 391 HA THR 69 HA THR 69 -12.778 0.567 -22.088 392 HB THR 69 HB THR 69 -13.008 2.715 -23.374 393 HG1 THR 69 HG1 THR 69 -15.063 3.183 -24.182 394 HG21 THR 69 1HG2 THR 69 -13.681 1.663 -25.484 395 HG22 THR 69 2HG2 THR 69 -14.412 0.302 -24.616 396 HG23 THR 69 3HG2 THR 69 -12.656 0.558 -24.545 397 H GLY 70 H GLY 70 -15.397 1.777 -20.239 398 HA2 GLY 70 HA2 GLY 70 -13.562 3.519 -18.674 399 HA3 GLY 70 HA3 GLY 70 -15.281 3.860 -18.883 400 H ALA 71 H ALA 71 -13.735 3.508 -16.388 401 HA ALA 71 HA ALA 71 -15.248 1.318 -15.085 402 HB1 ALA 71 1HB ALA 71 -12.837 1.932 -14.509 403 HB2 ALA 71 2HB ALA 71 -13.483 3.399 -13.762 404 HB3 ALA 71 3HB ALA 71 -13.969 1.785 -13.175 405 H LEU 72 H LEU 72 -16.712 1.908 -13.299 406 HA LEU 72 HA LEU 72 -18.021 4.601 -13.460 407 HB2 LEU 72 2HB LEU 72 -19.137 2.016 -14.197 408 HB3 LEU 72 3HB LEU 72 -19.923 2.541 -12.730 409 HG LEU 72 HG LEU 72 -20.550 4.681 -13.784 410 HD11 LEU 72 1HD1 LEU 72 -19.187 3.462 -16.225 411 HD12 LEU 72 2HD1 LEU 72 -18.846 5.012 -15.421 412 HD13 LEU 72 3HD1 LEU 72 -20.365 4.790 -16.311 413 HD21 LEU 72 1HD2 LEU 72 -22.082 2.741 -13.816 414 HD22 LEU 72 2HD2 LEU 72 -21.366 2.194 -15.346 415 HD23 LEU 72 3HD2 LEU 72 -22.272 3.717 -15.285 416 H LEU 73 H LEU 73 -18.825 5.421 -11.543 417 HA LEU 73 HA LEU 73 -17.560 4.701 -9.150 418 HB2 LEU 73 2HB LEU 73 -18.519 6.910 -9.840 419 HB3 LEU 73 3HB LEU 73 -20.108 6.318 -9.420 420 HG LEU 73 HG LEU 73 -18.952 7.824 -7.754 421 HD11 LEU 73 1HD1 LEU 73 -19.673 6.681 -5.758 422 HD12 LEU 73 2HD1 LEU 73 -19.703 5.120 -6.586 423 HD13 LEU 73 3HD1 LEU 73 -20.845 6.398 -7.063 424 HD21 LEU 73 1HD2 LEU 73 -17.257 5.386 -7.036 425 HD22 LEU 73 2HD2 LEU 73 -17.180 7.004 -6.344 426 HD23 LEU 73 3HD2 LEU 73 -16.659 6.744 -8.011 427 H GLY 74 H GLY 74 -17.636 2.915 -8.130 428 HA2 GLY 74 HA2 GLY 74 -20.162 1.453 -7.554 429 HA3 GLY 74 HA3 GLY 74 -18.492 0.941 -7.183 430 H SER 75 H SER 75 -17.444 3.142 -5.855 431 HA SER 75 HA SER 75 -19.256 3.993 -3.700 432 HB2 SER 75 2HB SER 75 -16.965 2.066 -3.204 433 HB3 SER 75 3HB SER 75 -17.648 3.097 -1.943 434 HG SER 75 HG SER 75 -18.586 1.010 -1.924 435 H LEU 76 H LEU 76 -18.412 5.735 -2.512 436 HA LEU 76 HA LEU 76 -15.660 6.670 -3.182 437 HB2 LEU 76 2HB LEU 76 -17.438 7.948 -4.392 438 HB3 LEU 76 3HB LEU 76 -18.098 8.476 -2.859 439 HG LEU 76 HG LEU 76 -15.149 8.936 -3.317 440 HD11 LEU 76 1HD1 LEU 76 -15.988 9.513 -5.490 441 HD12 LEU 76 2HD1 LEU 76 -15.643 11.011 -4.620 442 HD13 LEU 76 3HD1 LEU 76 -17.330 10.434 -4.804 443 HD21 LEU 76 1HD2 LEU 76 -17.361 10.683 -2.153 444 HD22 LEU 76 2HD2 LEU 76 -15.640 11.093 -2.198 445 HD23 LEU 76 3HD2 LEU 76 -16.196 9.729 -1.218 446 H THR 77 H THR 77 -14.453 6.707 -1.457 447 HA THR 77 HA THR 77 -15.628 6.850 1.296 448 HB THR 77 HB THR 77 -12.952 5.864 0.209 449 HG1 THR 77 HG1 THR 77 -13.830 3.875 0.990 450 HG21 THR 77 1HG2 THR 77 -14.033 5.849 3.077 451 HG22 THR 77 2HG2 THR 77 -12.656 6.807 2.488 452 HG23 THR 77 3HG2 THR 77 -12.547 5.051 2.525 453 H VAL 78 H VAL 78 -15.504 8.858 2.204 454 HA VAL 78 HA VAL 78 -13.411 10.768 1.328 455 HB VAL 78 HB VAL 78 -14.297 12.331 2.989 456 HG11 VAL 78 1HG1 VAL 78 -15.039 12.403 0.645 457 HG12 VAL 78 2HG1 VAL 78 -16.353 11.262 1.004 458 HG13 VAL 78 3HG1 VAL 78 -16.347 12.881 1.735 459 HG21 VAL 78 1HG2 VAL 78 -15.344 10.834 4.629 460 HG22 VAL 78 2HG2 VAL 78 -16.516 11.986 3.983 461 HG23 VAL 78 3HG2 VAL 78 -16.535 10.305 3.413 462 H LEU 79 H LEU 79 -11.453 11.058 2.376 463 HA LEU 79 HA LEU 79 -10.969 9.331 4.782 464 HB2 LEU 79 2HB LEU 79 -9.029 10.536 2.795 465 HB3 LEU 79 3HB LEU 79 -8.595 9.519 4.157 466 HG LEU 79 HG LEU 79 -10.335 8.631 1.798 467 HD11 LEU 79 1HD1 LEU 79 -8.296 7.431 1.040 468 HD12 LEU 79 2HD1 LEU 79 -7.367 8.189 2.341 469 HD13 LEU 79 3HD1 LEU 79 -8.073 9.192 1.053 470 HD21 LEU 79 1HD2 LEU 79 -10.725 7.307 3.859 471 HD22 LEU 79 2HD2 LEU 79 -8.983 7.016 4.011 472 HD23 LEU 79 3HD2 LEU 79 -9.893 6.355 2.637 473 H ASP 80 H ASP 80 -10.265 12.607 3.471 474 HA ASP 80 HA ASP 80 -11.226 13.929 5.766 475 HB2 ASP 80 2HB ASP 80 -8.877 13.027 6.610 476 HB3 ASP 80 3HB ASP 80 -8.240 14.290 5.558 477 H GLY 81 H GLY 81 -10.698 16.344 5.669 478 HA2 GLY 81 HA2 GLY 81 -9.215 17.785 3.982 479 HA3 GLY 81 HA3 GLY 81 -10.553 17.381 2.908 480 H ASP 82 H ASP 82 -10.331 19.854 3.030 481 HA ASP 82 HA ASP 82 -12.125 21.014 5.095 482 HB2 ASP 82 2HB ASP 82 -10.243 22.377 4.412 483 HB3 ASP 82 3HB ASP 82 -10.654 22.208 2.728 484 H SER 83 H SER 83 -14.193 20.687 4.832 485 HA SER 83 HA SER 83 -14.996 18.728 3.100 486 HB2 SER 83 2HB SER 83 -17.265 19.061 4.048 487 HB3 SER 83 3HB SER 83 -15.980 19.043 5.261 488 HG SER 83 HG SER 83 -17.489 20.761 5.628 489 H ARG 84 H ARG 84 -15.180 22.089 2.340 490 HA ARG 84 HA ARG 84 -17.201 22.228 0.383 491 HB2 ARG 84 2HB ARG 84 -14.419 23.491 0.325 492 HB3 ARG 84 3HB ARG 84 -15.795 23.992 -0.657 493 HG2 ARG 84 2HG ARG 84 -17.048 24.605 1.397 494 HG3 ARG 84 3HG ARG 84 -15.680 24.090 2.397 495 HD2 ARG 84 2HD ARG 84 -14.218 25.771 1.237 496 HD3 ARG 84 3HD ARG 84 -15.639 26.318 0.334 497 HE ARG 84 HE ARG 84 -16.461 27.396 2.197 498 HH11 ARG 84 1HH1 ARG 84 -13.697 25.405 3.260 499 HH12 ARG 84 2HH1 ARG 84 -13.628 26.201 4.792 500 HH21 ARG 84 1HH2 ARG 84 -16.318 28.338 4.226 501 HH22 ARG 84 2HH2 ARG 84 -15.074 27.831 5.331 502 H LEU 85 H LEU 85 -13.961 20.665 0.151 503 HA LEU 85 HA LEU 85 -14.319 20.180 -2.743 504 HB2 LEU 85 2HB LEU 85 -12.172 20.827 -1.915 505 HB3 LEU 85 3HB LEU 85 -12.112 19.475 -0.786 506 HG LEU 85 HG LEU 85 -11.796 17.886 -2.508 507 HD11 LEU 85 1HD1 LEU 85 -13.371 18.623 -4.276 508 HD12 LEU 85 2HD1 LEU 85 -11.756 18.369 -4.931 509 HD13 LEU 85 3HD1 LEU 85 -12.334 20.016 -4.628 510 HD21 LEU 85 1HD2 LEU 85 -9.886 19.516 -1.917 511 HD22 LEU 85 2HD2 LEU 85 -10.233 20.344 -3.432 512 HD23 LEU 85 3HD2 LEU 85 -9.715 18.645 -3.457 513 H CYS 86 H CYS 86 -13.997 17.989 0.170 514 HA CYS 86 HA CYS 86 -14.825 15.616 -0.813 515 HB2 CYS 86 2HB CYS 86 -15.990 16.834 1.736 516 HB3 CYS 86 3HB CYS 86 -15.740 15.121 1.367 517 HG CYS 86 HG CYS 86 -13.087 15.293 1.179 518 H ALA 87 H ALA 87 -17.167 18.246 0.044 519 HA ALA 87 HA ALA 87 -19.502 16.704 -0.684 520 HB1 ALA 87 1HB ALA 87 -19.052 19.720 -0.480 521 HB2 ALA 87 2HB ALA 87 -20.629 18.908 -0.523 522 HB3 ALA 87 3HB ALA 87 -19.536 18.639 0.849 523 H ALA 88 H ALA 88 -17.481 18.978 -2.567 524 HA ALA 88 HA ALA 88 -19.227 19.039 -4.861 525 HB1 ALA 88 1HB ALA 88 -17.330 20.273 -5.861 526 HB2 ALA 88 2HB ALA 88 -17.647 20.857 -4.225 527 HB3 ALA 88 3HB ALA 88 -16.270 19.779 -4.530 528 H THR 89 H THR 89 -16.091 17.342 -4.288 529 HA THR 89 HA THR 89 -15.986 15.974 -6.790 530 HB THR 89 HB THR 89 -14.075 16.239 -5.259 531 HG1 THR 89 HG1 THR 89 -13.301 14.150 -5.752 532 HG21 THR 89 1HG2 THR 89 -13.685 14.855 -3.384 533 HG22 THR 89 2HG2 THR 89 -15.080 13.798 -3.731 534 HG23 THR 89 3HG2 THR 89 -15.325 15.443 -3.130 535 H LYS 90 H LYS 90 -17.361 14.932 -3.683 536 HA LYS 90 HA LYS 90 -18.137 12.313 -4.302 537 HB2 LYS 90 2HB LYS 90 -18.154 13.297 -2.094 538 HB3 LYS 90 3HB LYS 90 -19.352 14.495 -2.601 539 HG2 LYS 90 2HG LYS 90 -20.861 12.337 -2.998 540 HG3 LYS 90 3HG LYS 90 -19.695 11.592 -1.879 541 HD2 LYS 90 2HD LYS 90 -21.229 14.179 -1.403 542 HD3 LYS 90 3HD LYS 90 -21.739 12.590 -0.784 543 HE2 LYS 90 2HE LYS 90 -19.563 12.403 0.458 544 HE3 LYS 90 3HE LYS 90 -19.129 14.023 -0.090 545 HZ1 LYS 90 HZ1 LYS 90 -21.089 14.862 1.114 546 HZ2 LYS 90 HZ2 LYS 90 -20.110 14.039 2.140 547 HZ3 LYS 90 HZ3 LYS 90 -21.486 13.353 1.603 548 H ARG 91 H ARG 91 -19.959 15.309 -4.801 549 HA ARG 91 HA ARG 91 -22.203 14.035 -6.097 550 HB2 ARG 91 2HB ARG 91 -21.270 16.929 -6.047 551 HB3 ARG 91 3HB ARG 91 -22.767 16.399 -6.814 552 HG2 ARG 91 2HG ARG 91 -23.659 15.570 -4.698 553 HG3 ARG 91 3HG ARG 91 -22.139 15.911 -3.871 554 HD2 ARG 91 2HD ARG 91 -23.610 17.671 -3.301 555 HD3 ARG 91 3HD ARG 91 -22.427 18.345 -4.427 556 HE ARG 91 HE ARG 91 -25.287 17.644 -4.998 557 HH11 ARG 91 1HH1 ARG 91 -22.421 19.433 -6.066 558 HH12 ARG 91 2HH1 ARG 91 -23.299 20.249 -7.320 559 HH21 ARG 91 1HH2 ARG 91 -26.337 18.718 -6.652 560 HH22 ARG 91 2HH2 ARG 91 -25.477 19.844 -7.648 561 H ALA 92 H ALA 92 -19.336 15.716 -7.472 562 HA ALA 92 HA ALA 92 -20.023 15.479 -10.219 563 HB1 ALA 92 1HB ALA 92 -17.298 15.557 -8.851 564 HB2 ALA 92 2HB ALA 92 -17.577 15.745 -10.589 565 HB3 ALA 92 3HB ALA 92 -18.249 16.925 -9.470 566 H VAL 93 H VAL 93 -18.077 13.242 -8.192 567 HA VAL 93 HA VAL 93 -17.700 11.301 -10.224 568 HB VAL 93 HB VAL 93 -17.785 10.509 -7.319 569 HG11 VAL 93 1HG1 VAL 93 -15.841 9.795 -9.529 570 HG12 VAL 93 2HG1 VAL 93 -15.998 9.042 -7.931 571 HG13 VAL 93 3HG1 VAL 93 -17.262 8.824 -9.132 572 HG21 VAL 93 1HG2 VAL 93 -16.144 12.672 -8.362 573 HG22 VAL 93 2HG2 VAL 93 -16.271 12.027 -6.733 574 HG23 VAL 93 3HG2 VAL 93 -15.115 11.333 -7.874 575 H ALA 94 H ALA 94 -20.453 11.904 -8.227 576 HA ALA 94 HA ALA 94 -21.714 9.277 -8.675 577 HB1 ALA 94 1HB ALA 94 -22.057 10.537 -6.566 578 HB2 ALA 94 2HB ALA 94 -22.837 11.853 -7.474 579 HB3 ALA 94 3HB ALA 94 -23.584 10.251 -7.422 580 H GLN 95 H GLN 95 -21.232 12.033 -10.605 581 HA GLN 95 HA GLN 95 -23.612 11.376 -12.303 582 HB2 GLN 95 2HB GLN 95 -24.071 13.696 -12.642 583 HB3 GLN 95 3HB GLN 95 -24.051 13.329 -10.921 584 HG2 GLN 95 2HG GLN 95 -22.849 15.342 -10.946 585 HG3 GLN 95 3HG GLN 95 -21.629 14.169 -10.915 586 HE21 GLN 95 1HE2 GLN 95 -20.048 14.336 -12.514 587 HE22 GLN 95 2HE2 GLN 95 -20.205 15.421 -13.898 588 H VAL 96 H VAL 96 -20.188 11.822 -12.281 589 HA VAL 96 HA VAL 96 -19.688 12.503 -14.970 590 HB VAL 96 HB VAL 96 -17.653 11.026 -14.768 591 HG11 VAL 96 1HG1 VAL 96 -16.450 12.455 -13.265 592 HG12 VAL 96 2HG1 VAL 96 -17.657 13.427 -14.140 593 HG13 VAL 96 3HG1 VAL 96 -17.922 12.942 -12.448 594 HG21 VAL 96 1HG2 VAL 96 -17.122 10.356 -12.374 595 HG22 VAL 96 2HG2 VAL 96 -18.843 10.414 -12.072 596 HG23 VAL 96 3HG2 VAL 96 -18.215 9.278 -13.290 597 H ASN 97 H ASN 97 -19.385 11.372 -16.881 598 HA ASN 97 HA ASN 97 -21.294 9.379 -17.455 599 HB2 ASN 97 2HB ASN 97 -20.389 11.097 -19.016 600 HB3 ASN 97 3HB ASN 97 -18.870 10.200 -19.122 601 HD21 ASN 97 1HD2 ASN 97 -18.995 7.932 -20.083 602 HD22 ASN 97 2HD2 ASN 97 -20.290 7.624 -21.222 603 H SER 98 H SER 98 -17.729 9.032 -17.266 604 HA SER 98 HA SER 98 -17.415 6.507 -16.206 605 HB2 SER 98 2HB SER 98 -16.848 5.132 -18.193 606 HB3 SER 98 3HB SER 98 -18.572 5.446 -18.040 607 HG SER 98 HG SER 98 -17.725 5.718 -20.208 608 H PHE 99 H PHE 99 -15.214 5.918 -16.113 609 HA PHE 99 HA PHE 99 -13.365 8.141 -16.774 610 HB2 PHE 99 2HB PHE 99 -12.859 5.725 -15.015 611 HB3 PHE 99 3HB PHE 99 -12.001 7.261 -15.052 612 HD1 PHE 99 HD1 PHE 99 -14.769 5.375 -13.662 613 HD2 PHE 99 HD2 PHE 99 -13.229 9.354 -14.289 614 HE1 PHE 99 HE1 PHE 99 -16.324 6.248 -11.946 615 HE2 PHE 99 HE2 PHE 99 -14.762 10.220 -12.538 616 HZ PHE 99 HZ PHE 99 -16.278 8.617 -11.326 617 HA PRO 100 HA PRO 100 -12.324 5.200 -20.054 618 HB2 PRO 100 2HB PRO 100 -10.550 7.344 -21.178 619 HB3 PRO 100 3HB PRO 100 -11.864 6.423 -21.979 620 HG2 PRO 100 2HG PRO 100 -12.208 9.020 -21.222 621 HG3 PRO 100 3HG PRO 100 -13.527 7.813 -21.016 622 HD2 PRO 100 2HD PRO 100 -11.509 8.766 -18.952 623 HD3 PRO 100 3HD PRO 100 -13.286 8.667 -18.823 624 H LEU 101 H LEU 101 -10.817 3.605 -19.934 625 HA LEU 101 HA LEU 101 -8.076 4.218 -18.948 626 HB2 LEU 101 2HB LEU 101 -7.949 1.794 -18.382 627 HB3 LEU 101 3HB LEU 101 -8.972 2.798 -17.368 628 HG LEU 101 HG LEU 101 -10.280 1.234 -19.588 629 HD11 LEU 101 1HD1 LEU 101 -10.541 -0.718 -18.153 630 HD12 LEU 101 2HD1 LEU 101 -9.535 0.027 -16.895 631 HD13 LEU 101 3HD1 LEU 101 -8.824 -0.419 -18.451 632 HD21 LEU 101 1HD2 LEU 101 -11.142 1.859 -16.702 633 HD22 LEU 101 2HD2 LEU 101 -12.141 1.112 -17.964 634 HD23 LEU 101 3HD2 LEU 101 -11.624 2.790 -18.114 635 HA PRO 102 HA PRO 102 -6.960 3.441 -23.136 636 HB2 PRO 102 2HB PRO 102 -4.222 3.495 -23.004 637 HB3 PRO 102 3HB PRO 102 -5.253 4.928 -22.760 638 HG2 PRO 102 2HG PRO 102 -3.995 3.162 -20.647 639 HG3 PRO 102 3HG PRO 102 -4.041 4.954 -20.726 640 HD2 PRO 102 2HD PRO 102 -5.812 3.499 -19.222 641 HD3 PRO 102 3HD PRO 102 -6.267 5.029 -20.009 642 H LYS 103 H LYS 103 -4.909 1.421 -20.929 643 HA LYS 103 HA LYS 103 -5.097 -0.924 -22.705 644 HB2 LYS 103 2HB LYS 103 -3.670 -0.258 -20.105 645 HB3 LYS 103 3HB LYS 103 -3.835 -1.926 -20.659 646 HG2 LYS 103 2HG LYS 103 -1.675 -1.031 -21.258 647 HG3 LYS 103 3HG LYS 103 -2.604 -1.476 -22.688 648 HD2 LYS 103 2HD LYS 103 -3.056 0.871 -23.190 649 HD3 LYS 103 3HD LYS 103 -2.328 1.389 -21.649 650 HE2 LYS 103 2HE LYS 103 -0.156 0.511 -22.354 651 HE3 LYS 103 3HE LYS 103 -0.861 -0.141 -23.839 652 HZ1 LYS 103 HZ1 LYS 103 -0.715 2.759 -23.179 653 HZ2 LYS 103 HZ2 LYS 103 -1.340 2.114 -24.554 654 HZ3 LYS 103 HZ3 LYS 103 0.257 1.974 -24.229 655 H ASP 104 H ASP 104 -6.140 -2.805 -22.103 656 HA ASP 104 HA ASP 104 -8.458 -2.482 -20.267 657 HB2 ASP 104 2HB ASP 104 -8.814 -2.077 -22.720 658 HB3 ASP 104 3HB ASP 104 -8.346 -3.746 -23.025 659 H GLN 105 H GLN 105 -5.874 -4.036 -19.776 660 HA GLN 105 HA GLN 105 -6.771 -6.834 -19.892 661 HB2 GLN 105 2HB GLN 105 -4.132 -5.562 -19.142 662 HB3 GLN 105 3HB GLN 105 -4.476 -7.262 -18.870 663 HG2 GLN 105 2HG GLN 105 -3.286 -7.098 -20.942 664 HG3 GLN 105 3HG GLN 105 -4.924 -7.639 -21.258 665 HE21 GLN 105 1HE2 GLN 105 -3.291 -4.441 -20.895 666 HE22 GLN 105 2HE2 GLN 105 -3.884 -3.803 -22.427 667 HA PRO 106 HA PRO 106 -8.224 -6.891 -15.640 668 HB2 PRO 106 2HB PRO 106 -6.647 -9.478 -15.516 669 HB3 PRO 106 3HB PRO 106 -8.281 -9.120 -14.877 670 HG2 PRO 106 2HG PRO 106 -7.982 -10.435 -17.226 671 HG3 PRO 106 3HG PRO 106 -9.214 -9.135 -17.088 672 HD2 PRO 106 2HD PRO 106 -6.456 -9.002 -18.324 673 HD3 PRO 106 3HD PRO 106 -7.993 -8.307 -18.906 674 H ASP 107 H ASP 107 -4.792 -7.079 -16.446 675 HA ASP 107 HA ASP 107 -3.867 -6.992 -13.660 676 HB2 ASP 107 2HB ASP 107 -2.645 -8.173 -15.466 677 HB3 ASP 107 3HB ASP 107 -2.394 -6.628 -16.287 678 H VAL 108 H VAL 108 -4.650 -4.706 -16.164 679 HA VAL 108 HA VAL 108 -3.626 -2.454 -14.502 680 HB VAL 108 HB VAL 108 -3.997 -0.991 -16.317 681 HG11 VAL 108 1HG1 VAL 108 -1.859 -2.293 -16.296 682 HG12 VAL 108 2HG1 VAL 108 -2.592 -3.469 -17.407 683 HG13 VAL 108 3HG1 VAL 108 -2.345 -1.797 -17.923 684 HG21 VAL 108 1HG2 VAL 108 -6.031 -1.934 -17.306 685 HG22 VAL 108 2HG2 VAL 108 -4.785 -1.606 -18.496 686 HG23 VAL 108 3HG2 VAL 108 -5.051 -3.279 -17.968 687 H VAL 109 H VAL 109 -6.645 -3.886 -15.767 688 HA VAL 109 HA VAL 109 -8.445 -1.831 -15.032 689 HB VAL 109 HB VAL 109 -8.732 -4.847 -15.220 690 HG11 VAL 109 1HG1 VAL 109 -10.559 -4.218 -13.749 691 HG12 VAL 109 2HG1 VAL 109 -10.980 -2.841 -14.796 692 HG13 VAL 109 3HG1 VAL 109 -11.209 -4.517 -15.360 693 HG21 VAL 109 1HG2 VAL 109 -8.305 -3.472 -17.352 694 HG22 VAL 109 2HG2 VAL 109 -9.802 -4.408 -17.363 695 HG23 VAL 109 3HG2 VAL 109 -9.843 -2.670 -17.046 696 H GLU 110 H GLU 110 -6.871 -4.299 -13.067 697 HA GLU 110 HA GLU 110 -8.553 -3.896 -10.717 698 HB2 GLU 110 2HB GLU 110 -5.997 -5.386 -11.231 699 HB3 GLU 110 3HB GLU 110 -6.773 -5.357 -9.648 700 HG2 GLU 110 2HG GLU 110 -8.349 -6.216 -12.124 701 HG3 GLU 110 3HG GLU 110 -7.278 -7.312 -11.266 702 H LYS 111 H LYS 111 -5.970 -2.066 -12.041 703 HA LYS 111 HA LYS 111 -4.933 -1.245 -9.369 704 HB2 LYS 111 2HB LYS 111 -3.781 -1.374 -12.148 705 HB3 LYS 111 3HB LYS 111 -3.124 -0.202 -11.015 706 HG2 LYS 111 2HG LYS 111 -1.844 -2.298 -11.092 707 HG3 LYS 111 3HG LYS 111 -2.421 -1.870 -9.477 708 HD2 LYS 111 2HD LYS 111 -4.100 -3.565 -9.501 709 HD3 LYS 111 3HD LYS 111 -3.917 -3.858 -11.226 710 HE2 LYS 111 2HE LYS 111 -1.792 -4.404 -9.112 711 HE3 LYS 111 3HE LYS 111 -2.930 -5.619 -9.733 712 HZ1 LYS 111 HZ1 LYS 111 -0.920 -5.840 -10.952 713 HZ2 LYS 111 HZ2 LYS 111 -0.817 -4.241 -11.282 714 HZ3 LYS 111 HZ3 LYS 111 -1.984 -5.140 -11.987 715 H LEU 112 H LEU 112 -6.398 0.060 -12.244 716 HA LEU 112 HA LEU 112 -6.255 2.800 -11.188 717 HB2 LEU 112 2HB LEU 112 -7.325 3.447 -13.325 718 HB3 LEU 112 3HB LEU 112 -5.873 2.538 -13.462 719 HG LEU 112 HG LEU 112 -7.205 0.523 -13.776 720 HD11 LEU 112 1HD1 LEU 112 -9.332 0.419 -14.621 721 HD12 LEU 112 2HD1 LEU 112 -9.508 2.189 -14.615 722 HD13 LEU 112 3HD1 LEU 112 -9.390 1.259 -13.093 723 HD21 LEU 112 1HD2 LEU 112 -7.270 2.623 -15.929 724 HD22 LEU 112 2HD2 LEU 112 -7.430 0.863 -16.196 725 HD23 LEU 112 3HD2 LEU 112 -5.922 1.535 -15.564 726 H LYS 113 H LYS 113 -8.517 0.189 -10.951 727 HA LYS 113 HA LYS 113 -10.882 1.746 -10.651 728 HB2 LYS 113 2HB LYS 113 -11.802 -0.317 -9.631 729 HB3 LYS 113 3HB LYS 113 -11.008 -0.599 -11.190 730 HG2 LYS 113 2HG LYS 113 -9.127 -1.635 -10.178 731 HG3 LYS 113 3HG LYS 113 -9.471 -0.993 -8.584 732 HD2 LYS 113 2HD LYS 113 -9.898 -3.465 -8.954 733 HD3 LYS 113 3HD LYS 113 -11.154 -2.530 -8.141 734 HE2 LYS 113 2HE LYS 113 -12.506 -2.396 -10.126 735 HE3 LYS 113 3HE LYS 113 -11.218 -3.123 -11.110 736 HZ1 LYS 113 HZ1 LYS 113 -12.930 -4.763 -10.501 737 HZ2 LYS 113 HZ2 LYS 113 -12.626 -4.522 -8.899 738 HZ3 LYS 113 HZ3 LYS 113 -11.472 -5.169 -9.885 739 H ASN 114 H ASN 114 -8.362 1.129 -8.376 740 HA ASN 114 HA ASN 114 -10.024 2.280 -6.160 741 HB2 ASN 114 2HB ASN 114 -7.851 0.192 -5.821 742 HB3 ASN 114 3HB ASN 114 -8.930 0.859 -4.580 743 HD21 ASN 114 1HD2 ASN 114 -11.414 0.640 -6.200 744 HD22 ASN 114 2HD2 ASN 114 -11.744 -1.080 -6.241 745 H ILE 115 H ILE 115 -9.300 4.353 -6.670 746 HA ILE 115 HA ILE 115 -6.425 4.931 -6.146 747 HB ILE 115 HB ILE 115 -6.707 7.030 -7.326 748 HG12 ILE 115 2HG1 ILE 115 -9.203 7.196 -6.999 749 HG13 ILE 115 3HG1 ILE 115 -8.555 7.685 -8.542 750 HG21 ILE 115 1HG2 ILE 115 -7.206 4.483 -8.891 751 HG22 ILE 115 2HG2 ILE 115 -6.735 6.029 -9.627 752 HG23 ILE 115 3HG2 ILE 115 -5.661 5.218 -8.471 753 HD11 ILE 115 1HD1 ILE 115 -10.582 6.516 -8.959 754 HD12 ILE 115 2HD1 ILE 115 -9.261 5.496 -9.531 755 HD13 ILE 115 3HD1 ILE 115 -10.071 5.123 -7.998 756 H ASN 116 H ASN 116 -5.863 6.841 -5.039 757 HA ASN 116 HA ASN 116 -8.056 8.056 -3.420 758 HB2 ASN 116 2HB ASN 116 -5.114 8.094 -2.696 759 HB3 ASN 116 3HB ASN 116 -6.472 8.793 -1.810 760 HD21 ASN 116 1HD2 ASN 116 -7.802 5.873 -2.687 761 HD22 ASN 116 2HD2 ASN 116 -7.239 4.934 -1.311 762 H LEU 117 H LEU 117 -8.520 10.059 -3.919 763 HA LEU 117 HA LEU 117 -6.738 11.673 -5.709 764 HB2 LEU 117 2HB LEU 117 -9.575 12.285 -4.755 765 HB3 LEU 117 3HB LEU 117 -8.616 13.217 -5.892 766 HG LEU 117 HG LEU 117 -9.758 10.407 -6.329 767 HD11 LEU 117 1HD1 LEU 117 -11.111 11.512 -8.065 768 HD12 LEU 117 2HD1 LEU 117 -10.373 13.079 -7.666 769 HD13 LEU 117 3HD1 LEU 117 -11.387 12.233 -6.470 770 HD21 LEU 117 1HD2 LEU 117 -8.909 10.696 -8.700 771 HD22 LEU 117 2HD2 LEU 117 -7.650 10.409 -7.495 772 HD23 LEU 117 3HD2 LEU 117 -7.925 12.061 -8.114 773 H THR 118 H THR 118 -5.410 13.026 -4.722 774 HA THR 118 HA THR 118 -6.071 14.091 -2.031 775 HB THR 118 HB THR 118 -3.383 12.903 -2.804 776 HG1 THR 118 HG1 THR 118 -3.983 11.347 -1.289 777 HG21 THR 118 1HG2 THR 118 -2.990 13.244 -0.306 778 HG22 THR 118 2HG2 THR 118 -4.468 14.241 -0.282 779 HG23 THR 118 3HG2 THR 118 -3.063 14.740 -1.248 780 H VAL 119 H VAL 119 -5.816 16.149 -1.845 781 HA VAL 119 HA VAL 119 -4.451 17.815 -3.900 782 HB VAL 119 HB VAL 119 -7.164 17.836 -2.513 783 HG11 VAL 119 1HG1 VAL 119 -7.565 20.085 -3.502 784 HG12 VAL 119 2HG1 VAL 119 -6.430 20.021 -2.160 785 HG13 VAL 119 3HG1 VAL 119 -5.819 20.199 -3.837 786 HG21 VAL 119 1HG2 VAL 119 -6.319 18.062 -5.433 787 HG22 VAL 119 2HG2 VAL 119 -7.043 16.637 -4.631 788 HG23 VAL 119 3HG2 VAL 119 -7.996 18.111 -4.828 789 H ALA 120 H ALA 120 -3.351 19.557 -3.091 790 HA ALA 120 HA ALA 120 -3.359 20.461 -0.348 791 HB1 ALA 120 1HB ALA 120 -2.265 18.293 0.029 792 HB2 ALA 120 2HB ALA 120 -1.055 18.668 -1.216 793 HB3 ALA 120 3HB ALA 120 -1.119 19.611 0.278 794 HA PRO 121 HA PRO 121 0.239 22.740 -2.446 795 HB2 PRO 121 2HB PRO 121 0.572 22.863 -5.149 796 HB3 PRO 121 3HB PRO 121 1.205 21.523 -4.150 797 HG2 PRO 121 2HG PRO 121 -1.375 21.613 -5.739 798 HG3 PRO 121 3HG PRO 121 -0.128 20.326 -5.715 799 HD2 PRO 121 2HD PRO 121 -2.396 20.205 -4.230 800 HD3 PRO 121 3HD PRO 121 -0.852 19.534 -3.622 801 H GLU 122 H GLU 122 0.436 24.908 -3.389 802 HA GLU 122 HA GLU 122 -2.030 26.250 -4.273 803 HB2 GLU 122 2HB GLU 122 -1.924 25.929 -1.658 804 HB3 GLU 122 3HB GLU 122 -0.719 27.208 -1.707 805 HG2 GLU 122 2HG GLU 122 -3.602 27.336 -2.695 806 HG3 GLU 122 3HG GLU 122 -2.972 28.067 -1.224 Start of MODEL 13 1 H1 ALA 22 H ALA 22 14.961 4.736 -23.158 2 HA ALA 22 HA ALA 22 12.374 3.752 -22.851 3 HB1 ALA 22 1HB ALA 22 14.436 1.621 -23.632 4 HB2 ALA 22 2HB ALA 22 12.864 1.290 -22.867 5 HB3 ALA 22 3HB ALA 22 12.921 1.978 -24.489 6 H ALA 23 H ALA 23 12.178 2.894 -20.696 7 HA ALA 23 HA ALA 23 14.508 2.673 -18.985 8 HB1 ALA 23 1HB ALA 23 14.352 5.130 -19.331 9 HB2 ALA 23 2HB ALA 23 12.714 5.109 -18.639 10 HB3 ALA 23 3HB ALA 23 14.101 4.639 -17.609 11 H ARG 24 H ARG 24 14.122 1.512 -17.374 12 HA ARG 24 HA ARG 24 11.394 0.842 -16.405 13 HB2 ARG 24 2HB ARG 24 13.569 -1.092 -17.319 14 HB3 ARG 24 3HB ARG 24 12.032 -1.578 -16.587 15 HG2 ARG 24 2HG ARG 24 10.792 -0.565 -18.493 16 HG3 ARG 24 3HG ARG 24 12.323 -0.066 -19.211 17 HD2 ARG 24 2HD ARG 24 11.734 -1.936 -20.404 18 HD3 ARG 24 3HD ARG 24 13.025 -2.474 -19.331 19 HE ARG 24 HE ARG 24 10.791 -3.112 -17.883 20 HH11 ARG 24 1HH1 ARG 24 11.626 -3.794 -21.257 21 HH12 ARG 24 2HH1 ARG 24 10.558 -5.173 -21.331 22 HH21 ARG 24 1HH2 ARG 24 9.494 -4.955 -18.032 23 HH22 ARG 24 2HH2 ARG 24 9.447 -5.864 -19.505 24 H GLN 25 H GLN 25 13.802 2.351 -15.376 25 HA GLN 25 HA GLN 25 14.783 0.807 -13.051 26 HB2 GLN 25 2HB GLN 25 15.307 3.704 -13.840 27 HB3 GLN 25 3HB GLN 25 16.258 2.700 -12.741 28 HG2 GLN 25 2HG GLN 25 16.039 2.394 -15.753 29 HG3 GLN 25 3HG GLN 25 17.417 2.987 -14.863 30 HE21 GLN 25 1HE2 GLN 25 15.975 0.175 -16.241 31 HE22 GLN 25 2HE2 GLN 25 17.009 -0.998 -15.445 32 H GLN 26 H GLN 26 12.526 3.495 -13.742 33 HA GLN 26 HA GLN 26 11.407 3.413 -11.032 34 HB2 GLN 26 2HB GLN 26 12.017 5.697 -10.410 35 HB3 GLN 26 3HB GLN 26 13.380 4.614 -10.521 36 HG2 GLN 26 2HG GLN 26 13.403 5.723 -13.068 37 HG3 GLN 26 3HG GLN 26 12.714 7.049 -12.130 38 HE21 GLN 26 1HE2 GLN 26 15.361 4.576 -11.811 39 HE22 GLN 26 2HE2 GLN 26 16.522 5.701 -11.161 40 H PHE 27 H PHE 27 10.650 3.445 -14.056 41 HA PHE 27 HA PHE 27 9.376 5.858 -14.729 42 HB2 PHE 27 2HB PHE 27 8.637 4.701 -16.613 43 HB3 PHE 27 3HB PHE 27 10.146 3.877 -16.203 44 HD1 PHE 27 HD1 PHE 27 9.946 1.653 -14.901 45 HD2 PHE 27 HD2 PHE 27 6.553 3.648 -16.626 46 HE1 PHE 27 HE1 PHE 27 8.596 -0.415 -14.633 47 HE2 PHE 27 HE2 PHE 27 5.169 1.629 -16.303 48 HZ PHE 27 HZ PHE 27 6.197 -0.436 -15.320 49 H VAL 28 H VAL 28 8.231 3.571 -12.501 50 HA VAL 28 HA VAL 28 5.448 3.484 -12.914 51 HB VAL 28 HB VAL 28 5.285 3.052 -10.435 52 HG11 VAL 28 1HG1 VAL 28 7.370 1.393 -11.927 53 HG12 VAL 28 2HG1 VAL 28 6.374 0.852 -10.564 54 HG13 VAL 28 3HG1 VAL 28 5.604 1.246 -12.116 55 HG21 VAL 28 1HG2 VAL 28 8.331 3.260 -10.442 56 HG22 VAL 28 2HG2 VAL 28 7.212 4.353 -9.603 57 HG23 VAL 28 3HG2 VAL 28 7.322 2.652 -9.129 58 H THR 29 H THR 29 7.341 6.045 -11.453 59 HA THR 29 HA THR 29 5.288 7.576 -10.269 60 HB THR 29 HB THR 29 7.682 7.973 -10.007 61 HG1 THR 29 HG1 THR 29 6.297 9.627 -9.462 62 HG21 THR 29 1HG2 THR 29 7.598 9.332 -12.744 63 HG22 THR 29 2HG2 THR 29 8.397 7.773 -12.418 64 HG23 THR 29 3HG2 THR 29 8.982 9.251 -11.635 65 H SER 30 H SER 30 6.174 7.287 -13.714 66 HA SER 30 HA SER 30 4.315 9.365 -14.547 67 HB2 SER 30 2HB SER 30 6.416 8.678 -15.777 68 HB3 SER 30 3HB SER 30 5.579 7.191 -16.246 69 HG SER 30 HG SER 30 3.966 8.539 -17.261 70 H GLU 31 H GLU 31 4.020 5.893 -13.908 71 HA GLU 31 HA GLU 31 1.410 5.640 -15.150 72 HB2 GLU 31 2HB GLU 31 2.579 3.998 -12.879 73 HB3 GLU 31 3HB GLU 31 1.100 3.666 -13.781 74 HG2 GLU 31 2HG GLU 31 2.521 3.694 -15.909 75 HG3 GLU 31 3HG GLU 31 3.935 3.638 -14.858 76 H VAL 32 H VAL 32 2.563 6.847 -11.947 77 HA VAL 32 HA VAL 32 -0.102 7.007 -10.797 78 HB VAL 32 HB VAL 32 2.423 8.550 -10.077 79 HG11 VAL 32 1HG1 VAL 32 1.287 8.933 -7.886 80 HG12 VAL 32 2HG1 VAL 32 0.519 9.792 -9.214 81 HG13 VAL 32 3HG1 VAL 32 -0.216 8.298 -8.582 82 HG21 VAL 32 1HG2 VAL 32 1.131 6.074 -8.839 83 HG22 VAL 32 2HG2 VAL 32 2.654 6.105 -9.745 84 HG23 VAL 32 3HG2 VAL 32 2.545 6.934 -8.189 85 H GLY 33 H GLY 33 1.756 9.026 -12.984 86 HA2 GLY 33 HA2 GLY 33 -0.006 11.348 -13.004 87 HA3 GLY 33 HA3 GLY 33 1.278 10.941 -14.160 88 H ARG 34 H ARG 34 -0.661 8.257 -14.020 89 HA ARG 34 HA ARG 34 -2.681 9.207 -16.033 90 HB2 ARG 34 2HB ARG 34 -1.123 6.593 -15.928 91 HB3 ARG 34 3HB ARG 34 -2.499 6.890 -16.992 92 HG2 ARG 34 2HG ARG 34 0.108 8.476 -17.029 93 HG3 ARG 34 3HG ARG 34 -0.225 7.072 -18.058 94 HD2 ARG 34 2HD ARG 34 -2.115 8.229 -19.090 95 HD3 ARG 34 3HD ARG 34 -1.864 9.637 -18.040 96 HE ARG 34 HE ARG 34 0.575 9.154 -19.340 97 HH11 ARG 34 1HH1 ARG 34 -2.668 10.221 -20.285 98 HH12 ARG 34 2HH1 ARG 34 -2.080 11.110 -21.657 99 HH21 ARG 34 1HH2 ARG 34 1.272 10.306 -21.119 100 HH22 ARG 34 2HH2 ARG 34 0.137 11.160 -22.121 101 H TYR 35 H TYR 35 -2.012 6.369 -13.988 102 HA TYR 35 HA TYR 35 -4.577 5.308 -14.038 103 HB2 TYR 35 2HB TYR 35 -2.155 4.929 -12.249 104 HB3 TYR 35 3HB TYR 35 -3.633 4.051 -11.914 105 HD1 TYR 35 HD1 TYR 35 -1.295 4.768 -14.781 106 HD2 TYR 35 HD2 TYR 35 -4.100 2.065 -12.986 107 HE1 TYR 35 HE1 TYR 35 -1.092 3.264 -16.760 108 HE2 TYR 35 HE2 TYR 35 -3.980 0.590 -14.947 109 HH TYR 35 HH TYR 35 -2.991 0.260 -17.052 110 H GLY 36 H GLY 36 -3.571 7.790 -11.972 111 HA2 GLY 36 HA2 GLY 36 -6.216 7.834 -10.543 112 HA3 GLY 36 HA3 GLY 36 -4.733 8.555 -9.912 113 H ALA 37 H ALA 37 -4.378 9.395 -12.990 114 HA ALA 37 HA ALA 37 -5.356 12.098 -12.581 115 HB1 ALA 37 1HB ALA 37 -4.091 12.600 -14.601 116 HB2 ALA 37 2HB ALA 37 -3.090 11.674 -13.472 117 HB3 ALA 37 3HB ALA 37 -3.815 10.880 -14.896 118 H ILE 38 H ILE 38 -6.114 9.262 -14.596 119 HA ILE 38 HA ILE 38 -7.962 10.521 -16.369 120 HB ILE 38 HB ILE 38 -8.769 8.305 -16.843 121 HG12 ILE 38 2HG1 ILE 38 -7.515 7.486 -14.188 122 HG13 ILE 38 3HG1 ILE 38 -9.217 7.434 -14.647 123 HG21 ILE 38 1HG2 ILE 38 -5.866 7.703 -16.250 124 HG22 ILE 38 2HG2 ILE 38 -6.839 7.311 -17.659 125 HG23 ILE 38 3HG2 ILE 38 -6.304 8.981 -17.414 126 HD11 ILE 38 1HD1 ILE 38 -8.615 5.702 -16.392 127 HD12 ILE 38 2HD1 ILE 38 -7.007 5.627 -15.603 128 HD13 ILE 38 3HD1 ILE 38 -8.476 5.207 -14.705 129 H TYR 39 H TYR 39 -8.322 9.578 -13.079 130 HA TYR 39 HA TYR 39 -11.211 9.983 -12.972 131 HB2 TYR 39 2HB TYR 39 -9.188 9.648 -10.725 132 HB3 TYR 39 3HB TYR 39 -10.934 9.622 -10.560 133 HD1 TYR 39 HD1 TYR 39 -8.001 7.649 -11.586 134 HD2 TYR 39 HD2 TYR 39 -12.296 7.836 -11.566 135 HE1 TYR 39 HE1 TYR 39 -8.088 5.214 -12.245 136 HE2 TYR 39 HE2 TYR 39 -12.362 5.481 -12.367 137 HH TYR 39 HH TYR 39 -9.520 3.487 -12.802 138 H THR 40 H THR 40 -8.378 11.660 -11.545 139 HA THR 40 HA THR 40 -9.835 13.785 -10.379 140 HB THR 40 HB THR 40 -7.418 12.925 -9.968 141 HG1 THR 40 HG1 THR 40 -8.068 15.699 -9.983 142 HG21 THR 40 1HG2 THR 40 -5.609 13.980 -11.004 143 HG22 THR 40 2HG2 THR 40 -6.626 15.241 -11.755 144 HG23 THR 40 3HG2 THR 40 -6.691 13.576 -12.346 145 H GLN 41 H GLN 41 -8.527 13.502 -13.648 146 HA GLN 41 HA GLN 41 -8.978 16.286 -14.350 147 HB2 GLN 41 2HB GLN 41 -8.439 13.735 -15.937 148 HB3 GLN 41 3HB GLN 41 -8.628 15.316 -16.704 149 HG2 GLN 41 2HG GLN 41 -6.471 14.580 -14.678 150 HG3 GLN 41 3HG GLN 41 -6.259 14.758 -16.418 151 HE21 GLN 41 1HE2 GLN 41 -4.881 16.242 -14.217 152 HE22 GLN 41 2HE2 GLN 41 -5.292 17.929 -14.498 153 H LEU 42 H LEU 42 -10.856 13.235 -14.702 154 HA LEU 42 HA LEU 42 -12.933 14.553 -16.251 155 HB2 LEU 42 2HB LEU 42 -12.424 12.070 -16.246 156 HB3 LEU 42 3HB LEU 42 -13.099 12.020 -14.607 157 HG LEU 42 HG LEU 42 -15.289 12.702 -15.447 158 HD11 LEU 42 1HD1 LEU 42 -14.724 14.102 -17.389 159 HD12 LEU 42 2HD1 LEU 42 -15.746 12.769 -17.919 160 HD13 LEU 42 3HD1 LEU 42 -13.989 12.707 -18.212 161 HD21 LEU 42 1HD2 LEU 42 -14.091 10.360 -16.962 162 HD22 LEU 42 2HD2 LEU 42 -15.831 10.678 -16.795 163 HD23 LEU 42 3HD2 LEU 42 -14.867 10.336 -15.358 164 H ILE 43 H ILE 43 -12.432 13.990 -12.758 165 HA ILE 43 HA ILE 43 -15.004 14.969 -11.953 166 HB ILE 43 HB ILE 43 -12.357 14.423 -10.587 167 HG12 ILE 43 2HG1 ILE 43 -13.946 13.107 -9.124 168 HG13 ILE 43 3HG1 ILE 43 -15.283 13.672 -10.154 169 HG21 ILE 43 1HG2 ILE 43 -13.019 16.544 -9.511 170 HG22 ILE 43 2HG2 ILE 43 -14.688 15.935 -9.325 171 HG23 ILE 43 3HG2 ILE 43 -13.327 15.187 -8.433 172 HD11 ILE 43 1HD1 ILE 43 -13.007 11.831 -10.935 173 HD12 ILE 43 2HD1 ILE 43 -14.716 11.427 -10.722 174 HD13 ILE 43 3HD1 ILE 43 -14.231 12.466 -12.077 175 H ARG 44 H ARG 44 -11.872 16.673 -12.175 176 HA ARG 44 HA ARG 44 -12.980 19.160 -11.281 177 HB2 ARG 44 2HB ARG 44 -10.884 20.138 -11.692 178 HB3 ARG 44 3HB ARG 44 -10.618 18.487 -11.145 179 HG2 ARG 44 2HG ARG 44 -9.050 18.658 -12.790 180 HG3 ARG 44 3HG ARG 44 -10.392 17.890 -13.635 181 HD2 ARG 44 2HD ARG 44 -11.015 20.182 -14.542 182 HD3 ARG 44 3HD ARG 44 -9.544 20.815 -13.793 183 HE ARG 44 HE ARG 44 -8.471 18.846 -15.243 184 HH11 ARG 44 1HH1 ARG 44 -10.905 21.171 -16.363 185 HH12 ARG 44 2HH1 ARG 44 -10.641 20.730 -18.031 186 HH21 ARG 44 1HH2 ARG 44 -8.077 18.498 -17.311 187 HH22 ARG 44 2HH2 ARG 44 -8.956 19.328 -18.582 188 H GLN 45 H GLN 45 -13.053 17.667 -14.390 189 HA GLN 45 HA GLN 45 -13.630 19.950 -16.093 190 HB2 GLN 45 2HB GLN 45 -14.697 17.101 -16.083 191 HB3 GLN 45 3HB GLN 45 -15.099 18.265 -17.341 192 HG2 GLN 45 2HG GLN 45 -12.199 17.980 -16.803 193 HG3 GLN 45 3HG GLN 45 -13.001 16.518 -17.400 194 HE21 GLN 45 1HE2 GLN 45 -14.038 16.619 -19.561 195 HE22 GLN 45 2HE2 GLN 45 -13.513 17.859 -20.688 196 H ASN 46 H ASN 46 -15.626 18.137 -13.739 197 HA ASN 46 HA ASN 46 -18.086 19.540 -14.539 198 HB2 ASN 46 2HB ASN 46 -17.475 17.969 -12.013 199 HB3 ASN 46 3HB ASN 46 -19.072 18.468 -12.572 200 HD21 ASN 46 1HD2 ASN 46 -16.701 16.029 -12.693 201 HD22 ASN 46 2HD2 ASN 46 -17.534 15.041 -13.892 202 H LEU 47 H LEU 47 -15.573 20.100 -12.120 203 HA LEU 47 HA LEU 47 -17.307 21.867 -10.524 204 HB2 LEU 47 2HB LEU 47 -14.640 20.524 -9.960 205 HB3 LEU 47 3HB LEU 47 -15.671 21.386 -8.815 206 HG LEU 47 HG LEU 47 -16.441 18.846 -10.174 207 HD11 LEU 47 1HD1 LEU 47 -14.558 18.676 -8.674 208 HD12 LEU 47 2HD1 LEU 47 -15.986 17.847 -8.008 209 HD13 LEU 47 3HD1 LEU 47 -15.504 19.445 -7.382 210 HD21 LEU 47 1HD2 LEU 47 -17.870 20.532 -8.081 211 HD22 LEU 47 2HD2 LEU 47 -18.230 18.811 -8.352 212 HD23 LEU 47 3HD2 LEU 47 -18.486 19.980 -9.644 213 H LEU 48 H LEU 48 -17.212 23.808 -11.022 214 HA LEU 48 HA LEU 48 -14.769 25.132 -11.979 215 HB2 LEU 48 2HB LEU 48 -16.357 26.919 -12.741 216 HB3 LEU 48 3HB LEU 48 -16.547 25.338 -13.467 217 HG LEU 48 HG LEU 48 -18.528 24.880 -12.123 218 HD11 LEU 48 1HD1 LEU 48 -18.136 26.138 -10.061 219 HD12 LEU 48 2HD1 LEU 48 -19.644 26.670 -10.816 220 HD13 LEU 48 3HD1 LEU 48 -18.194 27.677 -10.961 221 HD21 LEU 48 1HD2 LEU 48 -20.013 26.490 -13.227 222 HD22 LEU 48 2HD2 LEU 48 -18.705 25.993 -14.313 223 HD23 LEU 48 3HD2 LEU 48 -18.634 27.578 -13.511 224 H VAL 49 H VAL 49 -14.971 24.554 -9.210 225 HA VAL 49 HA VAL 49 -15.826 26.960 -7.804 226 HB VAL 49 HB VAL 49 -14.453 24.546 -6.665 227 HG11 VAL 49 1HG1 VAL 49 -15.464 25.275 -4.499 228 HG12 VAL 49 2HG1 VAL 49 -14.284 26.439 -5.121 229 HG13 VAL 49 3HG1 VAL 49 -16.020 26.768 -5.291 230 HG21 VAL 49 1HG2 VAL 49 -17.424 25.203 -6.853 231 HG22 VAL 49 2HG2 VAL 49 -16.582 23.880 -7.699 232 HG23 VAL 49 3HG2 VAL 49 -16.735 23.834 -5.942 233 H GLU 50 H GLU 50 -12.668 25.272 -7.701 234 HA GLU 50 HA GLU 50 -10.535 25.928 -7.843 235 HB2 GLU 50 2HB GLU 50 -11.475 28.662 -8.775 236 HB3 GLU 50 3HB GLU 50 -9.879 27.941 -8.945 237 HG2 GLU 50 2HG GLU 50 -10.947 26.085 -10.323 238 HG3 GLU 50 3HG GLU 50 -12.464 26.991 -10.267 239 H ASP 51 H ASP 51 -12.066 28.954 -6.648 240 HA ASP 51 HA ASP 51 -9.873 29.660 -4.968 241 HB2 ASP 51 2HB ASP 51 -11.520 31.229 -5.960 242 HB3 ASP 51 3HB ASP 51 -12.767 30.582 -4.887 243 H SER 52 H SER 52 -12.765 27.751 -4.288 244 HA SER 52 HA SER 52 -11.961 27.440 -1.424 245 HB2 SER 52 2HB SER 52 -14.486 26.413 -2.734 246 HB3 SER 52 3HB SER 52 -14.094 26.486 -1.016 247 HG SER 52 HG SER 52 -15.453 28.227 -1.638 248 H PHE 53 H PHE 53 -11.014 25.962 -4.212 249 HA PHE 53 HA PHE 53 -10.687 23.262 -2.985 250 HB2 PHE 53 2HB PHE 53 -10.150 24.324 -5.776 251 HB3 PHE 53 3HB PHE 53 -9.768 22.713 -5.219 252 HD1 PHE 53 HD1 PHE 53 -12.790 23.119 -3.558 253 HD2 PHE 53 HD2 PHE 53 -11.238 22.901 -7.581 254 HE1 PHE 53 HE1 PHE 53 -14.899 22.177 -4.297 255 HE2 PHE 53 HE2 PHE 53 -13.367 21.895 -8.327 256 HZ PHE 53 HZ PHE 53 -15.199 21.494 -6.688 257 H ARG 54 H ARG 54 -9.002 26.202 -3.887 258 HA ARG 54 HA ARG 54 -6.323 25.090 -3.442 259 HB2 ARG 54 2HB ARG 54 -5.534 27.135 -4.382 260 HB3 ARG 54 3HB ARG 54 -6.898 26.555 -5.321 261 HG2 ARG 54 2HG ARG 54 -7.384 28.778 -5.266 262 HG3 ARG 54 3HG ARG 54 -8.323 28.212 -3.896 263 HD2 ARG 54 2HD ARG 54 -7.271 30.293 -3.345 264 HD3 ARG 54 3HD ARG 54 -6.524 29.037 -2.354 265 HE ARG 54 HE ARG 54 -4.986 29.293 -4.717 266 HH11 ARG 54 1HH1 ARG 54 -5.741 31.340 -1.942 267 HH12 ARG 54 2HH1 ARG 54 -4.254 32.234 -2.065 268 HH21 ARG 54 1HH2 ARG 54 -3.093 30.479 -4.848 269 HH22 ARG 54 2HH2 ARG 54 -2.784 31.768 -3.725 270 H GLY 55 H GLY 55 -4.751 26.224 -2.085 271 HA2 GLY 55 HA2 GLY 55 -3.975 27.338 -0.202 272 HA3 GLY 55 HA3 GLY 55 -5.616 27.951 0.103 273 H LYS 56 H LYS 56 -6.646 25.111 0.101 274 HA LYS 56 HA LYS 56 -5.650 24.105 2.733 275 HB2 LYS 56 2HB LYS 56 -7.950 23.156 3.001 276 HB3 LYS 56 3HB LYS 56 -7.868 24.901 2.985 277 HG2 LYS 56 2HG LYS 56 -9.802 24.262 1.802 278 HG3 LYS 56 3HG LYS 56 -8.699 24.940 0.640 279 HD2 LYS 56 2HD LYS 56 -8.141 22.780 -0.262 280 HD3 LYS 56 3HD LYS 56 -8.967 21.919 1.049 281 HE2 LYS 56 2HE LYS 56 -10.222 23.697 -1.047 282 HE3 LYS 56 3HE LYS 56 -10.191 21.922 -1.102 283 HZ1 LYS 56 HZ1 LYS 56 -11.709 21.849 0.733 284 HZ2 LYS 56 HZ2 LYS 56 -12.286 23.003 -0.309 285 HZ3 LYS 56 HZ3 LYS 56 -11.552 23.444 1.068 286 H GLN 57 H GLN 57 -6.679 21.571 2.708 287 HA GLN 57 HA GLN 57 -5.631 20.236 0.263 288 HB2 GLN 57 2HB GLN 57 -4.078 18.992 1.399 289 HB3 GLN 57 3HB GLN 57 -4.011 20.456 2.310 290 HG2 GLN 57 2HG GLN 57 -4.181 19.108 4.087 291 HG3 GLN 57 3HG GLN 57 -5.914 19.195 3.765 292 HE21 GLN 57 1HE2 GLN 57 -4.412 17.193 1.403 293 HE22 GLN 57 2HE2 GLN 57 -4.865 15.695 2.214 294 H CYS 58 H CYS 58 -6.400 17.960 0.071 295 HA CYS 58 HA CYS 58 -8.402 16.985 1.941 296 HB2 CYS 58 2HB CYS 58 -9.800 18.494 0.566 297 HB3 CYS 58 3HB CYS 58 -9.170 17.736 -0.909 298 HG CYS 58 HG CYS 58 -10.739 16.080 1.501 299 H ARG 59 H ARG 59 -8.623 14.776 1.816 300 HA ARG 59 HA ARG 59 -7.553 13.326 -0.507 301 HB2 ARG 59 2HB ARG 59 -6.758 11.510 0.900 302 HB3 ARG 59 3HB ARG 59 -5.782 12.951 1.003 303 HG2 ARG 59 2HG ARG 59 -7.858 12.538 3.153 304 HG3 ARG 59 3HG ARG 59 -6.464 11.483 3.115 305 HD2 ARG 59 2HD ARG 59 -5.006 13.588 3.081 306 HD3 ARG 59 3HD ARG 59 -6.511 14.488 3.340 307 HE ARG 59 HE ARG 59 -6.472 13.924 5.537 308 HH11 ARG 59 1HH1 ARG 59 -4.224 11.648 3.981 309 HH12 ARG 59 2HH1 ARG 59 -3.743 10.973 5.502 310 HH21 ARG 59 1HH2 ARG 59 -5.827 12.972 7.434 311 HH22 ARG 59 2HH2 ARG 59 -4.641 11.714 7.427 312 H VAL 60 H VAL 60 -9.006 11.967 -1.337 313 HA VAL 60 HA VAL 60 -10.927 10.563 0.423 314 HB VAL 60 HB VAL 60 -12.869 11.048 -0.916 315 HG11 VAL 60 1HG1 VAL 60 -12.277 12.666 0.923 316 HG12 VAL 60 2HG1 VAL 60 -11.526 13.692 -0.295 317 HG13 VAL 60 3HG1 VAL 60 -13.259 13.390 -0.378 318 HG21 VAL 60 1HG2 VAL 60 -11.813 11.284 -3.143 319 HG22 VAL 60 2HG2 VAL 60 -12.918 12.632 -2.769 320 HG23 VAL 60 3HG2 VAL 60 -11.164 12.870 -2.643 321 H ASN 61 H ASN 61 -12.018 8.753 -0.963 322 HA ASN 61 HA ASN 61 -10.079 7.793 -2.967 323 HB2 ASN 61 2HB ASN 61 -9.433 6.962 -0.783 324 HB3 ASN 61 3HB ASN 61 -11.071 6.407 -0.441 325 HD21 ASN 61 1HD2 ASN 61 -11.956 4.645 -1.843 326 HD22 ASN 61 2HD2 ASN 61 -10.818 3.478 -2.498 327 H LEU 62 H LEU 62 -10.816 6.722 -4.631 328 HA LEU 62 HA LEU 62 -13.788 6.283 -4.880 329 HB2 LEU 62 2HB LEU 62 -11.556 7.029 -6.763 330 HB3 LEU 62 3HB LEU 62 -12.980 6.209 -7.387 331 HG LEU 62 HG LEU 62 -14.412 8.019 -6.717 332 HD11 LEU 62 1HD1 LEU 62 -13.480 10.193 -5.861 333 HD12 LEU 62 2HD1 LEU 62 -11.935 9.366 -5.547 334 HD13 LEU 62 3HD1 LEU 62 -13.396 8.887 -4.674 335 HD21 LEU 62 1HD2 LEU 62 -13.270 8.120 -8.898 336 HD22 LEU 62 2HD2 LEU 62 -11.888 8.957 -8.151 337 HD23 LEU 62 3HD2 LEU 62 -13.469 9.756 -8.244 338 H LYS 63 H LYS 63 -14.492 4.276 -4.979 339 HA LYS 63 HA LYS 63 -12.692 2.109 -6.012 340 HB2 LYS 63 2HB LYS 63 -15.063 1.900 -4.119 341 HB3 LYS 63 3HB LYS 63 -14.184 0.532 -4.817 342 HG2 LYS 63 2HG LYS 63 -12.059 1.473 -3.747 343 HG3 LYS 63 3HG LYS 63 -13.083 2.625 -2.885 344 HD2 LYS 63 2HD LYS 63 -13.280 -0.406 -2.675 345 HD3 LYS 63 3HD LYS 63 -12.499 0.679 -1.515 346 HE2 LYS 63 2HE LYS 63 -14.701 1.832 -1.149 347 HE3 LYS 63 3HE LYS 63 -15.465 0.691 -2.261 348 HZ1 LYS 63 HZ1 LYS 63 -14.137 -0.036 0.290 349 HZ2 LYS 63 HZ2 LYS 63 -14.804 -1.105 -0.750 350 HZ3 LYS 63 HZ3 LYS 63 -15.747 -0.019 0.022 351 H LEU 64 H LEU 64 -13.112 1.862 -8.169 352 HA LEU 64 HA LEU 64 -15.898 2.252 -9.110 353 HB2 LEU 64 2HB LEU 64 -13.346 1.921 -10.722 354 HB3 LEU 64 3HB LEU 64 -14.942 2.391 -11.304 355 HG LEU 64 HG LEU 64 -13.850 4.330 -11.386 356 HD11 LEU 64 1HD1 LEU 64 -15.869 4.755 -10.198 357 HD12 LEU 64 2HD1 LEU 64 -14.624 5.886 -9.661 358 HD13 LEU 64 3HD1 LEU 64 -15.074 4.533 -8.614 359 HD21 LEU 64 1HD2 LEU 64 -12.519 3.928 -8.697 360 HD22 LEU 64 2HD2 LEU 64 -12.312 5.272 -9.807 361 HD23 LEU 64 3HD2 LEU 64 -11.789 3.666 -10.317 362 H ILE 65 H ILE 65 -16.764 0.887 -10.667 363 HA ILE 65 HA ILE 65 -16.021 -2.009 -10.462 364 HB ILE 65 HB ILE 65 -18.277 -2.368 -11.543 365 HG12 ILE 65 2HG1 ILE 65 -18.973 0.421 -10.549 366 HG13 ILE 65 3HG1 ILE 65 -18.504 0.117 -12.229 367 HG21 ILE 65 1HG2 ILE 65 -19.456 -2.254 -9.392 368 HG22 ILE 65 2HG2 ILE 65 -17.798 -2.815 -9.168 369 HG23 ILE 65 3HG2 ILE 65 -18.232 -1.142 -8.746 370 HD11 ILE 65 1HD1 ILE 65 -20.368 -1.474 -12.460 371 HD12 ILE 65 2HD1 ILE 65 -20.887 -1.078 -10.789 372 HD13 ILE 65 3HD1 ILE 65 -20.895 0.168 -12.053 373 HA PRO 66 HA PRO 66 -14.552 -1.651 -14.643 374 HB2 PRO 66 2HB PRO 66 -14.615 -4.217 -15.556 375 HB3 PRO 66 3HB PRO 66 -13.508 -3.706 -14.237 376 HG2 PRO 66 2HG PRO 66 -16.222 -5.049 -13.953 377 HG3 PRO 66 3HG PRO 66 -14.667 -5.495 -13.170 378 HD2 PRO 66 2HD PRO 66 -16.548 -3.955 -11.918 379 HD3 PRO 66 3HD PRO 66 -14.798 -3.669 -11.676 380 H THR 67 H THR 67 -15.220 -1.482 -16.730 381 HA THR 67 HA THR 67 -17.606 -2.528 -17.934 382 HB THR 67 HB THR 67 -17.712 0.214 -16.702 383 HG1 THR 67 HG1 THR 67 -18.806 -1.707 -15.979 384 HG21 THR 67 1HG2 THR 67 -19.204 -0.513 -19.270 385 HG22 THR 67 2HG2 THR 67 -18.029 0.812 -19.062 386 HG23 THR 67 3HG2 THR 67 -19.571 0.871 -18.213 387 H GLY 68 H GLY 68 -17.554 -2.183 -20.181 388 HA2 GLY 68 HA2 GLY 68 -14.891 -2.224 -21.108 389 HA3 GLY 68 HA3 GLY 68 -16.341 -2.282 -22.126 390 H THR 69 H THR 69 -17.081 0.516 -21.082 391 HA THR 69 HA THR 69 -15.413 2.141 -22.923 392 HB THR 69 HB THR 69 -17.140 3.897 -22.385 393 HG1 THR 69 HG1 THR 69 -18.976 3.199 -21.291 394 HG21 THR 69 1HG2 THR 69 -18.257 1.260 -23.458 395 HG22 THR 69 2HG2 THR 69 -17.312 2.452 -24.395 396 HG23 THR 69 3HG2 THR 69 -18.893 2.894 -23.749 397 H GLY 70 H GLY 70 -15.364 1.372 -19.625 398 HA2 GLY 70 HA2 GLY 70 -13.336 2.748 -18.557 399 HA3 GLY 70 HA3 GLY 70 -14.514 4.048 -18.674 400 H ALA 71 H ALA 71 -13.410 3.131 -16.193 401 HA ALA 71 HA ALA 71 -15.142 1.245 -14.885 402 HB1 ALA 71 1HB ALA 71 -13.834 1.699 -12.980 403 HB2 ALA 71 2HB ALA 71 -12.722 1.881 -14.322 404 HB3 ALA 71 3HB ALA 71 -13.383 3.323 -13.546 405 H LEU 72 H LEU 72 -16.618 1.769 -13.103 406 HA LEU 72 HA LEU 72 -17.999 4.411 -13.338 407 HB2 LEU 72 2HB LEU 72 -18.968 1.789 -14.096 408 HB3 LEU 72 3HB LEU 72 -19.830 2.269 -12.642 409 HG LEU 72 HG LEU 72 -20.584 4.347 -13.732 410 HD11 LEU 72 1HD1 LEU 72 -18.993 3.277 -16.113 411 HD12 LEU 72 2HD1 LEU 72 -18.791 4.832 -15.284 412 HD13 LEU 72 3HD1 LEU 72 -20.245 4.535 -16.242 413 HD21 LEU 72 1HD2 LEU 72 -21.098 1.828 -15.369 414 HD22 LEU 72 2HD2 LEU 72 -22.132 3.276 -15.318 415 HD23 LEU 72 3HD2 LEU 72 -21.934 2.281 -13.864 416 H LEU 73 H LEU 73 -18.811 5.309 -11.456 417 HA LEU 73 HA LEU 73 -17.554 4.633 -9.043 418 HB2 LEU 73 2HB LEU 73 -18.479 6.834 -9.776 419 HB3 LEU 73 3HB LEU 73 -20.088 6.285 -9.339 420 HG LEU 73 HG LEU 73 -18.883 7.803 -7.716 421 HD11 LEU 73 1HD1 LEU 73 -19.643 6.723 -5.690 422 HD12 LEU 73 2HD1 LEU 73 -19.715 5.144 -6.491 423 HD13 LEU 73 3HD1 LEU 73 -20.817 6.464 -6.988 424 HD21 LEU 73 1HD2 LEU 73 -17.265 5.360 -6.903 425 HD22 LEU 73 2HD2 LEU 73 -17.138 7.016 -6.293 426 HD23 LEU 73 3HD2 LEU 73 -16.639 6.650 -7.949 427 H GLY 74 H GLY 74 -17.662 2.888 -7.959 428 HA2 GLY 74 HA2 GLY 74 -20.206 1.447 -7.413 429 HA3 GLY 74 HA3 GLY 74 -18.543 0.886 -7.086 430 H SER 75 H SER 75 -17.524 3.177 -5.719 431 HA SER 75 HA SER 75 -19.314 3.990 -3.548 432 HB2 SER 75 2HB SER 75 -17.156 1.908 -3.082 433 HB3 SER 75 3HB SER 75 -17.610 3.059 -1.823 434 HG SER 75 HG SER 75 -19.536 1.436 -3.140 435 H LEU 76 H LEU 76 -18.484 5.722 -2.360 436 HA LEU 76 HA LEU 76 -15.737 6.673 -3.010 437 HB2 LEU 76 2HB LEU 76 -17.520 7.880 -4.287 438 HB3 LEU 76 3HB LEU 76 -18.213 8.439 -2.777 439 HG LEU 76 HG LEU 76 -15.279 8.950 -3.217 440 HD11 LEU 76 1HD1 LEU 76 -15.789 10.978 -4.599 441 HD12 LEU 76 2HD1 LEU 76 -17.466 10.383 -4.758 442 HD13 LEU 76 3HD1 LEU 76 -16.115 9.444 -5.423 443 HD21 LEU 76 1HD2 LEU 76 -17.524 10.709 -2.148 444 HD22 LEU 76 2HD2 LEU 76 -15.799 11.116 -2.161 445 HD23 LEU 76 3HD2 LEU 76 -16.376 9.779 -1.153 446 H THR 77 H THR 77 -14.570 6.969 -1.290 447 HA THR 77 HA THR 77 -15.746 7.057 1.477 448 HB THR 77 HB THR 77 -13.099 6.012 0.362 449 HG1 THR 77 HG1 THR 77 -14.971 4.685 0.167 450 HG21 THR 77 1HG2 THR 77 -12.683 5.225 2.704 451 HG22 THR 77 2HG2 THR 77 -14.036 6.235 3.266 452 HG23 THR 77 3HG2 THR 77 -12.586 6.973 2.539 453 H VAL 78 H VAL 78 -15.399 8.988 2.558 454 HA VAL 78 HA VAL 78 -13.297 10.839 1.532 455 HB VAL 78 HB VAL 78 -14.090 12.498 3.096 456 HG11 VAL 78 1HG1 VAL 78 -16.163 13.068 1.916 457 HG12 VAL 78 2HG1 VAL 78 -14.995 12.397 0.774 458 HG13 VAL 78 3HG1 VAL 78 -16.345 11.397 1.351 459 HG21 VAL 78 1HG2 VAL 78 -16.330 10.562 3.792 460 HG22 VAL 78 2HG2 VAL 78 -15.064 11.149 4.889 461 HG23 VAL 78 3HG2 VAL 78 -16.258 12.277 4.243 462 H LEU 79 H LEU 79 -11.334 11.117 2.584 463 HA LEU 79 HA LEU 79 -10.932 9.482 5.060 464 HB2 LEU 79 2HB LEU 79 -9.650 8.772 3.106 465 HB3 LEU 79 3HB LEU 79 -8.973 10.380 2.924 466 HG LEU 79 HG LEU 79 -7.736 10.188 5.015 467 HD11 LEU 79 1HD1 LEU 79 -7.656 8.001 6.235 468 HD12 LEU 79 2HD1 LEU 79 -9.041 7.437 5.286 469 HD13 LEU 79 3HD1 LEU 79 -9.214 8.820 6.397 470 HD21 LEU 79 1HD2 LEU 79 -7.404 7.650 3.340 471 HD22 LEU 79 2HD2 LEU 79 -6.163 8.444 4.320 472 HD23 LEU 79 3HD2 LEU 79 -6.798 9.244 2.865 473 H ASP 80 H ASP 80 -10.168 12.670 3.588 474 HA ASP 80 HA ASP 80 -11.004 14.069 5.885 475 HB2 ASP 80 2HB ASP 80 -8.440 13.145 6.391 476 HB3 ASP 80 3HB ASP 80 -8.098 14.679 5.622 477 H GLY 81 H GLY 81 -10.528 16.468 5.716 478 HA2 GLY 81 HA2 GLY 81 -9.113 17.869 3.948 479 HA3 GLY 81 HA3 GLY 81 -10.474 17.445 2.923 480 H ASP 82 H ASP 82 -10.313 19.903 2.967 481 HA ASP 82 HA ASP 82 -12.022 21.098 5.085 482 HB2 ASP 82 2HB ASP 82 -10.126 22.428 4.359 483 HB3 ASP 82 3HB ASP 82 -10.578 22.221 2.685 484 H SER 83 H SER 83 -14.084 20.747 4.868 485 HA SER 83 HA SER 83 -14.951 18.821 3.240 486 HB2 SER 83 2HB SER 83 -16.789 20.826 4.585 487 HB3 SER 83 3HB SER 83 -17.136 19.128 4.224 488 HG SER 83 HG SER 83 -16.498 19.471 6.434 489 H ARG 84 H ARG 84 -15.117 22.163 2.247 490 HA ARG 84 HA ARG 84 -17.274 22.015 0.428 491 HB2 ARG 84 2HB ARG 84 -16.187 24.103 1.191 492 HB3 ARG 84 3HB ARG 84 -14.739 23.695 0.273 493 HG2 ARG 84 2HG ARG 84 -16.116 25.381 -0.845 494 HG3 ARG 84 3HG ARG 84 -15.969 23.935 -1.845 495 HD2 ARG 84 2HD ARG 84 -18.231 23.227 -1.182 496 HD3 ARG 84 3HD ARG 84 -18.350 24.607 -0.070 497 HE ARG 84 HE ARG 84 -17.759 25.549 -2.701 498 HH11 ARG 84 1HH1 ARG 84 -19.345 26.488 -4.002 499 HH12 ARG 84 2HH1 ARG 84 -21.023 26.198 -3.670 500 HH21 ARG 84 1HH2 ARG 84 -20.476 24.142 -0.938 501 HH22 ARG 84 2HH2 ARG 84 -21.657 24.894 -1.959 502 H LEU 85 H LEU 85 -13.953 20.689 0.051 503 HA LEU 85 HA LEU 85 -14.452 20.218 -2.828 504 HB2 LEU 85 2HB LEU 85 -12.220 20.789 -2.171 505 HB3 LEU 85 3HB LEU 85 -12.147 19.441 -1.020 506 HG LEU 85 HG LEU 85 -12.139 17.811 -2.775 507 HD11 LEU 85 1HD1 LEU 85 -13.674 18.836 -4.477 508 HD12 LEU 85 2HD1 LEU 85 -12.138 18.348 -5.188 509 HD13 LEU 85 3HD1 LEU 85 -12.442 20.056 -4.825 510 HD21 LEU 85 1HD2 LEU 85 -10.034 19.131 -2.232 511 HD22 LEU 85 2HD2 LEU 85 -10.336 20.090 -3.683 512 HD23 LEU 85 3HD2 LEU 85 -10.030 18.349 -3.835 513 H CYS 86 H CYS 86 -14.124 18.059 0.111 514 HA CYS 86 HA CYS 86 -15.048 15.686 -0.876 515 HB2 CYS 86 2HB CYS 86 -16.082 16.983 1.689 516 HB3 CYS 86 3HB CYS 86 -15.986 15.260 1.322 517 HG CYS 86 HG CYS 86 -13.319 15.261 1.006 518 H ALA 87 H ALA 87 -17.211 18.398 0.062 519 HA ALA 87 HA ALA 87 -19.661 17.127 -0.652 520 HB1 ALA 87 1HB ALA 87 -19.409 19.032 0.927 521 HB2 ALA 87 2HB ALA 87 -18.949 20.096 -0.421 522 HB3 ALA 87 3HB ALA 87 -20.583 19.394 -0.345 523 H ALA 88 H ALA 88 -17.335 18.733 -2.722 524 HA ALA 88 HA ALA 88 -19.260 19.119 -4.899 525 HB1 ALA 88 1HB ALA 88 -16.300 19.826 -4.616 526 HB2 ALA 88 2HB ALA 88 -17.373 20.321 -5.937 527 HB3 ALA 88 3HB ALA 88 -17.674 20.920 -4.301 528 H THR 89 H THR 89 -16.142 17.411 -4.374 529 HA THR 89 HA THR 89 -16.013 16.030 -6.860 530 HB THR 89 HB THR 89 -14.144 16.322 -5.274 531 HG1 THR 89 HG1 THR 89 -13.326 14.262 -5.795 532 HG21 THR 89 1HG2 THR 89 -15.142 13.843 -3.824 533 HG22 THR 89 2HG2 THR 89 -15.430 15.466 -3.193 534 HG23 THR 89 3HG2 THR 89 -13.769 14.896 -3.416 535 H LYS 90 H LYS 90 -17.413 14.971 -3.790 536 HA LYS 90 HA LYS 90 -18.233 12.371 -4.336 537 HB2 LYS 90 2HB LYS 90 -18.331 13.485 -2.186 538 HB3 LYS 90 3HB LYS 90 -19.459 14.700 -2.815 539 HG2 LYS 90 2HG LYS 90 -21.046 12.593 -3.152 540 HG3 LYS 90 3HG LYS 90 -19.965 11.846 -1.970 541 HD2 LYS 90 2HD LYS 90 -21.396 14.520 -1.668 542 HD3 LYS 90 3HD LYS 90 -22.009 13.014 -0.996 543 HE2 LYS 90 2HE LYS 90 -19.328 14.300 -0.256 544 HE3 LYS 90 3HE LYS 90 -20.836 14.526 0.641 545 HZ1 LYS 90 HZ1 LYS 90 -19.498 12.780 1.647 546 HZ2 LYS 90 HZ2 LYS 90 -19.483 11.908 0.271 547 HZ3 LYS 90 HZ3 LYS 90 -20.887 12.137 1.088 548 H ARG 91 H ARG 91 -19.963 15.385 -5.067 549 HA ARG 91 HA ARG 91 -22.210 14.099 -6.344 550 HB2 ARG 91 2HB ARG 91 -21.250 16.989 -6.518 551 HB3 ARG 91 3HB ARG 91 -22.823 16.395 -7.076 552 HG2 ARG 91 2HG ARG 91 -23.458 15.758 -4.792 553 HG3 ARG 91 3HG ARG 91 -21.864 16.217 -4.189 554 HD2 ARG 91 2HD ARG 91 -22.312 18.569 -5.060 555 HD3 ARG 91 3HD ARG 91 -23.981 18.070 -5.355 556 HE ARG 91 HE ARG 91 -22.548 18.361 -2.763 557 HH11 ARG 91 1HH1 ARG 91 -25.644 17.569 -4.303 558 HH12 ARG 91 2HH1 ARG 91 -26.530 17.740 -2.821 559 HH21 ARG 91 1HH2 ARG 91 -23.763 18.598 -0.889 560 HH22 ARG 91 2HH2 ARG 91 -25.480 18.328 -0.918 561 H ALA 92 H ALA 92 -19.247 15.638 -7.669 562 HA ALA 92 HA ALA 92 -19.858 15.350 -10.434 563 HB1 ALA 92 1HB ALA 92 -17.167 15.406 -8.990 564 HB2 ALA 92 2HB ALA 92 -17.405 15.580 -10.734 565 HB3 ALA 92 3HB ALA 92 -18.073 16.788 -9.635 566 H VAL 93 H VAL 93 -17.983 13.168 -8.299 567 HA VAL 93 HA VAL 93 -17.597 11.168 -10.258 568 HB VAL 93 HB VAL 93 -17.781 10.366 -7.351 569 HG11 VAL 93 1HG1 VAL 93 -15.966 8.904 -7.960 570 HG12 VAL 93 2HG1 VAL 93 -17.198 8.730 -9.212 571 HG13 VAL 93 3HG1 VAL 93 -15.762 9.713 -9.529 572 HG21 VAL 93 1HG2 VAL 93 -16.418 12.067 -6.796 573 HG22 VAL 93 2HG2 VAL 93 -15.149 11.149 -7.584 574 HG23 VAL 93 3HG2 VAL 93 -15.978 12.411 -8.484 575 H ALA 94 H ALA 94 -20.390 11.853 -8.375 576 HA ALA 94 HA ALA 94 -21.696 9.238 -8.760 577 HB1 ALA 94 1HB ALA 94 -22.756 11.875 -7.654 578 HB2 ALA 94 2HB ALA 94 -23.588 10.316 -7.599 579 HB3 ALA 94 3HB ALA 94 -22.079 10.535 -6.697 580 H GLN 95 H GLN 95 -21.140 11.963 -10.747 581 HA GLN 95 HA GLN 95 -23.511 11.315 -12.456 582 HB2 GLN 95 2HB GLN 95 -23.890 13.640 -12.886 583 HB3 GLN 95 3HB GLN 95 -23.912 13.337 -11.150 584 HG2 GLN 95 2HG GLN 95 -22.624 15.318 -11.266 585 HG3 GLN 95 3HG GLN 95 -21.462 14.084 -11.138 586 HE21 GLN 95 1HE2 GLN 95 -19.811 14.166 -12.687 587 HE22 GLN 95 2HE2 GLN 95 -19.926 15.180 -14.141 588 H VAL 96 H VAL 96 -20.062 11.693 -12.403 589 HA VAL 96 HA VAL 96 -19.556 12.295 -15.133 590 HB VAL 96 HB VAL 96 -17.471 10.907 -14.820 591 HG11 VAL 96 1HG1 VAL 96 -17.849 12.929 -12.597 592 HG12 VAL 96 2HG1 VAL 96 -16.347 12.447 -13.349 593 HG13 VAL 96 3HG1 VAL 96 -17.553 13.343 -14.301 594 HG21 VAL 96 1HG2 VAL 96 -18.681 10.379 -12.105 595 HG22 VAL 96 2HG2 VAL 96 -18.008 9.228 -13.267 596 HG23 VAL 96 3HG2 VAL 96 -16.956 10.362 -12.379 597 H ASN 97 H ASN 97 -19.280 11.101 -16.968 598 HA ASN 97 HA ASN 97 -21.211 9.072 -17.386 599 HB2 ASN 97 2HB ASN 97 -18.918 10.003 -19.167 600 HB3 ASN 97 3HB ASN 97 -20.286 9.003 -19.683 601 HD21 ASN 97 1HD2 ASN 97 -22.493 9.945 -19.600 602 HD22 ASN 97 2HD2 ASN 97 -22.663 11.686 -19.704 603 H SER 98 H SER 98 -17.661 8.789 -17.204 604 HA SER 98 HA SER 98 -17.307 6.244 -16.203 605 HB2 SER 98 2HB SER 98 -16.640 4.958 -18.293 606 HB3 SER 98 3HB SER 98 -18.380 5.119 -18.037 607 HG SER 98 HG SER 98 -16.803 6.769 -19.774 608 H PHE 99 H PHE 99 -15.133 5.818 -15.924 609 HA PHE 99 HA PHE 99 -13.352 8.027 -16.628 610 HB2 PHE 99 2HB PHE 99 -12.800 5.561 -14.951 611 HB3 PHE 99 3HB PHE 99 -11.894 7.078 -14.966 612 HD1 PHE 99 HD1 PHE 99 -14.695 5.265 -13.508 613 HD2 PHE 99 HD2 PHE 99 -13.106 9.228 -14.212 614 HE1 PHE 99 HE1 PHE 99 -16.259 6.186 -11.851 615 HE2 PHE 99 HE2 PHE 99 -14.644 10.124 -12.507 616 HZ PHE 99 HZ PHE 99 -16.218 8.579 -11.319 617 HA PRO 100 HA PRO 100 -12.087 5.387 -20.058 618 HB2 PRO 100 2HB PRO 100 -10.547 7.114 -21.514 619 HB3 PRO 100 3HB PRO 100 -12.331 7.239 -21.404 620 HG2 PRO 100 2HG PRO 100 -10.248 8.779 -19.808 621 HG3 PRO 100 3HG PRO 100 -11.686 9.423 -20.665 622 HD2 PRO 100 2HD PRO 100 -11.695 8.871 -17.982 623 HD3 PRO 100 3HD PRO 100 -13.144 8.644 -19.009 624 H LEU 101 H LEU 101 -10.566 3.807 -19.974 625 HA LEU 101 HA LEU 101 -8.416 3.968 -18.163 626 HB2 LEU 101 2HB LEU 101 -8.627 1.809 -20.266 627 HB3 LEU 101 3HB LEU 101 -8.085 1.726 -18.609 628 HG LEU 101 HG LEU 101 -9.975 0.487 -18.710 629 HD11 LEU 101 1HD1 LEU 101 -11.600 1.511 -17.182 630 HD12 LEU 101 2HD1 LEU 101 -10.849 3.101 -17.465 631 HD13 LEU 101 3HD1 LEU 101 -9.920 1.801 -16.705 632 HD21 LEU 101 1HD2 LEU 101 -12.107 0.942 -19.608 633 HD22 LEU 101 2HD2 LEU 101 -10.888 1.268 -20.847 634 HD23 LEU 101 3HD2 LEU 101 -11.687 2.610 -20.002 635 HA PRO 102 HA PRO 102 -5.156 5.320 -21.000 636 HB2 PRO 102 2HB PRO 102 -2.917 4.700 -19.555 637 HB3 PRO 102 3HB PRO 102 -4.019 6.053 -19.131 638 HG2 PRO 102 2HG PRO 102 -3.941 3.264 -17.954 639 HG3 PRO 102 3HG PRO 102 -4.045 4.818 -17.084 640 HD2 PRO 102 2HD PRO 102 -6.231 3.259 -17.639 641 HD3 PRO 102 3HD PRO 102 -6.323 5.046 -17.604 642 H LYS 103 H LYS 103 -4.756 2.118 -19.406 643 HA LYS 103 HA LYS 103 -4.682 0.837 -22.088 644 HB2 LYS 103 2HB LYS 103 -2.996 0.158 -19.647 645 HB3 LYS 103 3HB LYS 103 -3.491 -1.083 -20.779 646 HG2 LYS 103 2HG LYS 103 -1.449 -0.578 -21.655 647 HG3 LYS 103 3HG LYS 103 -2.493 0.441 -22.632 648 HD2 LYS 103 2HD LYS 103 -0.563 1.706 -22.043 649 HD3 LYS 103 3HD LYS 103 -1.901 2.380 -21.102 650 HE2 LYS 103 2HE LYS 103 -1.182 1.142 -19.109 651 HE3 LYS 103 3HE LYS 103 0.063 0.293 -20.037 652 HZ1 LYS 103 HZ1 LYS 103 0.022 3.216 -19.531 653 HZ2 LYS 103 HZ2 LYS 103 1.172 2.416 -20.383 654 HZ3 LYS 103 HZ3 LYS 103 0.992 2.131 -18.782 655 H ASP 104 H ASP 104 -5.865 -1.132 -22.183 656 HA ASP 104 HA ASP 104 -8.221 -1.007 -20.408 657 HB2 ASP 104 2HB ASP 104 -9.478 -1.560 -22.302 658 HB3 ASP 104 3HB ASP 104 -8.275 -0.408 -22.874 659 H GLN 105 H GLN 105 -5.720 -2.953 -20.063 660 HA GLN 105 HA GLN 105 -6.872 -5.531 -20.775 661 HB2 GLN 105 2HB GLN 105 -4.245 -4.859 -19.388 662 HB3 GLN 105 3HB GLN 105 -4.786 -6.474 -19.820 663 HG2 GLN 105 2HG GLN 105 -3.468 -6.070 -21.615 664 HG3 GLN 105 3HG GLN 105 -5.002 -5.493 -22.266 665 HE21 GLN 105 1HE2 GLN 105 -5.126 -3.208 -22.865 666 HE22 GLN 105 2HE2 GLN 105 -3.712 -2.184 -22.667 667 HA PRO 106 HA PRO 106 -8.765 -6.201 -16.812 668 HB2 PRO 106 2HB PRO 106 -8.740 -8.947 -16.570 669 HB3 PRO 106 3HB PRO 106 -9.801 -8.051 -17.698 670 HG2 PRO 106 2HG PRO 106 -7.106 -9.324 -18.308 671 HG3 PRO 106 3HG PRO 106 -8.649 -9.505 -19.207 672 HD2 PRO 106 2HD PRO 106 -6.787 -7.742 -20.013 673 HD3 PRO 106 3HD PRO 106 -8.520 -7.315 -20.075 674 H ASP 107 H ASP 107 -5.450 -6.760 -17.319 675 HA ASP 107 HA ASP 107 -4.831 -7.482 -14.514 676 HB2 ASP 107 2HB ASP 107 -3.463 -8.347 -16.403 677 HB3 ASP 107 3HB ASP 107 -3.030 -6.693 -16.832 678 H VAL 108 H VAL 108 -4.968 -4.625 -16.597 679 HA VAL 108 HA VAL 108 -3.809 -2.891 -14.462 680 HB VAL 108 HB VAL 108 -3.578 -1.182 -16.061 681 HG11 VAL 108 1HG1 VAL 108 -1.819 -2.941 -16.067 682 HG12 VAL 108 2HG1 VAL 108 -2.652 -3.751 -17.417 683 HG13 VAL 108 3HG1 VAL 108 -1.977 -2.127 -17.641 684 HG21 VAL 108 1HG2 VAL 108 -4.901 -2.879 -18.169 685 HG22 VAL 108 2HG2 VAL 108 -5.623 -1.449 -17.390 686 HG23 VAL 108 3HG2 VAL 108 -4.178 -1.286 -18.382 687 H VAL 109 H VAL 109 -6.872 -3.503 -16.135 688 HA VAL 109 HA VAL 109 -8.354 -1.298 -15.145 689 HB VAL 109 HB VAL 109 -9.117 -4.192 -15.673 690 HG11 VAL 109 1HG1 VAL 109 -11.497 -3.385 -15.836 691 HG12 VAL 109 2HG1 VAL 109 -10.861 -3.384 -14.193 692 HG13 VAL 109 3HG1 VAL 109 -10.993 -1.850 -15.082 693 HG21 VAL 109 1HG2 VAL 109 -10.042 -3.276 -17.775 694 HG22 VAL 109 2HG2 VAL 109 -9.687 -1.621 -17.259 695 HG23 VAL 109 3HG2 VAL 109 -8.366 -2.722 -17.646 696 H GLU 110 H GLU 110 -7.036 -4.069 -13.489 697 HA GLU 110 HA GLU 110 -8.618 -3.897 -11.053 698 HB2 GLU 110 2HB GLU 110 -6.068 -5.302 -11.792 699 HB3 GLU 110 3HB GLU 110 -6.872 -5.508 -10.238 700 HG2 GLU 110 2HG GLU 110 -8.421 -6.007 -12.808 701 HG3 GLU 110 3HG GLU 110 -7.332 -7.212 -12.125 702 H LYS 111 H LYS 111 -6.014 -1.989 -12.267 703 HA LYS 111 HA LYS 111 -4.915 -1.367 -9.556 704 HB2 LYS 111 2HB LYS 111 -3.859 -1.106 -12.379 705 HB3 LYS 111 3HB LYS 111 -3.207 -0.108 -11.087 706 HG2 LYS 111 2HG LYS 111 -1.906 -2.142 -11.548 707 HG3 LYS 111 3HG LYS 111 -2.371 -1.937 -9.866 708 HD2 LYS 111 2HD LYS 111 -4.031 -3.645 -9.977 709 HD3 LYS 111 3HD LYS 111 -3.961 -3.717 -11.738 710 HE2 LYS 111 2HE LYS 111 -1.589 -4.402 -9.961 711 HE3 LYS 111 3HE LYS 111 -2.833 -5.578 -10.381 712 HZ1 LYS 111 HZ1 LYS 111 -1.033 -5.755 -11.953 713 HZ2 LYS 111 HZ2 LYS 111 -1.111 -4.170 -12.349 714 HZ3 LYS 111 HZ3 LYS 111 -2.341 -5.172 -12.745 715 H LEU 112 H LEU 112 -6.443 0.103 -12.315 716 HA LEU 112 HA LEU 112 -6.341 2.818 -11.219 717 HB2 LEU 112 2HB LEU 112 -7.611 3.420 -13.299 718 HB3 LEU 112 3HB LEU 112 -6.097 2.641 -13.521 719 HG LEU 112 HG LEU 112 -7.339 0.513 -13.787 720 HD11 LEU 112 1HD1 LEU 112 -9.507 1.131 -12.995 721 HD12 LEU 112 2HD1 LEU 112 -9.557 0.443 -14.606 722 HD13 LEU 112 3HD1 LEU 112 -9.716 2.195 -14.423 723 HD21 LEU 112 1HD2 LEU 112 -6.184 1.554 -15.641 724 HD22 LEU 112 2HD2 LEU 112 -7.591 2.614 -15.937 725 HD23 LEU 112 3HD2 LEU 112 -7.698 0.848 -16.202 726 H LYS 113 H LYS 113 -8.581 0.164 -10.944 727 HA LYS 113 HA LYS 113 -10.952 1.636 -10.503 728 HB2 LYS 113 2HB LYS 113 -11.772 -0.454 -9.456 729 HB3 LYS 113 3HB LYS 113 -11.057 -0.691 -11.054 730 HG2 LYS 113 2HG LYS 113 -9.096 -1.676 -10.171 731 HG3 LYS 113 3HG LYS 113 -9.385 -1.058 -8.544 732 HD2 LYS 113 2HD LYS 113 -9.727 -3.561 -9.014 733 HD3 LYS 113 3HD LYS 113 -10.898 -2.696 -8.013 734 HE2 LYS 113 2HE LYS 113 -12.483 -2.528 -9.795 735 HE3 LYS 113 3HE LYS 113 -11.314 -3.121 -10.995 736 HZ1 LYS 113 HZ1 LYS 113 -11.347 -5.266 -9.971 737 HZ2 LYS 113 HZ2 LYS 113 -12.897 -4.856 -10.263 738 HZ3 LYS 113 HZ3 LYS 113 -12.314 -4.758 -8.731 739 H ASN 114 H ASN 114 -8.326 1.104 -8.343 740 HA ASN 114 HA ASN 114 -9.945 2.244 -6.090 741 HB2 ASN 114 2HB ASN 114 -7.695 0.264 -5.743 742 HB3 ASN 114 3HB ASN 114 -8.770 0.922 -4.497 743 HD21 ASN 114 1HD2 ASN 114 -11.302 0.584 -5.889 744 HD22 ASN 114 2HD2 ASN 114 -11.564 -1.154 -5.987 745 H ILE 115 H ILE 115 -9.331 4.367 -6.481 746 HA ILE 115 HA ILE 115 -6.441 5.031 -6.060 747 HB ILE 115 HB ILE 115 -6.798 7.064 -7.319 748 HG12 ILE 115 2HG1 ILE 115 -9.289 7.225 -6.967 749 HG13 ILE 115 3HG1 ILE 115 -8.677 7.637 -8.523 750 HG21 ILE 115 1HG2 ILE 115 -7.262 4.452 -8.762 751 HG22 ILE 115 2HG2 ILE 115 -6.917 5.992 -9.574 752 HG23 ILE 115 3HG2 ILE 115 -5.738 5.291 -8.461 753 HD11 ILE 115 1HD1 ILE 115 -10.691 6.436 -8.834 754 HD12 ILE 115 2HD1 ILE 115 -9.366 5.413 -9.408 755 HD13 ILE 115 3HD1 ILE 115 -10.127 5.081 -7.847 756 H ASN 116 H ASN 116 -5.877 6.875 -4.912 757 HA ASN 116 HA ASN 116 -8.049 8.161 -3.350 758 HB2 ASN 116 2HB ASN 116 -5.177 8.982 -3.121 759 HB3 ASN 116 3HB ASN 116 -6.532 9.170 -1.996 760 HD21 ASN 116 1HD2 ASN 116 -7.371 6.349 -1.885 761 HD22 ASN 116 2HD2 ASN 116 -6.074 5.541 -1.037 762 H LEU 117 H LEU 117 -8.773 10.119 -3.901 763 HA LEU 117 HA LEU 117 -7.244 11.835 -5.843 764 HB2 LEU 117 2HB LEU 117 -9.985 12.286 -4.607 765 HB3 LEU 117 3HB LEU 117 -9.146 13.385 -5.695 766 HG LEU 117 HG LEU 117 -10.148 10.569 -6.384 767 HD11 LEU 117 1HD1 LEU 117 -11.963 12.202 -6.005 768 HD12 LEU 117 2HD1 LEU 117 -11.857 11.763 -7.725 769 HD13 LEU 117 3HD1 LEU 117 -11.208 13.322 -7.165 770 HD21 LEU 117 1HD2 LEU 117 -8.896 12.683 -8.168 771 HD22 LEU 117 2HD2 LEU 117 -9.688 11.204 -8.749 772 HD23 LEU 117 3HD2 LEU 117 -8.219 11.086 -7.781 773 H THR 118 H THR 118 -5.686 12.898 -4.792 774 HA THR 118 HA THR 118 -6.206 14.018 -2.089 775 HB THR 118 HB THR 118 -3.691 12.523 -2.907 776 HG1 THR 118 HG1 THR 118 -4.420 11.135 -1.251 777 HG21 THR 118 1HG2 THR 118 -4.444 14.073 -0.390 778 HG22 THR 118 2HG2 THR 118 -3.051 14.348 -1.459 779 HG23 THR 118 3HG2 THR 118 -3.108 12.893 -0.457 780 H VAL 119 H VAL 119 -5.755 16.060 -1.944 781 HA VAL 119 HA VAL 119 -4.062 17.424 -3.978 782 HB VAL 119 HB VAL 119 -5.668 19.058 -4.373 783 HG11 VAL 119 1HG1 VAL 119 -6.072 16.935 -5.620 784 HG12 VAL 119 2HG1 VAL 119 -7.281 16.488 -4.384 785 HG13 VAL 119 3HG1 VAL 119 -7.536 17.918 -5.403 786 HG21 VAL 119 1HG2 VAL 119 -7.527 17.865 -2.304 787 HG22 VAL 119 2HG2 VAL 119 -6.620 19.391 -2.125 788 HG23 VAL 119 3HG2 VAL 119 -7.852 19.256 -3.369 789 H ALA 120 H ALA 120 -3.355 19.534 -3.392 790 HA ALA 120 HA ALA 120 -3.528 20.621 -0.719 791 HB1 ALA 120 1HB ALA 120 -0.952 19.187 -1.574 792 HB2 ALA 120 2HB ALA 120 -1.114 20.188 -0.121 793 HB3 ALA 120 3HB ALA 120 -2.029 18.690 -0.260 794 HA PRO 121 HA PRO 121 -2.483 24.328 -2.681 795 HB2 PRO 121 2HB PRO 121 -0.147 24.841 -0.834 796 HB3 PRO 121 3HB PRO 121 -1.517 25.916 -1.238 797 HG2 PRO 121 2HG PRO 121 -1.515 24.589 1.106 798 HG3 PRO 121 3HG PRO 121 -3.017 24.622 0.129 799 HD2 PRO 121 2HD PRO 121 -0.924 22.450 0.267 800 HD3 PRO 121 3HD PRO 121 -2.706 22.292 0.403 801 H GLU 122 H GLU 122 0.474 22.377 -2.162 802 HA GLU 122 HA GLU 122 1.966 23.635 -4.344 803 HB2 GLU 122 2HB GLU 122 2.455 21.077 -2.753 804 HB3 GLU 122 3HB GLU 122 3.569 21.779 -3.945 805 HG2 GLU 122 2HG GLU 122 3.680 23.881 -2.579 806 HG3 GLU 122 3HG GLU 122 2.692 23.090 -1.341 Start of MODEL 14 1 H1 ALA 22 H ALA 22 15.494 4.988 -20.564 2 HA ALA 22 HA ALA 22 13.774 3.043 -21.679 3 HB1 ALA 22 1HB ALA 22 15.521 1.353 -22.374 4 HB2 ALA 22 2HB ALA 22 15.402 2.724 -23.482 5 HB3 ALA 22 3HB ALA 22 16.742 2.636 -22.323 6 H ALA 23 H ALA 23 13.199 1.811 -19.973 7 HA ALA 23 HA ALA 23 15.114 0.948 -17.935 8 HB1 ALA 23 1HB ALA 23 13.005 3.017 -17.141 9 HB2 ALA 23 2HB ALA 23 14.129 2.185 -16.064 10 HB3 ALA 23 3HB ALA 23 14.755 3.317 -17.286 11 H ARG 24 H ARG 24 11.647 1.601 -17.511 12 HA ARG 24 HA ARG 24 9.828 0.386 -17.242 13 HB2 ARG 24 2HB ARG 24 11.303 -1.946 -18.496 14 HB3 ARG 24 3HB ARG 24 9.554 -1.818 -18.257 15 HG2 ARG 24 2HG ARG 24 9.414 0.140 -19.695 16 HG3 ARG 24 3HG ARG 24 11.165 0.151 -19.928 17 HD2 ARG 24 2HD ARG 24 9.292 -2.059 -20.801 18 HD3 ARG 24 3HD ARG 24 9.970 -0.805 -21.844 19 HE ARG 24 HE ARG 24 11.274 -3.228 -20.946 20 HH11 ARG 24 1HH1 ARG 24 12.047 0.106 -21.928 21 HH12 ARG 24 2HH1 ARG 24 13.603 -0.365 -22.543 22 HH21 ARG 24 1HH2 ARG 24 13.322 -3.714 -21.669 23 HH22 ARG 24 2HH2 ARG 24 14.339 -2.479 -22.338 24 H GLN 25 H GLN 25 12.205 0.210 -15.234 25 HA GLN 25 HA GLN 25 11.424 -2.199 -13.681 26 HB2 GLN 25 2HB GLN 25 13.627 -0.227 -13.033 27 HB3 GLN 25 3HB GLN 25 13.425 -1.861 -12.426 28 HG2 GLN 25 2HG GLN 25 14.186 -1.049 -15.259 29 HG3 GLN 25 3HG GLN 25 15.230 -1.777 -14.058 30 HE21 GLN 25 1HE2 GLN 25 13.427 -2.474 -16.810 31 HE22 GLN 25 2HE2 GLN 25 13.174 -4.191 -16.505 32 H GLN 26 H GLN 26 10.952 1.213 -13.659 33 HA GLN 26 HA GLN 26 9.624 1.208 -10.987 34 HB2 GLN 26 2HB GLN 26 10.848 3.130 -10.336 35 HB3 GLN 26 3HB GLN 26 11.995 1.878 -10.779 36 HG2 GLN 26 2HG GLN 26 11.179 4.247 -12.533 37 HG3 GLN 26 3HG GLN 26 12.640 4.149 -11.563 38 HE21 GLN 26 1HE2 GLN 26 14.250 2.408 -12.153 39 HE22 GLN 26 2HE2 GLN 26 14.320 1.926 -13.833 40 H PHE 27 H PHE 27 9.477 2.154 -14.270 41 HA PHE 27 HA PHE 27 8.559 4.720 -14.338 42 HB2 PHE 27 2HB PHE 27 8.036 4.377 -16.484 43 HB3 PHE 27 3HB PHE 27 9.248 3.132 -16.204 44 HD1 PHE 27 HD1 PHE 27 5.888 3.930 -17.267 45 HD2 PHE 27 HD2 PHE 27 8.309 0.733 -15.698 46 HE1 PHE 27 HE1 PHE 27 4.172 2.299 -17.972 47 HE2 PHE 27 HE2 PHE 27 6.583 -0.923 -16.438 48 HZ PHE 27 HZ PHE 27 4.516 -0.149 -17.560 49 H VAL 28 H VAL 28 6.684 2.106 -13.156 50 HA VAL 28 HA VAL 28 4.010 2.890 -13.649 51 HB VAL 28 HB VAL 28 3.506 1.800 -11.410 52 HG11 VAL 28 1HG1 VAL 28 3.880 -0.463 -12.309 53 HG12 VAL 28 2HG1 VAL 28 3.350 0.639 -13.592 54 HG13 VAL 28 3HG1 VAL 28 5.065 0.177 -13.465 55 HG21 VAL 28 1HG2 VAL 28 6.445 0.975 -11.478 56 HG22 VAL 28 2HG2 VAL 28 5.728 2.108 -10.312 57 HG23 VAL 28 3HG2 VAL 28 5.203 0.425 -10.345 58 H THR 29 H THR 29 6.347 4.262 -11.426 59 HA THR 29 HA THR 29 4.579 5.937 -9.921 60 HB THR 29 HB THR 29 6.902 5.476 -9.373 61 HG1 THR 29 HG1 THR 29 7.215 7.548 -8.537 62 HG21 THR 29 1HG2 THR 29 8.766 6.629 -10.318 63 HG22 THR 29 2HG2 THR 29 7.721 7.653 -11.334 64 HG23 THR 29 3HG2 THR 29 7.902 5.920 -11.687 65 H SER 30 H SER 30 6.246 6.664 -13.042 66 HA SER 30 HA SER 30 5.008 9.198 -13.434 67 HB2 SER 30 2HB SER 30 5.991 7.202 -15.518 68 HB3 SER 30 3HB SER 30 5.749 8.945 -15.748 69 HG SER 30 HG SER 30 7.952 8.492 -15.326 70 H GLU 31 H GLU 31 3.917 5.890 -14.175 71 HA GLU 31 HA GLU 31 1.570 6.642 -15.650 72 HB2 GLU 31 2HB GLU 31 2.184 4.167 -14.015 73 HB3 GLU 31 3HB GLU 31 0.721 4.354 -14.936 74 HG2 GLU 31 2HG GLU 31 3.360 4.762 -16.343 75 HG3 GLU 31 3HG GLU 31 2.835 3.126 -15.925 76 H VAL 32 H VAL 32 2.186 6.792 -12.106 77 HA VAL 32 HA VAL 32 -0.577 6.879 -11.340 78 HB VAL 32 HB VAL 32 1.754 8.310 -10.007 79 HG11 VAL 32 1HG1 VAL 32 -1.016 7.606 -8.957 80 HG12 VAL 32 2HG1 VAL 32 0.339 8.163 -7.949 81 HG13 VAL 32 3HG1 VAL 32 -0.329 9.238 -9.171 82 HG21 VAL 32 1HG2 VAL 32 2.173 5.887 -10.077 83 HG22 VAL 32 2HG2 VAL 32 1.736 6.359 -8.442 84 HG23 VAL 32 3HG2 VAL 32 0.532 5.556 -9.492 85 H GLY 33 H GLY 33 1.483 9.210 -12.936 86 HA2 GLY 33 HA2 GLY 33 -0.122 11.583 -12.557 87 HA3 GLY 33 HA3 GLY 33 1.119 11.303 -13.795 88 H ARG 34 H ARG 34 -0.586 8.760 -14.564 89 HA ARG 34 HA ARG 34 -2.835 10.107 -16.006 90 HB2 ARG 34 2HB ARG 34 -1.656 7.331 -16.379 91 HB3 ARG 34 3HB ARG 34 -2.935 8.083 -17.331 92 HG2 ARG 34 2HG ARG 34 -1.305 9.856 -18.043 93 HG3 ARG 34 3HG ARG 34 -0.037 9.019 -17.120 94 HD2 ARG 34 2HD ARG 34 -0.435 6.965 -18.455 95 HD3 ARG 34 3HD ARG 34 -1.627 7.832 -19.418 96 HE ARG 34 HE ARG 34 0.206 9.397 -20.087 97 HH11 ARG 34 1HH1 ARG 34 1.333 6.245 -18.882 98 HH12 ARG 34 2HH1 ARG 34 2.594 6.195 -20.090 99 HH21 ARG 34 1HH2 ARG 34 1.825 9.225 -21.543 100 HH22 ARG 34 2HH2 ARG 34 2.920 7.853 -21.519 101 H TYR 35 H TYR 35 -2.147 7.113 -14.150 102 HA TYR 35 HA TYR 35 -4.599 5.916 -14.394 103 HB2 TYR 35 2HB TYR 35 -2.335 5.697 -12.435 104 HB3 TYR 35 3HB TYR 35 -3.846 4.894 -12.022 105 HD1 TYR 35 HD1 TYR 35 -1.782 5.310 -15.169 106 HD2 TYR 35 HD2 TYR 35 -3.947 2.666 -12.552 107 HE1 TYR 35 HE1 TYR 35 -1.263 3.410 -16.671 108 HE2 TYR 35 HE2 TYR 35 -3.570 0.798 -14.106 109 HH TYR 35 HH TYR 35 -1.520 1.192 -17.062 110 H GLY 36 H GLY 36 -3.762 7.961 -11.665 111 HA2 GLY 36 HA2 GLY 36 -6.536 8.016 -10.629 112 HA3 GLY 36 HA3 GLY 36 -5.114 8.841 -9.956 113 H ALA 37 H ALA 37 -4.716 9.833 -12.959 114 HA ALA 37 HA ALA 37 -5.959 12.390 -12.440 115 HB1 ALA 37 1HB ALA 37 -3.634 12.230 -13.241 116 HB2 ALA 37 2HB ALA 37 -4.216 11.494 -14.759 117 HB3 ALA 37 3HB ALA 37 -4.669 13.154 -14.341 118 H ILE 38 H ILE 38 -6.464 9.600 -14.610 119 HA ILE 38 HA ILE 38 -8.314 10.839 -16.399 120 HB ILE 38 HB ILE 38 -9.037 8.601 -16.978 121 HG12 ILE 38 2HG1 ILE 38 -7.846 7.784 -14.305 122 HG13 ILE 38 3HG1 ILE 38 -9.515 7.626 -14.850 123 HG21 ILE 38 1HG2 ILE 38 -7.005 7.707 -17.742 124 HG22 ILE 38 2HG2 ILE 38 -6.606 9.412 -17.476 125 HG23 ILE 38 3HG2 ILE 38 -6.119 8.179 -16.291 126 HD11 ILE 38 1HD1 ILE 38 -8.482 5.472 -14.814 127 HD12 ILE 38 2HD1 ILE 38 -8.841 5.926 -16.483 128 HD13 ILE 38 3HD1 ILE 38 -7.169 6.002 -15.856 129 H TYR 39 H TYR 39 -8.707 9.801 -13.138 130 HA TYR 39 HA TYR 39 -11.635 10.048 -13.159 131 HB2 TYR 39 2HB TYR 39 -9.700 9.714 -10.828 132 HB3 TYR 39 3HB TYR 39 -11.443 9.581 -10.763 133 HD1 TYR 39 HD1 TYR 39 -12.624 7.748 -11.912 134 HD2 TYR 39 HD2 TYR 39 -8.341 7.790 -11.601 135 HE1 TYR 39 HE1 TYR 39 -12.503 5.431 -12.833 136 HE2 TYR 39 HE2 TYR 39 -8.236 5.367 -12.344 137 HH TYR 39 HH TYR 39 -9.515 3.627 -13.170 138 H THR 40 H THR 40 -8.919 11.814 -11.601 139 HA THR 40 HA THR 40 -10.545 13.864 -10.482 140 HB THR 40 HB THR 40 -8.144 13.024 -9.929 141 HG1 THR 40 HG1 THR 40 -7.848 15.032 -8.867 142 HG21 THR 40 1HG2 THR 40 -7.292 15.477 -11.480 143 HG22 THR 40 2HG2 THR 40 -7.262 13.858 -12.191 144 HG23 THR 40 3HG2 THR 40 -6.300 14.181 -10.749 145 H GLN 41 H GLN 41 -8.951 13.697 -13.625 146 HA GLN 41 HA GLN 41 -9.417 16.472 -14.334 147 HB2 GLN 41 2HB GLN 41 -8.671 13.996 -15.931 148 HB3 GLN 41 3HB GLN 41 -8.807 15.592 -16.642 149 HG2 GLN 41 2HG GLN 41 -6.845 14.822 -14.435 150 HG3 GLN 41 3HG GLN 41 -6.441 15.048 -16.124 151 HE21 GLN 41 1HE2 GLN 41 -5.358 16.494 -13.739 152 HE22 GLN 41 2HE2 GLN 41 -5.750 18.173 -14.037 153 H LEU 42 H LEU 42 -11.329 13.491 -14.623 154 HA LEU 42 HA LEU 42 -13.266 14.774 -16.396 155 HB2 LEU 42 2HB LEU 42 -12.809 12.292 -16.343 156 HB3 LEU 42 3HB LEU 42 -13.514 12.260 -14.718 157 HG LEU 42 HG LEU 42 -15.685 13.057 -15.633 158 HD11 LEU 42 1HD1 LEU 42 -14.314 12.806 -18.356 159 HD12 LEU 42 2HD1 LEU 42 -15.000 14.296 -17.641 160 HD13 LEU 42 3HD1 LEU 42 -16.067 12.976 -18.109 161 HD21 LEU 42 1HD2 LEU 42 -16.241 10.960 -16.868 162 HD22 LEU 42 2HD2 LEU 42 -15.375 10.714 -15.353 163 HD23 LEU 42 3HD2 LEU 42 -14.497 10.577 -16.906 164 H ILE 43 H ILE 43 -12.876 14.274 -12.919 165 HA ILE 43 HA ILE 43 -15.489 15.112 -12.098 166 HB ILE 43 HB ILE 43 -12.823 14.594 -10.800 167 HG12 ILE 43 2HG1 ILE 43 -14.301 13.243 -9.312 168 HG13 ILE 43 3HG1 ILE 43 -15.714 13.816 -10.228 169 HG21 ILE 43 1HG2 ILE 43 -15.045 16.064 -9.348 170 HG22 ILE 43 2HG2 ILE 43 -13.610 15.320 -8.603 171 HG23 ILE 43 3HG2 ILE 43 -13.409 16.703 -9.671 172 HD11 ILE 43 1HD1 ILE 43 -14.684 12.668 -12.263 173 HD12 ILE 43 2HD1 ILE 43 -13.504 11.947 -11.123 174 HD13 ILE 43 3HD1 ILE 43 -15.233 11.616 -10.955 175 H ARG 44 H ARG 44 -12.481 16.872 -12.529 176 HA ARG 44 HA ARG 44 -13.516 19.370 -11.498 177 HB2 ARG 44 2HB ARG 44 -11.429 20.335 -12.013 178 HB3 ARG 44 3HB ARG 44 -11.191 18.694 -11.427 179 HG2 ARG 44 2HG ARG 44 -9.646 18.829 -13.110 180 HG3 ARG 44 3HG ARG 44 -10.992 17.971 -13.865 181 HD2 ARG 44 2HD ARG 44 -11.626 19.972 -15.106 182 HD3 ARG 44 3HD ARG 44 -10.473 20.949 -14.183 183 HE ARG 44 HE ARG 44 -8.966 18.906 -15.348 184 HH11 ARG 44 1HH1 ARG 44 -10.907 21.577 -16.655 185 HH12 ARG 44 2HH1 ARG 44 -9.952 21.638 -18.107 186 HH21 ARG 44 1HH2 ARG 44 -7.837 19.049 -17.129 187 HH22 ARG 44 2HH2 ARG 44 -8.209 20.204 -18.397 188 H GLN 45 H GLN 45 -13.865 17.851 -14.495 189 HA GLN 45 HA GLN 45 -14.518 20.090 -16.235 190 HB2 GLN 45 2HB GLN 45 -15.960 17.421 -15.996 191 HB3 GLN 45 3HB GLN 45 -16.076 18.546 -17.341 192 HG2 GLN 45 2HG GLN 45 -13.700 16.873 -16.539 193 HG3 GLN 45 3HG GLN 45 -14.701 16.653 -17.958 194 HE21 GLN 45 1HE2 GLN 45 -11.702 17.399 -17.305 195 HE22 GLN 45 2HE2 GLN 45 -11.406 18.582 -18.583 196 H ASN 46 H ASN 46 -16.286 18.384 -13.612 197 HA ASN 46 HA ASN 46 -18.722 19.963 -14.084 198 HB2 ASN 46 2HB ASN 46 -18.012 18.263 -11.678 199 HB3 ASN 46 3HB ASN 46 -19.610 18.791 -12.194 200 HD21 ASN 46 1HD2 ASN 46 -17.174 16.361 -12.511 201 HD22 ASN 46 2HD2 ASN 46 -18.136 15.373 -13.605 202 H LEU 47 H LEU 47 -15.979 20.068 -11.840 203 HA LEU 47 HA LEU 47 -17.347 21.942 -10.038 204 HB2 LEU 47 2HB LEU 47 -14.766 20.386 -9.790 205 HB3 LEU 47 3HB LEU 47 -15.619 21.241 -8.510 206 HG LEU 47 HG LEU 47 -16.623 18.817 -9.927 207 HD11 LEU 47 1HD1 LEU 47 -14.678 18.523 -8.529 208 HD12 LEU 47 2HD1 LEU 47 -16.108 17.738 -7.816 209 HD13 LEU 47 3HD1 LEU 47 -15.524 19.302 -7.173 210 HD21 LEU 47 1HD2 LEU 47 -18.304 18.806 -7.961 211 HD22 LEU 47 2HD2 LEU 47 -18.616 19.956 -9.282 212 HD23 LEU 47 3HD2 LEU 47 -17.905 20.529 -7.765 213 H LEU 48 H LEU 48 -17.181 23.868 -10.718 214 HA LEU 48 HA LEU 48 -14.747 24.981 -11.888 215 HB2 LEU 48 2HB LEU 48 -16.217 26.962 -12.379 216 HB3 LEU 48 3HB LEU 48 -16.675 25.409 -13.075 217 HG LEU 48 HG LEU 48 -18.491 25.134 -11.510 218 HD11 LEU 48 1HD1 LEU 48 -17.703 27.803 -10.266 219 HD12 LEU 48 2HD1 LEU 48 -17.670 26.204 -9.471 220 HD13 LEU 48 3HD1 LEU 48 -19.213 26.919 -9.959 221 HD21 LEU 48 1HD2 LEU 48 -19.915 26.989 -12.293 222 HD22 LEU 48 2HD2 LEU 48 -18.861 26.390 -13.592 223 HD23 LEU 48 3HD2 LEU 48 -18.465 27.913 -12.759 224 H VAL 49 H VAL 49 -14.434 24.312 -9.189 225 HA VAL 49 HA VAL 49 -14.845 26.766 -7.585 226 HB VAL 49 HB VAL 49 -13.798 24.070 -6.798 227 HG11 VAL 49 1HG1 VAL 49 -13.046 25.643 -5.137 228 HG12 VAL 49 2HG1 VAL 49 -14.651 26.416 -5.064 229 HG13 VAL 49 3HG1 VAL 49 -14.407 24.764 -4.441 230 HG21 VAL 49 1HG2 VAL 49 -16.580 25.279 -6.496 231 HG22 VAL 49 2HG2 VAL 49 -16.143 23.906 -7.540 232 HG23 VAL 49 3HG2 VAL 49 -16.075 23.732 -5.780 233 H GLU 50 H GLU 50 -12.054 24.796 -8.616 234 HA GLU 50 HA GLU 50 -9.887 25.259 -8.955 235 HB2 GLU 50 2HB GLU 50 -10.944 28.073 -9.421 236 HB3 GLU 50 3HB GLU 50 -9.399 27.409 -9.984 237 HG2 GLU 50 2HG GLU 50 -10.731 25.628 -11.223 238 HG3 GLU 50 3HG GLU 50 -12.198 26.522 -10.794 239 H ASP 51 H ASP 51 -10.070 28.550 -7.695 240 HA ASP 51 HA ASP 51 -7.693 28.218 -6.184 241 HB2 ASP 51 2HB ASP 51 -8.572 30.328 -7.206 242 HB3 ASP 51 3HB ASP 51 -9.827 30.371 -5.972 243 H SER 52 H SER 52 -11.030 27.686 -5.217 244 HA SER 52 HA SER 52 -10.275 27.468 -2.334 245 HB2 SER 52 2HB SER 52 -12.983 27.234 -3.640 246 HB3 SER 52 3HB SER 52 -12.654 27.187 -1.902 247 HG SER 52 HG SER 52 -11.958 29.349 -2.022 248 H PHE 53 H PHE 53 -10.069 25.361 -4.931 249 HA PHE 53 HA PHE 53 -10.082 22.993 -3.149 250 HB2 PHE 53 2HB PHE 53 -9.434 23.331 -6.084 251 HB3 PHE 53 3HB PHE 53 -9.309 21.833 -5.187 252 HD1 PHE 53 HD1 PHE 53 -12.119 22.757 -3.585 253 HD2 PHE 53 HD2 PHE 53 -10.885 22.065 -7.672 254 HE1 PHE 53 HE1 PHE 53 -14.378 22.033 -4.143 255 HE2 PHE 53 HE2 PHE 53 -13.141 21.269 -8.204 256 HZ PHE 53 HZ PHE 53 -14.912 21.244 -6.447 257 H ARG 54 H ARG 54 -8.077 25.522 -4.364 258 HA ARG 54 HA ARG 54 -5.513 24.300 -3.531 259 HB2 ARG 54 2HB ARG 54 -6.162 27.056 -4.657 260 HB3 ARG 54 3HB ARG 54 -4.551 26.390 -4.336 261 HG2 ARG 54 2HG ARG 54 -5.039 24.543 -5.985 262 HG3 ARG 54 3HG ARG 54 -6.576 25.321 -6.347 263 HD2 ARG 54 2HD ARG 54 -5.074 26.031 -8.055 264 HD3 ARG 54 3HD ARG 54 -5.330 27.409 -6.985 265 HE ARG 54 HE ARG 54 -3.144 27.240 -6.173 266 HH11 ARG 54 1HH1 ARG 54 -0.962 26.752 -6.452 267 HH12 ARG 54 2HH1 ARG 54 -0.484 25.458 -7.513 268 HH21 ARG 54 1HH2 ARG 54 -3.701 24.586 -8.446 269 HH22 ARG 54 2HH2 ARG 54 -2.002 24.247 -8.604 270 H GLY 55 H GLY 55 -4.097 25.837 -2.200 271 HA2 GLY 55 HA2 GLY 55 -3.619 27.024 -0.267 272 HA3 GLY 55 HA3 GLY 55 -5.332 27.527 -0.185 273 H LYS 56 H LYS 56 -5.729 24.361 -0.276 274 HA LYS 56 HA LYS 56 -5.031 23.576 2.488 275 HB2 LYS 56 2HB LYS 56 -7.424 22.888 2.861 276 HB3 LYS 56 3HB LYS 56 -7.156 24.606 2.785 277 HG2 LYS 56 2HG LYS 56 -9.182 24.108 1.661 278 HG3 LYS 56 3HG LYS 56 -8.045 24.678 0.468 279 HD2 LYS 56 2HD LYS 56 -7.703 22.481 -0.425 280 HD3 LYS 56 3HD LYS 56 -8.570 21.698 0.903 281 HE2 LYS 56 2HE LYS 56 -9.658 23.512 -1.258 282 HE3 LYS 56 3HE LYS 56 -9.847 21.745 -1.163 283 HZ1 LYS 56 HZ1 LYS 56 -10.954 23.592 0.893 284 HZ2 LYS 56 HZ2 LYS 56 -11.323 22.017 0.690 285 HZ3 LYS 56 HZ3 LYS 56 -11.792 23.140 -0.429 286 H GLN 57 H GLN 57 -6.116 21.159 2.709 287 HA GLN 57 HA GLN 57 -5.285 19.683 0.247 288 HB2 GLN 57 2HB GLN 57 -3.806 18.418 1.414 289 HB3 GLN 57 3HB GLN 57 -3.717 19.854 2.368 290 HG2 GLN 57 2HG GLN 57 -3.956 18.386 4.062 291 HG3 GLN 57 3HG GLN 57 -5.662 18.693 3.778 292 HE21 GLN 57 1HE2 GLN 57 -4.282 16.665 1.333 293 HE22 GLN 57 2HE2 GLN 57 -4.966 15.192 2.008 294 H CYS 58 H CYS 58 -6.274 17.564 -0.031 295 HA CYS 58 HA CYS 58 -8.318 16.670 1.830 296 HB2 CYS 58 2HB CYS 58 -9.587 18.286 0.417 297 HB3 CYS 58 3HB CYS 58 -9.031 17.424 -1.039 298 HG CYS 58 HG CYS 58 -10.622 15.893 1.440 299 H ARG 59 H ARG 59 -8.548 14.472 1.730 300 HA ARG 59 HA ARG 59 -7.454 12.997 -0.587 301 HB2 ARG 59 2HB ARG 59 -6.674 11.199 0.805 302 HB3 ARG 59 3HB ARG 59 -5.766 12.667 1.104 303 HG2 ARG 59 2HG ARG 59 -8.024 12.101 2.997 304 HG3 ARG 59 3HG ARG 59 -6.681 10.981 3.001 305 HD2 ARG 59 2HD ARG 59 -5.217 13.128 3.309 306 HD3 ARG 59 3HD ARG 59 -6.776 13.909 3.684 307 HE ARG 59 HE ARG 59 -6.391 11.434 5.126 308 HH11 ARG 59 1HH1 ARG 59 -5.548 14.869 5.331 309 HH12 ARG 59 2HH1 ARG 59 -5.166 14.744 7.026 310 HH21 ARG 59 1HH2 ARG 59 -5.913 11.365 7.301 311 HH22 ARG 59 2HH2 ARG 59 -5.417 12.812 8.126 312 H VAL 60 H VAL 60 -8.904 11.624 -1.476 313 HA VAL 60 HA VAL 60 -10.975 10.358 0.242 314 HB VAL 60 HB VAL 60 -12.791 10.817 -1.291 315 HG11 VAL 60 1HG1 VAL 60 -13.203 13.166 -0.769 316 HG12 VAL 60 2HG1 VAL 60 -12.338 12.427 0.607 317 HG13 VAL 60 3HG1 VAL 60 -11.478 13.459 -0.523 318 HG21 VAL 60 1HG2 VAL 60 -12.644 12.423 -3.128 319 HG22 VAL 60 2HG2 VAL 60 -10.907 12.632 -2.843 320 HG23 VAL 60 3HG2 VAL 60 -11.542 11.064 -3.404 321 H ASN 61 H ASN 61 -12.061 8.539 -1.142 322 HA ASN 61 HA ASN 61 -10.115 7.471 -3.104 323 HB2 ASN 61 2HB ASN 61 -9.560 6.520 -0.960 324 HB3 ASN 61 3HB ASN 61 -11.231 6.140 -0.600 325 HD21 ASN 61 1HD2 ASN 61 -12.292 4.467 -2.036 326 HD22 ASN 61 2HD2 ASN 61 -11.262 3.235 -2.758 327 H LEU 62 H LEU 62 -10.908 6.532 -4.827 328 HA LEU 62 HA LEU 62 -13.904 6.266 -5.111 329 HB2 LEU 62 2HB LEU 62 -11.630 6.941 -6.970 330 HB3 LEU 62 3HB LEU 62 -13.053 6.131 -7.619 331 HG LEU 62 HG LEU 62 -14.483 7.957 -6.920 332 HD11 LEU 62 1HD1 LEU 62 -13.462 10.138 -6.134 333 HD12 LEU 62 2HD1 LEU 62 -11.939 9.280 -5.862 334 HD13 LEU 62 3HD1 LEU 62 -13.383 8.854 -4.917 335 HD21 LEU 62 1HD2 LEU 62 -13.565 9.656 -8.512 336 HD22 LEU 62 2HD2 LEU 62 -13.385 8.004 -9.137 337 HD23 LEU 62 3HD2 LEU 62 -11.991 8.845 -8.442 338 H LYS 63 H LYS 63 -14.768 4.332 -5.398 339 HA LYS 63 HA LYS 63 -13.055 2.034 -6.252 340 HB2 LYS 63 2HB LYS 63 -15.552 1.986 -4.521 341 HB3 LYS 63 3HB LYS 63 -14.635 0.575 -5.071 342 HG2 LYS 63 2HG LYS 63 -12.619 1.587 -3.851 343 HG3 LYS 63 3HG LYS 63 -13.744 2.731 -3.117 344 HD2 LYS 63 2HD LYS 63 -13.844 -0.307 -2.864 345 HD3 LYS 63 3HD LYS 63 -13.247 0.826 -1.645 346 HE2 LYS 63 2HE LYS 63 -15.512 1.878 -1.524 347 HE3 LYS 63 3HE LYS 63 -16.115 0.671 -2.682 348 HZ1 LYS 63 HZ1 LYS 63 -16.580 0.019 -0.404 349 HZ2 LYS 63 HZ2 LYS 63 -14.993 0.058 0.000 350 HZ3 LYS 63 HZ3 LYS 63 -15.546 -1.053 -1.073 351 H LEU 64 H LEU 64 -13.361 1.871 -8.455 352 HA LEU 64 HA LEU 64 -16.100 2.338 -9.506 353 HB2 LEU 64 2HB LEU 64 -13.532 1.975 -11.058 354 HB3 LEU 64 3HB LEU 64 -15.093 2.515 -11.653 355 HG LEU 64 HG LEU 64 -13.974 4.425 -11.675 356 HD11 LEU 64 1HD1 LEU 64 -14.648 5.951 -9.909 357 HD12 LEU 64 2HD1 LEU 64 -15.131 4.590 -8.883 358 HD13 LEU 64 3HD1 LEU 64 -15.940 4.885 -10.451 359 HD21 LEU 64 1HD2 LEU 64 -12.353 5.252 -10.068 360 HD22 LEU 64 2HD2 LEU 64 -11.913 3.662 -10.718 361 HD23 LEU 64 3HD2 LEU 64 -12.570 3.812 -9.061 362 H ILE 65 H ILE 65 -16.926 0.993 -11.111 363 HA ILE 65 HA ILE 65 -16.206 -1.920 -10.931 364 HB ILE 65 HB ILE 65 -18.477 -2.241 -12.029 365 HG12 ILE 65 2HG1 ILE 65 -19.162 0.515 -10.932 366 HG13 ILE 65 3HG1 ILE 65 -18.655 0.289 -12.617 367 HG21 ILE 65 1HG2 ILE 65 -18.395 -1.080 -9.207 368 HG22 ILE 65 2HG2 ILE 65 -19.655 -2.142 -9.862 369 HG23 ILE 65 3HG2 ILE 65 -18.011 -2.757 -9.665 370 HD11 ILE 65 1HD1 ILE 65 -21.050 0.334 -12.496 371 HD12 ILE 65 2HD1 ILE 65 -20.495 -1.272 -12.988 372 HD13 ILE 65 3HD1 ILE 65 -21.069 -1.001 -11.316 373 HA PRO 66 HA PRO 66 -14.757 -1.500 -15.139 374 HB2 PRO 66 2HB PRO 66 -14.885 -4.063 -16.075 375 HB3 PRO 66 3HB PRO 66 -13.692 -3.542 -14.843 376 HG2 PRO 66 2HG PRO 66 -16.343 -4.942 -14.393 377 HG3 PRO 66 3HG PRO 66 -14.746 -5.322 -13.682 378 HD2 PRO 66 2HD PRO 66 -16.616 -3.838 -12.348 379 HD3 PRO 66 3HD PRO 66 -14.867 -3.524 -12.178 380 H THR 67 H THR 67 -15.618 -1.045 -17.119 381 HA THR 67 HA THR 67 -18.447 -1.755 -17.759 382 HB THR 67 HB THR 67 -17.149 1.015 -17.801 383 HG1 THR 67 HG1 THR 67 -17.896 0.032 -15.799 384 HG21 THR 67 1HG2 THR 67 -19.461 1.808 -18.316 385 HG22 THR 67 2HG2 THR 67 -19.920 0.136 -18.694 386 HG23 THR 67 3HG2 THR 67 -18.675 0.981 -19.657 387 H GLY 68 H GLY 68 -18.947 -1.618 -20.034 388 HA2 GLY 68 HA2 GLY 68 -17.007 -2.728 -21.773 389 HA3 GLY 68 HA3 GLY 68 -18.530 -1.983 -22.288 390 H THR 69 H THR 69 -17.734 0.635 -21.134 391 HA THR 69 HA THR 69 -15.164 1.364 -22.438 392 HB THR 69 HB THR 69 -17.654 3.124 -22.543 393 HG1 THR 69 HG1 THR 69 -17.673 1.494 -24.113 394 HG21 THR 69 1HG2 THR 69 -14.803 3.571 -23.566 395 HG22 THR 69 2HG2 THR 69 -15.621 4.474 -22.275 396 HG23 THR 69 3HG2 THR 69 -16.206 4.594 -23.939 397 H GLY 70 H GLY 70 -14.063 1.381 -20.560 398 HA2 GLY 70 HA2 GLY 70 -13.008 2.820 -19.011 399 HA3 GLY 70 HA3 GLY 70 -14.527 3.727 -18.824 400 H ALA 71 H ALA 71 -13.936 3.670 -16.528 401 HA ALA 71 HA ALA 71 -15.234 1.310 -15.268 402 HB1 ALA 71 1HB ALA 71 -13.493 3.306 -13.787 403 HB2 ALA 71 2HB ALA 71 -14.014 1.674 -13.303 404 HB3 ALA 71 3HB ALA 71 -12.825 1.864 -14.571 405 H LEU 72 H LEU 72 -16.738 1.883 -13.524 406 HA LEU 72 HA LEU 72 -18.075 4.563 -13.763 407 HB2 LEU 72 2HB LEU 72 -19.071 1.849 -14.326 408 HB3 LEU 72 3HB LEU 72 -20.002 2.589 -13.057 409 HG LEU 72 HG LEU 72 -20.717 4.391 -14.438 410 HD11 LEU 72 1HD1 LEU 72 -18.808 5.000 -15.700 411 HD12 LEU 72 2HD1 LEU 72 -20.028 4.482 -16.880 412 HD13 LEU 72 3HD1 LEU 72 -18.690 3.400 -16.471 413 HD21 LEU 72 1HD2 LEU 72 -20.775 1.826 -16.077 414 HD22 LEU 72 2HD2 LEU 72 -21.947 3.169 -16.152 415 HD23 LEU 72 3HD2 LEU 72 -21.835 2.174 -14.689 416 H LEU 73 H LEU 73 -18.895 5.456 -11.846 417 HA LEU 73 HA LEU 73 -17.683 4.682 -9.421 418 HB2 LEU 73 2HB LEU 73 -18.564 6.924 -10.081 419 HB3 LEU 73 3HB LEU 73 -20.188 6.366 -9.728 420 HG LEU 73 HG LEU 73 -19.024 7.795 -7.977 421 HD11 LEU 73 1HD1 LEU 73 -19.862 6.643 -6.046 422 HD12 LEU 73 2HD1 LEU 73 -19.952 5.103 -6.926 423 HD13 LEU 73 3HD1 LEU 73 -21.002 6.456 -7.390 424 HD21 LEU 73 1HD2 LEU 73 -16.775 6.654 -8.178 425 HD22 LEU 73 2HD2 LEU 73 -17.445 5.288 -7.273 426 HD23 LEU 73 3HD2 LEU 73 -17.356 6.891 -6.523 427 H GLY 74 H GLY 74 -17.838 2.929 -8.338 428 HA2 GLY 74 HA2 GLY 74 -20.411 1.503 -7.922 429 HA3 GLY 74 HA3 GLY 74 -18.769 0.923 -7.542 430 H SER 75 H SER 75 -17.813 3.221 -6.149 431 HA SER 75 HA SER 75 -19.643 4.124 -4.083 432 HB2 SER 75 2HB SER 75 -17.676 1.899 -3.509 433 HB3 SER 75 3HB SER 75 -18.041 3.090 -2.253 434 HG SER 75 HG SER 75 -20.043 1.602 -3.620 435 H LEU 76 H LEU 76 -18.703 5.724 -2.737 436 HA LEU 76 HA LEU 76 -15.890 6.506 -3.309 437 HB2 LEU 76 2HB LEU 76 -17.532 7.923 -4.556 438 HB3 LEU 76 3HB LEU 76 -18.224 8.462 -3.040 439 HG LEU 76 HG LEU 76 -15.229 8.753 -3.334 440 HD11 LEU 76 1HD1 LEU 76 -15.936 9.428 -5.545 441 HD12 LEU 76 2HD1 LEU 76 -15.528 10.879 -4.619 442 HD13 LEU 76 3HD1 LEU 76 -17.227 10.436 -4.901 443 HD21 LEU 76 1HD2 LEU 76 -17.405 10.634 -2.300 444 HD22 LEU 76 2HD2 LEU 76 -15.655 10.906 -2.192 445 HD23 LEU 76 3HD2 LEU 76 -16.406 9.577 -1.283 446 H THR 77 H THR 77 -14.729 6.833 -1.590 447 HA THR 77 HA THR 77 -15.937 6.890 1.168 448 HB THR 77 HB THR 77 -13.264 5.828 0.133 449 HG1 THR 77 HG1 THR 77 -15.145 4.523 -0.132 450 HG21 THR 77 1HG2 THR 77 -12.880 6.808 2.337 451 HG22 THR 77 2HG2 THR 77 -12.913 5.050 2.472 452 HG23 THR 77 3HG2 THR 77 -14.323 5.999 2.996 453 H VAL 78 H VAL 78 -15.686 8.874 2.150 454 HA VAL 78 HA VAL 78 -13.537 10.700 1.195 455 HB VAL 78 HB VAL 78 -14.393 12.359 2.773 456 HG11 VAL 78 1HG1 VAL 78 -16.373 12.974 1.452 457 HG12 VAL 78 2HG1 VAL 78 -15.080 12.365 0.410 458 HG13 VAL 78 3HG1 VAL 78 -16.470 11.323 0.796 459 HG21 VAL 78 1HG2 VAL 78 -15.526 10.977 4.454 460 HG22 VAL 78 2HG2 VAL 78 -16.660 12.126 3.735 461 HG23 VAL 78 3HG2 VAL 78 -16.708 10.430 3.239 462 H LEU 79 H LEU 79 -11.618 10.923 2.274 463 HA LEU 79 HA LEU 79 -11.255 9.269 4.749 464 HB2 LEU 79 2HB LEU 79 -9.239 10.313 2.739 465 HB3 LEU 79 3HB LEU 79 -8.848 9.359 4.154 466 HG LEU 79 HG LEU 79 -10.595 8.395 1.834 467 HD11 LEU 79 1HD1 LEU 79 -7.648 7.875 2.415 468 HD12 LEU 79 2HD1 LEU 79 -8.295 8.841 1.078 469 HD13 LEU 79 3HD1 LEU 79 -8.606 7.097 1.141 470 HD21 LEU 79 1HD2 LEU 79 -10.198 6.158 2.785 471 HD22 LEU 79 2HD2 LEU 79 -11.032 7.186 3.956 472 HD23 LEU 79 3HD2 LEU 79 -9.292 6.867 4.141 473 H ASP 80 H ASP 80 -10.349 12.494 3.386 474 HA ASP 80 HA ASP 80 -11.269 13.903 5.634 475 HB2 ASP 80 2HB ASP 80 -8.874 12.820 6.396 476 HB3 ASP 80 3HB ASP 80 -8.295 14.260 5.587 477 H GLY 81 H GLY 81 -10.752 16.265 5.488 478 HA2 GLY 81 HA2 GLY 81 -9.032 17.547 3.836 479 HA3 GLY 81 HA3 GLY 81 -10.388 17.275 2.746 480 H ASP 82 H ASP 82 -9.895 19.734 2.890 481 HA ASP 82 HA ASP 82 -11.520 21.092 4.968 482 HB2 ASP 82 2HB ASP 82 -9.514 22.221 4.266 483 HB3 ASP 82 3HB ASP 82 -9.979 22.121 2.582 484 H SER 83 H SER 83 -13.588 21.247 4.771 485 HA SER 83 HA SER 83 -14.744 19.253 3.580 486 HB2 SER 83 2HB SER 83 -16.306 21.741 4.305 487 HB3 SER 83 3HB SER 83 -16.885 20.063 4.328 488 HG SER 83 HG SER 83 -16.261 20.800 6.432 489 H ARG 84 H ARG 84 -14.728 22.400 1.984 490 HA ARG 84 HA ARG 84 -16.790 22.043 0.121 491 HB2 ARG 84 2HB ARG 84 -15.612 24.164 0.564 492 HB3 ARG 84 3HB ARG 84 -14.150 23.526 -0.160 493 HG2 ARG 84 2HG ARG 84 -15.190 25.050 -1.672 494 HG3 ARG 84 3HG ARG 84 -15.255 23.454 -2.392 495 HD2 ARG 84 2HD ARG 84 -17.588 24.734 -0.889 496 HD3 ARG 84 3HD ARG 84 -17.312 24.938 -2.633 497 HE ARG 84 HE ARG 84 -17.284 22.191 -2.243 498 HH11 ARG 84 1HH1 ARG 84 -19.697 24.722 -1.724 499 HH12 ARG 84 2HH1 ARG 84 -21.033 23.631 -1.941 500 HH21 ARG 84 1HH2 ARG 84 -19.026 20.836 -2.506 501 HH22 ARG 84 2HH2 ARG 84 -20.647 21.448 -2.396 502 H LEU 85 H LEU 85 -13.470 20.611 -0.015 503 HA LEU 85 HA LEU 85 -13.814 19.984 -2.871 504 HB2 LEU 85 2HB LEU 85 -11.691 20.687 -2.091 505 HB3 LEU 85 3HB LEU 85 -11.611 19.420 -0.870 506 HG LEU 85 HG LEU 85 -11.253 17.719 -2.480 507 HD11 LEU 85 1HD1 LEU 85 -12.784 18.312 -4.325 508 HD12 LEU 85 2HD1 LEU 85 -11.145 18.107 -4.942 509 HD13 LEU 85 3HD1 LEU 85 -11.805 19.739 -4.707 510 HD21 LEU 85 1HD2 LEU 85 -9.156 18.450 -3.459 511 HD22 LEU 85 2HD2 LEU 85 -9.359 19.372 -1.944 512 HD23 LEU 85 3HD2 LEU 85 -9.698 20.142 -3.496 513 H CYS 86 H CYS 86 -13.432 17.811 0.061 514 HA CYS 86 HA CYS 86 -14.384 15.505 -1.215 515 HB2 CYS 86 2HB CYS 86 -15.010 14.787 1.117 516 HB3 CYS 86 3HB CYS 86 -13.317 15.225 0.844 517 HG CYS 86 HG CYS 86 -15.712 17.175 2.126 518 H ALA 87 H ALA 87 -16.385 18.164 0.119 519 HA ALA 87 HA ALA 87 -18.881 16.746 -0.257 520 HB1 ALA 87 1HB ALA 87 -18.281 19.740 -0.125 521 HB2 ALA 87 2HB ALA 87 -19.880 18.984 0.064 522 HB3 ALA 87 3HB ALA 87 -18.615 18.681 1.269 523 H ALA 88 H ALA 88 -16.913 18.745 -2.457 524 HA ALA 88 HA ALA 88 -18.992 18.947 -4.486 525 HB1 ALA 88 1HB ALA 88 -17.350 20.756 -4.110 526 HB2 ALA 88 2HB ALA 88 -16.005 19.653 -4.499 527 HB3 ALA 88 3HB ALA 88 -17.182 20.115 -5.740 528 H THR 89 H THR 89 -15.845 17.193 -4.319 529 HA THR 89 HA THR 89 -16.037 15.848 -6.824 530 HB THR 89 HB THR 89 -13.991 16.062 -5.462 531 HG1 THR 89 HG1 THR 89 -13.270 14.019 -6.101 532 HG21 THR 89 1HG2 THR 89 -13.470 14.640 -3.648 533 HG22 THR 89 2HG2 THR 89 -14.879 13.593 -3.930 534 HG23 THR 89 3HG2 THR 89 -15.107 15.217 -3.270 535 H LYS 90 H LYS 90 -17.146 14.802 -3.646 536 HA LYS 90 HA LYS 90 -18.063 12.214 -4.092 537 HB2 LYS 90 2HB LYS 90 -17.949 13.291 -1.948 538 HB3 LYS 90 3HB LYS 90 -19.074 14.554 -2.454 539 HG2 LYS 90 2HG LYS 90 -20.734 12.445 -2.677 540 HG3 LYS 90 3HG LYS 90 -19.586 11.746 -1.516 541 HD2 LYS 90 2HD LYS 90 -20.991 14.441 -1.256 542 HD3 LYS 90 3HD LYS 90 -21.587 12.960 -0.497 543 HE2 LYS 90 2HE LYS 90 -18.823 14.150 0.061 544 HE3 LYS 90 3HE LYS 90 -20.274 14.550 1.007 545 HZ1 LYS 90 HZ1 LYS 90 -20.496 12.213 1.581 546 HZ2 LYS 90 HZ2 LYS 90 -19.041 12.780 2.066 547 HZ3 LYS 90 HZ3 LYS 90 -19.146 11.826 0.738 548 H ARG 91 H ARG 91 -19.791 15.244 -4.736 549 HA ARG 91 HA ARG 91 -22.128 13.929 -5.855 550 HB2 ARG 91 2HB ARG 91 -21.228 16.837 -5.898 551 HB3 ARG 91 3HB ARG 91 -22.820 16.288 -6.441 552 HG2 ARG 91 2HG ARG 91 -23.379 15.469 -4.207 553 HG3 ARG 91 3HG ARG 91 -21.758 15.838 -3.609 554 HD2 ARG 91 2HD ARG 91 -22.136 18.261 -4.126 555 HD3 ARG 91 3HD ARG 91 -23.810 17.886 -4.554 556 HE ARG 91 HE ARG 91 -22.549 17.934 -1.885 557 HH11 ARG 91 1HH1 ARG 91 -25.440 16.842 -3.615 558 HH12 ARG 91 2HH1 ARG 91 -26.392 16.773 -2.160 559 HH21 ARG 91 1HH2 ARG 91 -23.844 17.818 -0.054 560 HH22 ARG 91 2HH2 ARG 91 -25.500 17.303 -0.179 561 H ALA 92 H ALA 92 -19.333 15.616 -7.334 562 HA ALA 92 HA ALA 92 -20.163 15.479 -10.049 563 HB1 ALA 92 1HB ALA 92 -17.740 15.790 -10.507 564 HB2 ALA 92 2HB ALA 92 -18.377 16.912 -9.308 565 HB3 ALA 92 3HB ALA 92 -17.388 15.527 -8.791 566 H VAL 93 H VAL 93 -18.093 13.193 -8.198 567 HA VAL 93 HA VAL 93 -17.761 11.333 -10.295 568 HB VAL 93 HB VAL 93 -17.814 10.454 -7.407 569 HG11 VAL 93 1HG1 VAL 93 -15.902 9.757 -9.661 570 HG12 VAL 93 2HG1 VAL 93 -16.061 8.947 -8.090 571 HG13 VAL 93 3HG1 VAL 93 -17.346 8.811 -9.294 572 HG21 VAL 93 1HG2 VAL 93 -16.222 12.651 -8.360 573 HG22 VAL 93 2HG2 VAL 93 -16.203 11.860 -6.790 574 HG23 VAL 93 3HG2 VAL 93 -15.137 11.294 -8.094 575 H ALA 94 H ALA 94 -20.471 11.855 -8.192 576 HA ALA 94 HA ALA 94 -21.742 9.237 -8.681 577 HB1 ALA 94 1HB ALA 94 -22.822 11.754 -7.327 578 HB2 ALA 94 2HB ALA 94 -23.559 10.142 -7.308 579 HB3 ALA 94 3HB ALA 94 -21.998 10.411 -6.506 580 H GLN 95 H GLN 95 -21.322 12.027 -10.538 581 HA GLN 95 HA GLN 95 -23.760 11.399 -12.159 582 HB2 GLN 95 2HB GLN 95 -24.251 13.738 -12.413 583 HB3 GLN 95 3HB GLN 95 -24.196 13.302 -10.712 584 HG2 GLN 95 2HG GLN 95 -22.998 15.321 -10.679 585 HG3 GLN 95 3HG GLN 95 -21.774 14.164 -10.722 586 HE21 GLN 95 1HE2 GLN 95 -20.229 14.375 -12.390 587 HE22 GLN 95 2HE2 GLN 95 -20.454 15.539 -13.712 588 H VAL 96 H VAL 96 -20.331 11.900 -12.259 589 HA VAL 96 HA VAL 96 -20.012 12.586 -14.998 590 HB VAL 96 HB VAL 96 -17.878 11.297 -14.889 591 HG11 VAL 96 1HG1 VAL 96 -18.115 13.706 -14.152 592 HG12 VAL 96 2HG1 VAL 96 -18.113 13.101 -12.473 593 HG13 VAL 96 3HG1 VAL 96 -16.720 12.815 -13.499 594 HG21 VAL 96 1HG2 VAL 96 -18.874 10.559 -12.148 595 HG22 VAL 96 2HG2 VAL 96 -18.232 9.499 -13.414 596 HG23 VAL 96 3HG2 VAL 96 -17.170 10.634 -12.531 597 H ASN 97 H ASN 97 -19.617 11.362 -16.887 598 HA ASN 97 HA ASN 97 -21.515 9.262 -17.253 599 HB2 ASN 97 2HB ASN 97 -20.883 11.032 -18.899 600 HB3 ASN 97 3HB ASN 97 -19.347 10.208 -19.166 601 HD21 ASN 97 1HD2 ASN 97 -19.436 7.988 -20.190 602 HD22 ASN 97 2HD2 ASN 97 -20.861 7.584 -21.134 603 H SER 98 H SER 98 -17.929 9.164 -17.341 604 HA SER 98 HA SER 98 -17.472 6.532 -16.475 605 HB2 SER 98 2HB SER 98 -16.796 5.476 -18.677 606 HB3 SER 98 3HB SER 98 -18.532 5.562 -18.385 607 HG SER 98 HG SER 98 -17.806 6.197 -20.542 608 H PHE 99 H PHE 99 -15.331 6.066 -16.281 609 HA PHE 99 HA PHE 99 -13.466 8.260 -16.940 610 HB2 PHE 99 2HB PHE 99 -12.990 5.817 -15.210 611 HB3 PHE 99 3HB PHE 99 -12.084 7.321 -15.234 612 HD1 PHE 99 HD1 PHE 99 -13.384 9.503 -14.522 613 HD2 PHE 99 HD2 PHE 99 -14.800 5.493 -13.715 614 HE1 PHE 99 HE1 PHE 99 -14.921 10.375 -12.808 615 HE2 PHE 99 HE2 PHE 99 -16.380 6.405 -12.043 616 HZ PHE 99 HZ PHE 99 -16.414 8.810 -11.556 617 HA PRO 100 HA PRO 100 -12.118 5.386 -20.191 618 HB2 PRO 100 2HB PRO 100 -10.668 7.075 -21.768 619 HB3 PRO 100 3HB PRO 100 -12.455 7.142 -21.687 620 HG2 PRO 100 2HG PRO 100 -10.464 8.896 -20.219 621 HG3 PRO 100 3HG PRO 100 -11.943 9.384 -21.104 622 HD2 PRO 100 2HD PRO 100 -11.886 9.037 -18.372 623 HD3 PRO 100 3HD PRO 100 -13.337 8.707 -19.362 624 H LEU 101 H LEU 101 -10.445 3.947 -20.001 625 HA LEU 101 HA LEU 101 -8.323 4.522 -18.139 626 HB2 LEU 101 2HB LEU 101 -8.678 1.991 -19.767 627 HB3 LEU 101 3HB LEU 101 -7.896 2.187 -18.202 628 HG LEU 101 HG LEU 101 -10.853 2.299 -18.823 629 HD11 LEU 101 1HD1 LEU 101 -10.989 0.334 -17.367 630 HD12 LEU 101 2HD1 LEU 101 -9.231 0.385 -17.125 631 HD13 LEU 101 3HD1 LEU 101 -9.894 0.073 -18.734 632 HD21 LEU 101 1HD2 LEU 101 -10.536 3.977 -17.095 633 HD22 LEU 101 2HD2 LEU 101 -9.464 2.921 -16.188 634 HD23 LEU 101 3HD2 LEU 101 -11.201 2.535 -16.324 635 HA PRO 102 HA PRO 102 -5.072 5.171 -21.193 636 HB2 PRO 102 2HB PRO 102 -2.840 4.875 -19.676 637 HB3 PRO 102 3HB PRO 102 -3.970 6.248 -19.456 638 HG2 PRO 102 2HG PRO 102 -3.877 3.664 -17.859 639 HG3 PRO 102 3HG PRO 102 -3.919 5.338 -17.239 640 HD2 PRO 102 2HD PRO 102 -6.170 3.823 -17.500 641 HD3 PRO 102 3HD PRO 102 -6.182 5.587 -17.774 642 H LYS 103 H LYS 103 -5.279 2.214 -19.223 643 HA LYS 103 HA LYS 103 -4.439 0.569 -21.491 644 HB2 LYS 103 2HB LYS 103 -3.216 0.477 -18.717 645 HB3 LYS 103 3HB LYS 103 -3.261 -0.927 -19.771 646 HG2 LYS 103 2HG LYS 103 -1.222 -0.175 -20.409 647 HG3 LYS 103 3HG LYS 103 -2.202 0.727 -21.557 648 HD2 LYS 103 2HD LYS 103 -2.228 2.532 -19.595 649 HD3 LYS 103 3HD LYS 103 -0.795 1.649 -19.048 650 HE2 LYS 103 2HE LYS 103 0.096 1.927 -21.432 651 HE3 LYS 103 3HE LYS 103 -1.289 2.997 -21.735 652 HZ1 LYS 103 HZ1 LYS 103 0.761 3.449 -19.623 653 HZ2 LYS 103 HZ2 LYS 103 -0.459 4.460 -19.988 654 HZ3 LYS 103 HZ3 LYS 103 0.746 4.210 -21.084 655 H ASP 104 H ASP 104 -5.270 -1.644 -21.315 656 HA ASP 104 HA ASP 104 -7.736 -1.813 -19.655 657 HB2 ASP 104 2HB ASP 104 -7.978 -1.001 -22.029 658 HB3 ASP 104 3HB ASP 104 -7.360 -2.561 -22.576 659 H GLN 105 H GLN 105 -5.047 -3.285 -19.246 660 HA GLN 105 HA GLN 105 -5.789 -6.058 -19.887 661 HB2 GLN 105 2HB GLN 105 -3.285 -4.966 -18.563 662 HB3 GLN 105 3HB GLN 105 -3.634 -6.661 -18.787 663 HG2 GLN 105 2HG GLN 105 -2.180 -5.969 -20.571 664 HG3 GLN 105 3HG GLN 105 -3.755 -6.418 -21.241 665 HE21 GLN 105 1HE2 GLN 105 -2.331 -3.414 -19.823 666 HE22 GLN 105 2HE2 GLN 105 -2.798 -2.385 -21.172 667 HA PRO 106 HA PRO 106 -7.800 -6.578 -15.975 668 HB2 PRO 106 2HB PRO 106 -7.534 -9.279 -15.507 669 HB3 PRO 106 3HB PRO 106 -8.594 -8.582 -16.767 670 HG2 PRO 106 2HG PRO 106 -5.766 -9.628 -17.114 671 HG3 PRO 106 3HG PRO 106 -7.223 -10.034 -18.073 672 HD2 PRO 106 2HD PRO 106 -5.484 -8.175 -18.924 673 HD3 PRO 106 3HD PRO 106 -7.243 -7.908 -19.115 674 H ASP 107 H ASP 107 -4.407 -6.831 -16.242 675 HA ASP 107 HA ASP 107 -3.969 -7.349 -13.353 676 HB2 ASP 107 2HB ASP 107 -2.347 -8.196 -15.033 677 HB3 ASP 107 3HB ASP 107 -2.040 -6.541 -15.562 678 H VAL 108 H VAL 108 -4.104 -4.634 -15.635 679 HA VAL 108 HA VAL 108 -3.328 -2.724 -13.485 680 HB VAL 108 HB VAL 108 -3.076 -1.068 -15.158 681 HG11 VAL 108 1HG1 VAL 108 -1.623 -3.603 -16.025 682 HG12 VAL 108 2HG1 VAL 108 -1.090 -1.930 -16.309 683 HG13 VAL 108 3HG1 VAL 108 -1.158 -2.557 -14.655 684 HG21 VAL 108 1HG2 VAL 108 -3.926 -3.093 -17.240 685 HG22 VAL 108 2HG2 VAL 108 -4.754 -1.573 -16.799 686 HG23 VAL 108 3HG2 VAL 108 -3.165 -1.539 -17.566 687 H VAL 109 H VAL 109 -6.127 -3.624 -15.482 688 HA VAL 109 HA VAL 109 -7.867 -1.484 -14.835 689 HB VAL 109 HB VAL 109 -8.329 -4.471 -15.190 690 HG11 VAL 109 1HG1 VAL 109 -10.239 -3.755 -13.884 691 HG12 VAL 109 2HG1 VAL 109 -10.458 -2.304 -14.897 692 HG13 VAL 109 3HG1 VAL 109 -10.770 -3.928 -15.562 693 HG21 VAL 109 1HG2 VAL 109 -9.148 -3.828 -17.405 694 HG22 VAL 109 2HG2 VAL 109 -9.069 -2.106 -16.990 695 HG23 VAL 109 3HG2 VAL 109 -7.574 -3.028 -17.184 696 H GLU 110 H GLU 110 -6.525 -4.026 -12.833 697 HA GLU 110 HA GLU 110 -8.359 -3.706 -10.610 698 HB2 GLU 110 2HB GLU 110 -5.831 -5.223 -10.953 699 HB3 GLU 110 3HB GLU 110 -6.773 -5.264 -9.464 700 HG2 GLU 110 2HG GLU 110 -7.958 -5.992 -12.176 701 HG3 GLU 110 3HG GLU 110 -7.216 -7.141 -11.080 702 H LYS 111 H LYS 111 -5.764 -1.823 -11.664 703 HA LYS 111 HA LYS 111 -5.059 -0.896 -8.922 704 HB2 LYS 111 2HB LYS 111 -3.773 -0.507 -11.635 705 HB3 LYS 111 3HB LYS 111 -3.488 0.651 -10.341 706 HG2 LYS 111 2HG LYS 111 -1.738 -1.054 -10.456 707 HG3 LYS 111 3HG LYS 111 -2.548 -1.032 -8.890 708 HD2 LYS 111 2HD LYS 111 -3.767 -3.049 -9.363 709 HD3 LYS 111 3HD LYS 111 -3.359 -2.941 -11.086 710 HE2 LYS 111 2HE LYS 111 -0.923 -3.199 -10.433 711 HE3 LYS 111 3HE LYS 111 -1.467 -3.478 -8.765 712 HZ1 LYS 111 HZ1 LYS 111 -1.088 -5.554 -10.049 713 HZ2 LYS 111 HZ2 LYS 111 -2.303 -5.145 -11.077 714 HZ3 LYS 111 HZ3 LYS 111 -2.627 -5.449 -9.510 715 H LEU 112 H LEU 112 -6.089 0.431 -12.020 716 HA LEU 112 HA LEU 112 -6.696 3.014 -11.027 717 HB2 LEU 112 2HB LEU 112 -7.648 3.409 -13.290 718 HB3 LEU 112 3HB LEU 112 -6.069 2.701 -13.249 719 HG LEU 112 HG LEU 112 -7.085 0.516 -13.561 720 HD11 LEU 112 1HD1 LEU 112 -9.244 0.294 -14.784 721 HD12 LEU 112 2HD1 LEU 112 -9.595 1.947 -14.233 722 HD13 LEU 112 3HD1 LEU 112 -9.315 0.638 -13.069 723 HD21 LEU 112 1HD2 LEU 112 -7.211 0.662 -16.004 724 HD22 LEU 112 2HD2 LEU 112 -5.852 1.546 -15.336 725 HD23 LEU 112 3HD2 LEU 112 -7.307 2.438 -15.873 726 H LYS 113 H LYS 113 -8.725 0.115 -10.922 727 HA LYS 113 HA LYS 113 -11.188 1.550 -10.608 728 HB2 LYS 113 2HB LYS 113 -12.013 -0.609 -9.870 729 HB3 LYS 113 3HB LYS 113 -11.024 -0.796 -11.326 730 HG2 LYS 113 2HG LYS 113 -9.063 -1.495 -9.905 731 HG3 LYS 113 3HG LYS 113 -10.077 -1.332 -8.466 732 HD2 LYS 113 2HD LYS 113 -10.346 -3.274 -10.745 733 HD3 LYS 113 3HD LYS 113 -9.940 -3.611 -9.031 734 HE2 LYS 113 2HE LYS 113 -12.283 -2.782 -8.482 735 HE3 LYS 113 3HE LYS 113 -12.549 -2.692 -10.235 736 HZ1 LYS 113 HZ1 LYS 113 -12.022 -5.131 -8.612 737 HZ2 LYS 113 HZ2 LYS 113 -11.799 -5.137 -10.219 738 HZ3 LYS 113 HZ3 LYS 113 -13.305 -4.847 -9.584 739 H ASN 114 H ASN 114 -8.629 0.823 -8.354 740 HA ASN 114 HA ASN 114 -10.217 2.067 -6.142 741 HB2 ASN 114 2HB ASN 114 -8.068 -0.044 -5.835 742 HB3 ASN 114 3HB ASN 114 -9.006 0.730 -4.550 743 HD21 ASN 114 1HD2 ASN 114 -11.633 0.576 -5.494 744 HD22 ASN 114 2HD2 ASN 114 -12.058 -1.123 -5.688 745 H ILE 115 H ILE 115 -9.459 4.137 -6.769 746 HA ILE 115 HA ILE 115 -6.571 4.656 -6.255 747 HB ILE 115 HB ILE 115 -6.804 6.765 -7.394 748 HG12 ILE 115 2HG1 ILE 115 -9.270 7.044 -7.074 749 HG13 ILE 115 3HG1 ILE 115 -8.623 7.505 -8.593 750 HG21 ILE 115 1HG2 ILE 115 -6.839 5.840 -9.708 751 HG22 ILE 115 2HG2 ILE 115 -5.830 4.931 -8.575 752 HG23 ILE 115 3HG2 ILE 115 -7.412 4.301 -9.043 753 HD11 ILE 115 1HD1 ILE 115 -10.701 6.422 -8.989 754 HD12 ILE 115 2HD1 ILE 115 -9.420 5.392 -9.611 755 HD13 ILE 115 3HD1 ILE 115 -10.204 4.981 -8.076 756 H ASN 116 H ASN 116 -5.920 6.303 -4.946 757 HA ASN 116 HA ASN 116 -8.029 7.662 -3.350 758 HB2 ASN 116 2HB ASN 116 -5.159 8.208 -2.763 759 HB3 ASN 116 3HB ASN 116 -6.583 8.206 -1.721 760 HD21 ASN 116 1HD2 ASN 116 -7.534 5.547 -1.901 761 HD22 ASN 116 2HD2 ASN 116 -6.260 4.501 -1.323 762 H LEU 117 H LEU 117 -8.575 9.655 -3.983 763 HA LEU 117 HA LEU 117 -6.784 11.249 -5.778 764 HB2 LEU 117 2HB LEU 117 -9.616 11.848 -4.834 765 HB3 LEU 117 3HB LEU 117 -8.646 12.829 -5.922 766 HG LEU 117 HG LEU 117 -9.767 10.028 -6.457 767 HD11 LEU 117 1HD1 LEU 117 -10.337 12.731 -7.752 768 HD12 LEU 117 2HD1 LEU 117 -11.384 11.887 -6.585 769 HD13 LEU 117 3HD1 LEU 117 -11.097 11.177 -8.176 770 HD21 LEU 117 1HD2 LEU 117 -8.891 10.350 -8.797 771 HD22 LEU 117 2HD2 LEU 117 -7.642 10.062 -7.584 772 HD23 LEU 117 3HD2 LEU 117 -7.923 11.706 -8.192 773 H THR 118 H THR 118 -5.334 12.375 -4.724 774 HA THR 118 HA THR 118 -5.976 13.574 -2.077 775 HB THR 118 HB THR 118 -3.360 12.189 -2.784 776 HG1 THR 118 HG1 THR 118 -4.097 10.734 -1.213 777 HG21 THR 118 1HG2 THR 118 -2.998 12.574 -0.280 778 HG22 THR 118 2HG2 THR 118 -4.390 13.681 -0.323 779 HG23 THR 118 3HG2 THR 118 -2.937 14.044 -1.275 780 H VAL 119 H VAL 119 -5.707 15.633 -2.049 781 HA VAL 119 HA VAL 119 -4.092 17.113 -4.067 782 HB VAL 119 HB VAL 119 -6.823 17.448 -2.749 783 HG11 VAL 119 1HG1 VAL 119 -6.969 19.666 -3.887 784 HG12 VAL 119 2HG1 VAL 119 -5.880 19.575 -2.498 785 HG13 VAL 119 3HG1 VAL 119 -5.209 19.564 -4.158 786 HG21 VAL 119 1HG2 VAL 119 -7.615 17.678 -5.085 787 HG22 VAL 119 2HG2 VAL 119 -5.953 17.425 -5.671 788 HG23 VAL 119 3HG2 VAL 119 -6.811 16.136 -4.802 789 H ALA 120 H ALA 120 -2.794 18.713 -3.233 790 HA ALA 120 HA ALA 120 -2.942 19.770 -0.557 791 HB1 ALA 120 1HB ALA 120 -0.738 17.760 -1.215 792 HB2 ALA 120 2HB ALA 120 -0.786 18.780 0.235 793 HB3 ALA 120 3HB ALA 120 -2.018 17.531 -0.015 794 HA PRO 121 HA PRO 121 -0.337 22.781 -2.687 795 HB2 PRO 121 2HB PRO 121 0.459 24.395 -0.646 796 HB3 PRO 121 3HB PRO 121 -1.259 24.288 -1.147 797 HG2 PRO 121 2HG PRO 121 0.113 22.825 1.126 798 HG3 PRO 121 3HG PRO 121 -1.422 23.740 1.170 799 HD2 PRO 121 2HD PRO 121 -1.330 21.018 0.865 800 HD3 PRO 121 3HD PRO 121 -2.596 22.012 0.101 801 H GLU 122 H GLU 122 1.897 23.422 -2.927 802 HA GLU 122 HA GLU 122 3.870 21.428 -2.011 803 HB2 GLU 122 2HB GLU 122 3.908 22.136 -4.351 804 HB3 GLU 122 3HB GLU 122 4.100 23.817 -3.887 805 HG2 GLU 122 2HG GLU 122 6.225 22.828 -4.636 806 HG3 GLU 122 3HG GLU 122 6.324 23.370 -2.964 Start of MODEL 15 1 H1 ALA 22 H ALA 22 16.452 1.772 -18.516 2 HA ALA 22 HA ALA 22 13.915 0.550 -19.033 3 HB1 ALA 22 1HB ALA 22 15.017 -0.387 -21.019 4 HB2 ALA 22 2HB ALA 22 16.394 -0.931 -20.028 5 HB3 ALA 22 3HB ALA 22 14.791 -1.665 -19.812 6 H ALA 23 H ALA 23 13.332 -0.644 -17.255 7 HA ALA 23 HA ALA 23 15.211 -1.557 -15.222 8 HB1 ALA 23 1HB ALA 23 15.373 0.917 -14.977 9 HB2 ALA 23 2HB ALA 23 13.615 0.995 -14.713 10 HB3 ALA 23 3HB ALA 23 14.658 0.140 -13.548 11 H ARG 24 H ARG 24 11.903 -0.183 -15.198 12 HA ARG 24 HA ARG 24 9.877 -1.005 -14.939 13 HB2 ARG 24 2HB ARG 24 10.991 -3.775 -15.460 14 HB3 ARG 24 3HB ARG 24 9.306 -3.277 -15.545 15 HG2 ARG 24 2HG ARG 24 9.898 -1.630 -17.341 16 HG3 ARG 24 3HG ARG 24 11.551 -2.282 -17.351 17 HD2 ARG 24 2HD ARG 24 10.614 -4.542 -17.851 18 HD3 ARG 24 3HD ARG 24 8.992 -3.815 -17.925 19 HE ARG 24 HE ARG 24 11.030 -2.616 -19.672 20 HH11 ARG 24 1HH1 ARG 24 8.406 -5.001 -19.558 21 HH12 ARG 24 2HH1 ARG 24 8.274 -5.040 -21.306 22 HH21 ARG 24 1HH2 ARG 24 10.754 -2.728 -21.906 23 HH22 ARG 24 2HH2 ARG 24 9.471 -3.711 -22.572 24 H GLN 25 H GLN 25 11.907 -1.081 -12.591 25 HA GLN 25 HA GLN 25 10.528 -2.980 -10.766 26 HB2 GLN 25 2HB GLN 25 12.939 -1.266 -10.122 27 HB3 GLN 25 3HB GLN 25 12.351 -2.667 -9.258 28 HG2 GLN 25 2HG GLN 25 13.656 -2.650 -12.010 29 HG3 GLN 25 3HG GLN 25 14.360 -3.245 -10.523 30 HE21 GLN 25 1HE2 GLN 25 12.774 -4.229 -13.335 31 HE22 GLN 25 2HE2 GLN 25 12.206 -5.789 -12.752 32 H GLN 26 H GLN 26 10.667 0.386 -11.421 33 HA GLN 26 HA GLN 26 9.196 1.152 -8.937 34 HB2 GLN 26 2HB GLN 26 10.712 2.956 -8.599 35 HB3 GLN 26 3HB GLN 26 11.615 1.445 -8.644 36 HG2 GLN 26 2HG GLN 26 11.383 3.465 -10.923 37 HG3 GLN 26 3HG GLN 26 12.747 3.325 -9.814 38 HE21 GLN 26 1HE2 GLN 26 14.068 1.275 -9.905 39 HE22 GLN 26 2HE2 GLN 26 14.106 0.417 -11.427 40 H PHE 27 H PHE 27 9.751 1.734 -12.345 41 HA PHE 27 HA PHE 27 8.825 4.300 -12.720 42 HB2 PHE 27 2HB PHE 27 9.051 3.838 -14.887 43 HB3 PHE 27 3HB PHE 27 9.910 2.424 -14.281 44 HD1 PHE 27 HD1 PHE 27 7.238 3.640 -16.290 45 HD2 PHE 27 HD2 PHE 27 8.414 0.262 -13.922 46 HE1 PHE 27 HE1 PHE 27 5.422 2.275 -17.352 47 HE2 PHE 27 HE2 PHE 27 6.674 -1.139 -15.037 48 HZ PHE 27 HZ PHE 27 5.178 -0.129 -16.753 49 H VAL 28 H VAL 28 6.835 1.664 -11.824 50 HA VAL 28 HA VAL 28 4.273 2.400 -12.802 51 HB VAL 28 HB VAL 28 3.404 1.370 -10.645 52 HG11 VAL 28 1HG1 VAL 28 5.309 -0.301 -12.349 53 HG12 VAL 28 2HG1 VAL 28 3.956 -0.913 -11.378 54 HG13 VAL 28 3HG1 VAL 28 3.632 0.140 -12.769 55 HG21 VAL 28 1HG2 VAL 28 6.317 0.597 -10.173 56 HG22 VAL 28 2HG2 VAL 28 5.387 1.745 -9.188 57 HG23 VAL 28 3HG2 VAL 28 4.906 0.045 -9.259 58 H THR 29 H THR 29 6.194 3.859 -10.237 59 HA THR 29 HA THR 29 4.201 5.530 -9.085 60 HB THR 29 HB THR 29 6.512 5.136 -8.276 61 HG1 THR 29 HG1 THR 29 5.554 7.804 -8.525 62 HG21 THR 29 1HG2 THR 29 7.745 5.721 -10.419 63 HG22 THR 29 2HG2 THR 29 8.327 6.586 -8.981 64 HG23 THR 29 3HG2 THR 29 7.298 7.416 -10.155 65 H SER 30 H SER 30 5.925 5.903 -12.163 66 HA SER 30 HA SER 30 4.735 8.534 -12.679 67 HB2 SER 30 2HB SER 30 6.267 6.619 -14.500 68 HB3 SER 30 3HB SER 30 5.823 8.295 -14.892 69 HG SER 30 HG SER 30 7.977 8.184 -14.114 70 H GLU 31 H GLU 31 3.911 5.175 -13.430 71 HA GLU 31 HA GLU 31 1.685 5.832 -15.190 72 HB2 GLU 31 2HB GLU 31 2.222 3.427 -13.410 73 HB3 GLU 31 3HB GLU 31 0.818 3.558 -14.448 74 HG2 GLU 31 2HG GLU 31 3.480 4.024 -15.749 75 HG3 GLU 31 3HG GLU 31 3.134 2.389 -15.195 76 H VAL 32 H VAL 32 2.080 5.641 -11.615 77 HA VAL 32 HA VAL 32 -0.737 5.889 -11.026 78 HB VAL 32 HB VAL 32 1.735 6.450 -9.381 79 HG11 VAL 32 1HG1 VAL 32 0.083 7.967 -8.416 80 HG12 VAL 32 2HG1 VAL 32 -1.153 6.687 -8.439 81 HG13 VAL 32 3HG1 VAL 32 0.259 6.560 -7.364 82 HG21 VAL 32 1HG2 VAL 32 1.117 4.078 -9.932 83 HG22 VAL 32 2HG2 VAL 32 1.042 4.421 -8.199 84 HG23 VAL 32 3HG2 VAL 32 -0.454 4.334 -9.167 85 H GLY 33 H GLY 33 1.721 8.205 -11.859 86 HA2 GLY 33 HA2 GLY 33 0.302 10.644 -11.242 87 HA3 GLY 33 HA3 GLY 33 1.654 10.452 -12.388 88 H ARG 34 H ARG 34 -0.111 8.329 -13.857 89 HA ARG 34 HA ARG 34 -1.864 10.224 -15.366 90 HB2 ARG 34 2HB ARG 34 -0.873 7.429 -16.044 91 HB3 ARG 34 3HB ARG 34 -1.892 8.456 -17.063 92 HG2 ARG 34 2HG ARG 34 -0.075 10.174 -17.082 93 HG3 ARG 34 3HG ARG 34 0.961 9.079 -16.155 94 HD2 ARG 34 2HD ARG 34 -0.268 8.175 -18.771 95 HD3 ARG 34 3HD ARG 34 1.171 9.187 -18.773 96 HE ARG 34 HE ARG 34 0.985 6.377 -17.907 97 HH11 ARG 34 1HH1 ARG 34 3.078 9.260 -17.873 98 HH12 ARG 34 2HH1 ARG 34 4.517 8.266 -17.782 99 HH21 ARG 34 1HH2 ARG 34 2.820 5.256 -17.739 100 HH22 ARG 34 2HH2 ARG 34 4.389 6.083 -17.695 101 H TYR 35 H TYR 35 -1.876 6.977 -13.967 102 HA TYR 35 HA TYR 35 -4.426 6.082 -14.579 103 HB2 TYR 35 2HB TYR 35 -2.451 5.507 -12.390 104 HB3 TYR 35 3HB TYR 35 -4.060 4.829 -12.254 105 HD1 TYR 35 HD1 TYR 35 -1.697 5.287 -15.201 106 HD2 TYR 35 HD2 TYR 35 -4.123 2.622 -12.832 107 HE1 TYR 35 HE1 TYR 35 -1.144 3.444 -16.733 108 HE2 TYR 35 HE2 TYR 35 -3.773 0.838 -14.480 109 HH TYR 35 HH TYR 35 -1.352 1.208 -17.155 110 H GLY 36 H GLY 36 -3.592 7.845 -11.621 111 HA2 GLY 36 HA2 GLY 36 -6.394 8.101 -10.786 112 HA3 GLY 36 HA3 GLY 36 -4.971 8.815 -9.988 113 H ALA 37 H ALA 37 -4.349 9.898 -12.937 114 HA ALA 37 HA ALA 37 -5.608 12.447 -12.470 115 HB1 ALA 37 1HB ALA 37 -4.248 13.234 -14.348 116 HB2 ALA 37 2HB ALA 37 -3.271 12.329 -13.183 117 HB3 ALA 37 3HB ALA 37 -3.765 11.580 -14.721 118 H ILE 38 H ILE 38 -6.167 9.655 -14.600 119 HA ILE 38 HA ILE 38 -7.913 10.981 -16.474 120 HB ILE 38 HB ILE 38 -8.598 8.825 -17.178 121 HG12 ILE 38 2HG1 ILE 38 -7.909 7.879 -14.403 122 HG13 ILE 38 3HG1 ILE 38 -9.448 7.796 -15.249 123 HG21 ILE 38 1HG2 ILE 38 -6.084 9.384 -17.440 124 HG22 ILE 38 2HG2 ILE 38 -5.808 8.184 -16.143 125 HG23 ILE 38 3HG2 ILE 38 -6.561 7.706 -17.671 126 HD11 ILE 38 1HD1 ILE 38 -7.011 6.068 -15.691 127 HD12 ILE 38 2HD1 ILE 38 -8.623 5.581 -15.149 128 HD13 ILE 38 3HD1 ILE 38 -8.387 6.112 -16.820 129 H TYR 39 H TYR 39 -8.422 9.823 -13.250 130 HA TYR 39 HA TYR 39 -11.336 10.103 -13.267 131 HB2 TYR 39 2HB TYR 39 -9.377 9.742 -10.952 132 HB3 TYR 39 3HB TYR 39 -11.129 9.649 -10.841 133 HD1 TYR 39 HD1 TYR 39 -8.104 7.811 -11.831 134 HD2 TYR 39 HD2 TYR 39 -12.388 7.798 -11.828 135 HE1 TYR 39 HE1 TYR 39 -8.041 5.391 -12.552 136 HE2 TYR 39 HE2 TYR 39 -12.358 5.475 -12.712 137 HH TYR 39 HH TYR 39 -11.156 3.758 -13.465 138 H THR 40 H THR 40 -8.620 11.865 -11.698 139 HA THR 40 HA THR 40 -10.202 13.956 -10.613 140 HB THR 40 HB THR 40 -7.770 13.230 -10.114 141 HG1 THR 40 HG1 THR 40 -8.575 15.957 -10.178 142 HG21 THR 40 1HG2 THR 40 -7.065 15.573 -11.905 143 HG22 THR 40 2HG2 THR 40 -7.013 13.909 -12.481 144 HG23 THR 40 3HG2 THR 40 -5.999 14.382 -11.109 145 H GLN 41 H GLN 41 -8.781 13.691 -13.844 146 HA GLN 41 HA GLN 41 -9.303 16.379 -14.730 147 HB2 GLN 41 2HB GLN 41 -8.820 13.758 -16.124 148 HB3 GLN 41 3HB GLN 41 -9.208 15.228 -17.028 149 HG2 GLN 41 2HG GLN 41 -7.283 16.421 -16.101 150 HG3 GLN 41 3HG GLN 41 -6.874 15.022 -15.091 151 HE21 GLN 41 1HE2 GLN 41 -6.534 12.954 -16.261 152 HE22 GLN 41 2HE2 GLN 41 -5.643 13.012 -17.801 153 H LEU 42 H LEU 42 -11.232 13.369 -14.753 154 HA LEU 42 HA LEU 42 -13.394 14.614 -16.281 155 HB2 LEU 42 2HB LEU 42 -12.819 12.122 -16.190 156 HB3 LEU 42 3HB LEU 42 -13.488 12.153 -14.552 157 HG LEU 42 HG LEU 42 -15.692 12.851 -15.479 158 HD11 LEU 42 1HD1 LEU 42 -15.056 14.036 -17.527 159 HD12 LEU 42 2HD1 LEU 42 -16.107 12.691 -17.930 160 HD13 LEU 42 3HD1 LEU 42 -14.357 12.542 -18.212 161 HD21 LEU 42 1HD2 LEU 42 -15.372 10.514 -15.139 162 HD22 LEU 42 2HD2 LEU 42 -14.481 10.343 -16.666 163 HD23 LEU 42 3HD2 LEU 42 -16.224 10.705 -16.670 164 H ILE 43 H ILE 43 -12.633 14.279 -12.855 165 HA ILE 43 HA ILE 43 -15.247 15.203 -11.937 166 HB ILE 43 HB ILE 43 -12.580 14.563 -10.641 167 HG12 ILE 43 2HG1 ILE 43 -14.139 13.185 -9.218 168 HG13 ILE 43 3HG1 ILE 43 -15.490 13.753 -10.233 169 HG21 ILE 43 1HG2 ILE 43 -14.907 15.992 -9.305 170 HG22 ILE 43 2HG2 ILE 43 -13.548 15.213 -8.460 171 HG23 ILE 43 3HG2 ILE 43 -13.244 16.619 -9.462 172 HD11 ILE 43 1HD1 ILE 43 -14.402 12.580 -12.186 173 HD12 ILE 43 2HD1 ILE 43 -13.183 11.941 -11.029 174 HD13 ILE 43 3HD1 ILE 43 -14.896 11.527 -10.858 175 H ARG 44 H ARG 44 -12.030 16.765 -12.144 176 HA ARG 44 HA ARG 44 -12.956 19.297 -11.212 177 HB2 ARG 44 2HB ARG 44 -10.806 20.134 -11.767 178 HB3 ARG 44 3HB ARG 44 -10.607 18.479 -11.247 179 HG2 ARG 44 2HG ARG 44 -9.222 18.349 -13.009 180 HG3 ARG 44 3HG ARG 44 -10.733 17.921 -13.805 181 HD2 ARG 44 2HD ARG 44 -9.745 19.458 -15.242 182 HD3 ARG 44 3HD ARG 44 -10.970 20.397 -14.379 183 HE ARG 44 HE ARG 44 -8.888 20.952 -12.825 184 HH11 ARG 44 1HH1 ARG 44 -8.879 20.898 -16.369 185 HH12 ARG 44 2HH1 ARG 44 -7.549 22.018 -16.455 186 HH21 ARG 44 1HH2 ARG 44 -7.214 22.407 -13.027 187 HH22 ARG 44 2HH2 ARG 44 -6.639 22.873 -14.600 188 H GLN 45 H GLN 45 -13.173 17.809 -14.361 189 HA GLN 45 HA GLN 45 -13.700 20.333 -15.739 190 HB2 GLN 45 2HB GLN 45 -13.828 19.261 -17.658 191 HB3 GLN 45 3HB GLN 45 -12.713 18.283 -16.707 192 HG2 GLN 45 2HG GLN 45 -14.536 16.652 -16.322 193 HG3 GLN 45 3HG GLN 45 -15.636 17.621 -17.321 194 HE21 GLN 45 1HE2 GLN 45 -12.251 16.367 -17.485 195 HE22 GLN 45 2HE2 GLN 45 -12.327 16.014 -19.206 196 H ASN 46 H ASN 46 -15.700 18.313 -13.679 197 HA ASN 46 HA ASN 46 -18.156 19.760 -14.544 198 HB2 ASN 46 2HB ASN 46 -17.599 18.186 -12.002 199 HB3 ASN 46 3HB ASN 46 -19.157 18.794 -12.539 200 HD21 ASN 46 1HD2 ASN 46 -16.971 16.182 -12.656 201 HD22 ASN 46 2HD2 ASN 46 -17.978 15.183 -13.693 202 H LEU 47 H LEU 47 -15.687 19.773 -11.966 203 HA LEU 47 HA LEU 47 -17.080 21.820 -10.420 204 HB2 LEU 47 2HB LEU 47 -14.508 20.304 -9.925 205 HB3 LEU 47 3HB LEU 47 -15.427 21.278 -8.778 206 HG LEU 47 HG LEU 47 -16.373 18.729 -9.973 207 HD11 LEU 47 1HD1 LEU 47 -15.963 17.938 -7.688 208 HD12 LEU 47 2HD1 LEU 47 -15.378 19.584 -7.264 209 HD13 LEU 47 3HD1 LEU 47 -14.508 18.604 -8.468 210 HD21 LEU 47 1HD2 LEU 47 -18.180 18.927 -8.169 211 HD22 LEU 47 2HD2 LEU 47 -18.375 20.020 -9.553 212 HD23 LEU 47 3HD2 LEU 47 -17.720 20.639 -8.024 213 H LEU 48 H LEU 48 -16.855 23.490 -11.741 214 HA LEU 48 HA LEU 48 -14.306 24.642 -12.489 215 HB2 LEU 48 2HB LEU 48 -15.720 26.477 -13.477 216 HB3 LEU 48 3HB LEU 48 -15.981 24.846 -14.067 217 HG LEU 48 HG LEU 48 -18.040 24.617 -12.815 218 HD11 LEU 48 1HD1 LEU 48 -19.113 26.548 -11.678 219 HD12 LEU 48 2HD1 LEU 48 -17.610 27.481 -11.855 220 HD13 LEU 48 3HD1 LEU 48 -17.658 26.023 -10.844 221 HD21 LEU 48 1HD2 LEU 48 -17.899 27.207 -14.418 222 HD22 LEU 48 2HD2 LEU 48 -19.367 26.248 -14.103 223 HD23 LEU 48 3HD2 LEU 48 -18.060 25.560 -15.088 224 H VAL 49 H VAL 49 -14.448 24.362 -9.711 225 HA VAL 49 HA VAL 49 -15.280 26.950 -8.575 226 HB VAL 49 HB VAL 49 -14.295 24.604 -6.997 227 HG11 VAL 49 1HG1 VAL 49 -14.308 26.701 -5.739 228 HG12 VAL 49 2HG1 VAL 49 -15.983 27.028 -6.251 229 HG13 VAL 49 3HG1 VAL 49 -15.630 25.657 -5.178 230 HG21 VAL 49 1HG2 VAL 49 -17.159 25.281 -7.824 231 HG22 VAL 49 2HG2 VAL 49 -16.236 23.830 -8.290 232 HG23 VAL 49 3HG2 VAL 49 -16.709 24.066 -6.607 233 H GLU 50 H GLU 50 -12.417 24.981 -7.806 234 HA GLU 50 HA GLU 50 -10.208 25.343 -7.800 235 HB2 GLU 50 2HB GLU 50 -10.665 28.026 -9.168 236 HB3 GLU 50 3HB GLU 50 -9.166 27.112 -9.061 237 HG2 GLU 50 2HG GLU 50 -10.254 25.251 -10.360 238 HG3 GLU 50 3HG GLU 50 -11.683 26.267 -10.554 239 H ASP 51 H ASP 51 -11.852 28.414 -6.869 240 HA ASP 51 HA ASP 51 -9.714 29.419 -5.279 241 HB2 ASP 51 2HB ASP 51 -12.710 29.965 -5.164 242 HB3 ASP 51 3HB ASP 51 -11.493 30.908 -4.317 243 H SER 52 H SER 52 -12.603 27.546 -4.252 244 HA SER 52 HA SER 52 -11.466 27.242 -1.521 245 HB2 SER 52 2HB SER 52 -13.605 26.291 -0.935 246 HB3 SER 52 3HB SER 52 -13.819 27.864 -1.717 247 HG SER 52 HG SER 52 -14.058 25.353 -3.075 248 H PHE 53 H PHE 53 -10.561 25.758 -4.213 249 HA PHE 53 HA PHE 53 -10.366 23.043 -3.007 250 HB2 PHE 53 2HB PHE 53 -9.783 24.079 -5.807 251 HB3 PHE 53 3HB PHE 53 -9.515 22.428 -5.244 252 HD1 PHE 53 HD1 PHE 53 -11.070 22.927 -7.645 253 HD2 PHE 53 HD2 PHE 53 -12.433 22.884 -3.545 254 HE1 PHE 53 HE1 PHE 53 -13.263 22.094 -8.359 255 HE2 PHE 53 HE2 PHE 53 -14.651 22.212 -4.284 256 HZ PHE 53 HZ PHE 53 -15.079 21.729 -6.681 257 H ARG 54 H ARG 54 -8.687 26.000 -3.525 258 HA ARG 54 HA ARG 54 -6.007 24.799 -3.110 259 HB2 ARG 54 2HB ARG 54 -6.910 27.491 -4.171 260 HB3 ARG 54 3HB ARG 54 -5.216 27.032 -3.926 261 HG2 ARG 54 2HG ARG 54 -5.469 25.126 -5.464 262 HG3 ARG 54 3HG ARG 54 -7.158 25.483 -5.730 263 HD2 ARG 54 2HD ARG 54 -4.918 27.433 -6.404 264 HD3 ARG 54 3HD ARG 54 -5.666 26.309 -7.551 265 HE ARG 54 HE ARG 54 -7.795 27.611 -6.362 266 HH11 ARG 54 1HH1 ARG 54 -5.071 28.636 -8.375 267 HH12 ARG 54 2HH1 ARG 54 -5.942 29.978 -9.058 268 HH21 ARG 54 1HH2 ARG 54 -8.831 29.461 -7.182 269 HH22 ARG 54 2HH2 ARG 54 -8.047 30.425 -8.380 270 H GLY 55 H GLY 55 -4.520 25.851 -1.671 271 HA2 GLY 55 HA2 GLY 55 -3.823 27.002 0.248 272 HA3 GLY 55 HA3 GLY 55 -5.463 27.681 0.414 273 H LYS 56 H LYS 56 -6.003 24.470 0.127 274 HA LYS 56 HA LYS 56 -5.489 23.667 2.927 275 HB2 LYS 56 2HB LYS 56 -7.847 22.862 3.090 276 HB3 LYS 56 3HB LYS 56 -7.676 24.602 3.020 277 HG2 LYS 56 2HG LYS 56 -9.561 23.986 1.732 278 HG3 LYS 56 3HG LYS 56 -8.358 24.614 0.633 279 HD2 LYS 56 2HD LYS 56 -7.837 22.419 -0.224 280 HD3 LYS 56 3HD LYS 56 -8.720 21.602 1.076 281 HE2 LYS 56 2HE LYS 56 -9.864 23.405 -1.071 282 HE3 LYS 56 3HE LYS 56 -9.857 21.629 -1.150 283 HZ1 LYS 56 HZ1 LYS 56 -11.266 23.169 0.979 284 HZ2 LYS 56 HZ2 LYS 56 -11.437 21.576 0.649 285 HZ3 LYS 56 HZ3 LYS 56 -11.964 22.732 -0.421 286 H GLN 57 H GLN 57 -6.454 21.204 3.039 287 HA GLN 57 HA GLN 57 -5.338 19.754 0.670 288 HB2 GLN 57 2HB GLN 57 -3.839 18.631 1.937 289 HB3 GLN 57 3HB GLN 57 -3.977 19.990 2.964 290 HG2 GLN 57 2HG GLN 57 -4.320 18.546 4.601 291 HG3 GLN 57 3HG GLN 57 -5.977 18.446 4.046 292 HE21 GLN 57 1HE2 GLN 57 -4.390 16.822 1.574 293 HE22 GLN 57 2HE2 GLN 57 -4.461 15.241 2.303 294 H CYS 58 H CYS 58 -6.209 17.575 0.356 295 HA CYS 58 HA CYS 58 -8.455 16.685 1.980 296 HB2 CYS 58 2HB CYS 58 -9.543 18.296 0.454 297 HB3 CYS 58 3HB CYS 58 -8.828 17.467 -0.943 298 HG CYS 58 HG CYS 58 -11.398 16.944 -0.822 299 H ARG 59 H ARG 59 -8.907 14.471 1.719 300 HA ARG 59 HA ARG 59 -7.493 12.936 -0.328 301 HB2 ARG 59 2HB ARG 59 -6.626 11.302 1.209 302 HB3 ARG 59 3HB ARG 59 -5.863 12.865 1.385 303 HG2 ARG 59 2HG ARG 59 -8.003 12.840 3.279 304 HG3 ARG 59 3HG ARG 59 -7.255 11.245 3.386 305 HD2 ARG 59 2HD ARG 59 -5.796 13.876 3.434 306 HD3 ARG 59 3HD ARG 59 -6.302 13.003 4.896 307 HE ARG 59 HE ARG 59 -4.832 11.153 3.440 308 HH11 ARG 59 1HH1 ARG 59 -4.035 14.333 4.823 309 HH12 ARG 59 2HH1 ARG 59 -2.397 13.848 5.162 310 HH21 ARG 59 1HH2 ARG 59 -2.685 10.651 3.847 311 HH22 ARG 59 2HH2 ARG 59 -1.637 11.820 4.571 312 H VAL 60 H VAL 60 -8.944 11.782 -1.259 313 HA VAL 60 HA VAL 60 -11.007 10.334 0.313 314 HB VAL 60 HB VAL 60 -12.847 10.993 -1.107 315 HG11 VAL 60 1HG1 VAL 60 -12.309 12.510 0.846 316 HG12 VAL 60 2HG1 VAL 60 -11.401 13.539 -0.264 317 HG13 VAL 60 3HG1 VAL 60 -13.140 13.342 -0.488 318 HG21 VAL 60 1HG2 VAL 60 -12.687 12.699 -2.848 319 HG22 VAL 60 2HG2 VAL 60 -10.936 12.834 -2.609 320 HG23 VAL 60 3HG2 VAL 60 -11.644 11.310 -3.243 321 H ASN 61 H ASN 61 -12.012 8.603 -1.084 322 HA ASN 61 HA ASN 61 -10.088 7.724 -3.153 323 HB2 ASN 61 2HB ASN 61 -9.405 6.736 -1.070 324 HB3 ASN 61 3HB ASN 61 -11.056 6.262 -0.668 325 HD21 ASN 61 1HD2 ASN 61 -12.106 4.634 -2.119 326 HD22 ASN 61 2HD2 ASN 61 -11.064 3.402 -2.829 327 H LEU 62 H LEU 62 -10.835 6.801 -4.888 328 HA LEU 62 HA LEU 62 -13.806 6.452 -5.173 329 HB2 LEU 62 2HB LEU 62 -11.526 7.187 -6.996 330 HB3 LEU 62 3HB LEU 62 -12.934 6.385 -7.681 331 HG LEU 62 HG LEU 62 -14.391 8.185 -6.915 332 HD11 LEU 62 1HD1 LEU 62 -11.859 9.467 -5.794 333 HD12 LEU 62 2HD1 LEU 62 -13.322 9.033 -4.898 334 HD13 LEU 62 3HD1 LEU 62 -13.387 10.347 -6.071 335 HD21 LEU 62 1HD2 LEU 62 -11.908 9.141 -8.427 336 HD22 LEU 62 2HD2 LEU 62 -13.497 9.930 -8.451 337 HD23 LEU 62 3HD2 LEU 62 -13.319 8.312 -9.129 338 H LYS 63 H LYS 63 -14.631 4.526 -5.381 339 HA LYS 63 HA LYS 63 -12.929 2.171 -6.114 340 HB2 LYS 63 2HB LYS 63 -15.499 2.227 -4.475 341 HB3 LYS 63 3HB LYS 63 -14.496 0.816 -4.822 342 HG2 LYS 63 2HG LYS 63 -12.636 1.849 -3.500 343 HG3 LYS 63 3HG LYS 63 -13.701 3.230 -3.126 344 HD2 LYS 63 2HD LYS 63 -15.312 1.675 -2.050 345 HD3 LYS 63 3HD LYS 63 -14.167 0.335 -2.314 346 HE2 LYS 63 2HE LYS 63 -12.460 1.517 -0.952 347 HE3 LYS 63 3HE LYS 63 -13.556 2.891 -0.748 348 HZ1 LYS 63 HZ1 LYS 63 -13.607 1.431 1.179 349 HZ2 LYS 63 HZ2 LYS 63 -14.078 0.158 0.276 350 HZ3 LYS 63 HZ3 LYS 63 -15.075 1.437 0.458 351 H LEU 64 H LEU 64 -13.231 1.969 -8.350 352 HA LEU 64 HA LEU 64 -15.988 2.368 -9.352 353 HB2 LEU 64 2HB LEU 64 -13.458 2.039 -10.979 354 HB3 LEU 64 3HB LEU 64 -15.033 2.558 -11.523 355 HG LEU 64 HG LEU 64 -13.910 4.464 -11.596 356 HD11 LEU 64 1HD1 LEU 64 -14.585 6.024 -9.845 357 HD12 LEU 64 2HD1 LEU 64 -14.978 4.677 -8.758 358 HD13 LEU 64 3HD1 LEU 64 -15.876 4.911 -10.287 359 HD21 LEU 64 1HD2 LEU 64 -11.847 3.685 -10.667 360 HD22 LEU 64 2HD2 LEU 64 -12.464 3.908 -9.004 361 HD23 LEU 64 3HD2 LEU 64 -12.259 5.304 -10.073 362 H ILE 65 H ILE 65 -16.834 1.001 -10.909 363 HA ILE 65 HA ILE 65 -16.016 -1.887 -10.753 364 HB ILE 65 HB ILE 65 -18.309 -2.268 -11.805 365 HG12 ILE 65 2HG1 ILE 65 -19.052 0.443 -10.637 366 HG13 ILE 65 3HG1 ILE 65 -18.612 0.275 -12.329 367 HG21 ILE 65 1HG2 ILE 65 -18.194 -1.155 -8.972 368 HG22 ILE 65 2HG2 ILE 65 -19.413 -2.273 -9.601 369 HG23 ILE 65 3HG2 ILE 65 -17.734 -2.800 -9.469 370 HD11 ILE 65 1HD1 ILE 65 -20.399 -1.358 -12.682 371 HD12 ILE 65 2HD1 ILE 65 -20.918 -1.143 -10.983 372 HD13 ILE 65 3HD1 ILE 65 -20.994 0.220 -12.115 373 HA PRO 66 HA PRO 66 -14.709 -1.277 -15.007 374 HB2 PRO 66 2HB PRO 66 -14.298 -3.853 -15.823 375 HB3 PRO 66 3HB PRO 66 -13.218 -3.019 -14.658 376 HG2 PRO 66 2HG PRO 66 -15.466 -4.949 -14.031 377 HG3 PRO 66 3HG PRO 66 -13.808 -4.922 -13.371 378 HD2 PRO 66 2HD PRO 66 -15.938 -3.821 -12.055 379 HD3 PRO 66 3HD PRO 66 -14.293 -3.126 -11.946 380 H THR 67 H THR 67 -15.994 -0.776 -16.672 381 HA THR 67 HA THR 67 -18.632 -2.196 -17.025 382 HB THR 67 HB THR 67 -17.826 0.716 -17.446 383 HG1 THR 67 HG1 THR 67 -18.186 -0.113 -15.320 384 HG21 THR 67 1HG2 THR 67 -20.519 -0.660 -17.907 385 HG22 THR 67 2HG2 THR 67 -19.524 0.165 -19.139 386 HG23 THR 67 3HG2 THR 67 -20.262 1.095 -17.827 387 H GLY 68 H GLY 68 -15.807 -0.921 -18.763 388 HA2 GLY 68 HA2 GLY 68 -15.844 -2.760 -20.875 389 HA3 GLY 68 HA3 GLY 68 -16.836 -1.429 -21.414 390 H THR 69 H THR 69 -15.805 0.226 -22.386 391 HA THR 69 HA THR 69 -12.939 0.505 -22.619 392 HB THR 69 HB THR 69 -14.669 1.328 -24.245 393 HG1 THR 69 HG1 THR 69 -13.425 3.098 -24.784 394 HG21 THR 69 1HG2 THR 69 -16.206 2.477 -22.633 395 HG22 THR 69 2HG2 THR 69 -15.674 3.530 -23.956 396 HG23 THR 69 3HG2 THR 69 -14.951 3.701 -22.343 397 H GLY 70 H GLY 70 -15.147 1.564 -20.151 398 HA2 GLY 70 HA2 GLY 70 -12.888 2.773 -18.615 399 HA3 GLY 70 HA3 GLY 70 -14.410 3.647 -18.809 400 H ALA 71 H ALA 71 -13.759 3.434 -16.401 401 HA ALA 71 HA ALA 71 -15.292 1.212 -15.138 402 HB1 ALA 71 1HB ALA 71 -13.528 3.211 -13.716 403 HB2 ALA 71 2HB ALA 71 -14.071 1.603 -13.180 404 HB3 ALA 71 3HB ALA 71 -12.881 1.734 -14.460 405 H LEU 72 H LEU 72 -16.734 1.834 -13.323 406 HA LEU 72 HA LEU 72 -18.061 4.522 -13.576 407 HB2 LEU 72 2HB LEU 72 -19.115 1.848 -14.117 408 HB3 LEU 72 3HB LEU 72 -19.931 2.493 -12.725 409 HG LEU 72 HG LEU 72 -20.648 4.468 -13.977 410 HD11 LEU 72 1HD1 LEU 72 -19.055 3.222 -16.253 411 HD12 LEU 72 2HD1 LEU 72 -18.872 4.830 -15.525 412 HD13 LEU 72 3HD1 LEU 72 -20.310 4.458 -16.486 413 HD21 LEU 72 1HD2 LEU 72 -22.200 3.309 -15.514 414 HD22 LEU 72 2HD2 LEU 72 -22.036 2.429 -13.990 415 HD23 LEU 72 3HD2 LEU 72 -21.195 1.843 -15.438 416 H LEU 73 H LEU 73 -18.822 5.453 -11.667 417 HA LEU 73 HA LEU 73 -17.583 4.763 -9.243 418 HB2 LEU 73 2HB LEU 73 -18.482 6.979 -9.951 419 HB3 LEU 73 3HB LEU 73 -20.098 6.430 -9.590 420 HG LEU 73 HG LEU 73 -18.979 7.905 -7.882 421 HD11 LEU 73 1HD1 LEU 73 -20.901 6.515 -7.244 422 HD12 LEU 73 2HD1 LEU 73 -19.783 6.799 -5.906 423 HD13 LEU 73 3HD1 LEU 73 -19.805 5.227 -6.727 424 HD21 LEU 73 1HD2 LEU 73 -17.243 7.076 -6.429 425 HD22 LEU 73 2HD2 LEU 73 -16.696 6.818 -8.087 426 HD23 LEU 73 3HD2 LEU 73 -17.324 5.460 -7.134 427 H GLY 74 H GLY 74 -17.704 3.015 -8.175 428 HA2 GLY 74 HA2 GLY 74 -20.267 1.578 -7.657 429 HA3 GLY 74 HA3 GLY 74 -18.613 1.007 -7.314 430 H SER 75 H SER 75 -17.624 3.363 -5.984 431 HA SER 75 HA SER 75 -19.430 4.283 -3.916 432 HB2 SER 75 2HB SER 75 -17.441 2.093 -3.265 433 HB3 SER 75 3HB SER 75 -17.796 3.350 -2.073 434 HG SER 75 HG SER 75 -19.836 1.827 -3.346 435 H LEU 76 H LEU 76 -18.549 5.965 -2.656 436 HA LEU 76 HA LEU 76 -15.741 6.772 -3.232 437 HB2 LEU 76 2HB LEU 76 -17.387 8.153 -4.487 438 HB3 LEU 76 3HB LEU 76 -18.119 8.685 -2.979 439 HG LEU 76 HG LEU 76 -15.135 9.040 -3.270 440 HD11 LEU 76 1HD1 LEU 76 -15.861 9.680 -5.484 441 HD12 LEU 76 2HD1 LEU 76 -15.430 11.138 -4.574 442 HD13 LEU 76 3HD1 LEU 76 -17.144 10.699 -4.816 443 HD21 LEU 76 1HD2 LEU 76 -17.316 10.890 -2.204 444 HD22 LEU 76 2HD2 LEU 76 -15.566 11.182 -2.134 445 HD23 LEU 76 3HD2 LEU 76 -16.266 9.836 -1.220 446 H THR 77 H THR 77 -14.580 6.896 -1.517 447 HA THR 77 HA THR 77 -15.756 6.931 1.244 448 HB THR 77 HB THR 77 -13.080 6.011 0.104 449 HG1 THR 77 HG1 THR 77 -15.279 4.600 1.220 450 HG21 THR 77 1HG2 THR 77 -14.100 5.929 2.979 451 HG22 THR 77 2HG2 THR 77 -12.659 6.784 2.368 452 HG23 THR 77 3HG2 THR 77 -12.692 5.022 2.370 453 H VAL 78 H VAL 78 -15.547 8.884 2.295 454 HA VAL 78 HA VAL 78 -13.344 10.722 1.505 455 HB VAL 78 HB VAL 78 -14.266 12.331 3.096 456 HG11 VAL 78 1HG1 VAL 78 -16.191 13.009 1.719 457 HG12 VAL 78 2HG1 VAL 78 -14.876 12.437 0.697 458 HG13 VAL 78 3HG1 VAL 78 -16.270 11.380 0.996 459 HG21 VAL 78 1HG2 VAL 78 -16.614 10.409 3.394 460 HG22 VAL 78 2HG2 VAL 78 -15.476 10.921 4.667 461 HG23 VAL 78 3HG2 VAL 78 -16.565 12.102 3.936 462 H LEU 79 H LEU 79 -11.463 10.825 2.651 463 HA LEU 79 HA LEU 79 -11.316 9.246 5.188 464 HB2 LEU 79 2HB LEU 79 -9.963 8.387 3.328 465 HB3 LEU 79 3HB LEU 79 -9.183 9.954 3.156 466 HG LEU 79 HG LEU 79 -8.152 9.721 5.391 467 HD11 LEU 79 1HD1 LEU 79 -9.784 8.309 6.570 468 HD12 LEU 79 2HD1 LEU 79 -8.211 7.516 6.559 469 HD13 LEU 79 3HD1 LEU 79 -9.478 6.973 5.440 470 HD21 LEU 79 1HD2 LEU 79 -6.970 8.912 3.365 471 HD22 LEU 79 2HD2 LEU 79 -7.693 7.303 3.584 472 HD23 LEU 79 3HD2 LEU 79 -6.561 7.958 4.797 473 H ASP 80 H ASP 80 -10.363 12.327 3.655 474 HA ASP 80 HA ASP 80 -11.036 13.834 5.957 475 HB2 ASP 80 2HB ASP 80 -8.516 12.795 6.353 476 HB3 ASP 80 3HB ASP 80 -8.118 14.262 5.488 477 H GLY 81 H GLY 81 -10.221 16.201 5.649 478 HA2 GLY 81 HA2 GLY 81 -9.165 17.582 3.778 479 HA3 GLY 81 HA3 GLY 81 -10.529 17.030 2.796 480 H ASP 82 H ASP 82 -10.167 19.609 2.923 481 HA ASP 82 HA ASP 82 -11.950 20.801 4.959 482 HB2 ASP 82 2HB ASP 82 -10.012 22.085 4.380 483 HB3 ASP 82 3HB ASP 82 -10.322 21.948 2.679 484 H SER 83 H SER 83 -14.057 20.829 4.668 485 HA SER 83 HA SER 83 -15.070 18.901 3.004 486 HB2 SER 83 2HB SER 83 -17.297 19.561 3.866 487 HB3 SER 83 3HB SER 83 -16.062 19.455 5.128 488 HG SER 83 HG SER 83 -17.329 21.365 5.335 489 H ARG 84 H ARG 84 -14.859 22.247 2.144 490 HA ARG 84 HA ARG 84 -16.785 22.501 0.089 491 HB2 ARG 84 2HB ARG 84 -13.978 23.602 0.458 492 HB3 ARG 84 3HB ARG 84 -14.933 24.020 -0.954 493 HG2 ARG 84 2HG ARG 84 -15.884 24.481 1.913 494 HG3 ARG 84 3HG ARG 84 -14.997 25.677 0.974 495 HD2 ARG 84 2HD ARG 84 -17.696 24.505 0.164 496 HD3 ARG 84 3HD ARG 84 -17.435 26.072 0.944 497 HE ARG 84 HE ARG 84 -15.814 25.936 -1.403 498 HH11 ARG 84 1HH1 ARG 84 -19.250 26.284 -0.625 499 HH12 ARG 84 2HH1 ARG 84 -19.563 27.161 -2.101 500 HH21 ARG 84 1HH2 ARG 84 -16.264 26.984 -3.214 501 HH22 ARG 84 2HH2 ARG 84 -17.881 27.553 -3.569 502 H LEU 85 H LEU 85 -13.697 20.628 0.023 503 HA LEU 85 HA LEU 85 -14.084 20.150 -2.888 504 HB2 LEU 85 2HB LEU 85 -11.871 20.707 -2.123 505 HB3 LEU 85 3HB LEU 85 -11.863 19.372 -0.965 506 HG LEU 85 HG LEU 85 -11.751 17.739 -2.709 507 HD11 LEU 85 1HD1 LEU 85 -11.696 18.268 -5.125 508 HD12 LEU 85 2HD1 LEU 85 -12.066 19.972 -4.777 509 HD13 LEU 85 3HD1 LEU 85 -13.262 18.704 -4.454 510 HD21 LEU 85 1HD2 LEU 85 -9.615 18.279 -3.701 511 HD22 LEU 85 2HD2 LEU 85 -9.662 19.081 -2.125 512 HD23 LEU 85 3HD2 LEU 85 -9.936 20.031 -3.581 513 H CYS 86 H CYS 86 -13.878 18.082 0.125 514 HA CYS 86 HA CYS 86 -14.730 15.693 -0.814 515 HB2 CYS 86 2HB CYS 86 -15.893 16.948 1.703 516 HB3 CYS 86 3HB CYS 86 -15.591 15.248 1.376 517 HG CYS 86 HG CYS 86 -12.933 15.500 1.193 518 H ALA 87 H ALA 87 -17.034 18.355 0.018 519 HA ALA 87 HA ALA 87 -19.381 16.844 -0.664 520 HB1 ALA 87 1HB ALA 87 -20.495 19.046 -0.491 521 HB2 ALA 87 2HB ALA 87 -19.360 18.809 0.854 522 HB3 ALA 87 3HB ALA 87 -18.919 19.854 -0.503 523 H ALA 88 H ALA 88 -17.330 19.021 -2.590 524 HA ALA 88 HA ALA 88 -19.103 19.151 -4.852 525 HB1 ALA 88 1HB ALA 88 -16.129 19.837 -4.567 526 HB2 ALA 88 2HB ALA 88 -17.204 20.342 -5.880 527 HB3 ALA 88 3HB ALA 88 -17.490 20.924 -4.244 528 H THR 89 H THR 89 -16.028 17.342 -4.308 529 HA THR 89 HA THR 89 -16.010 15.976 -6.822 530 HB THR 89 HB THR 89 -14.054 16.215 -5.354 531 HG1 THR 89 HG1 THR 89 -13.327 14.124 -5.869 532 HG21 THR 89 1HG2 THR 89 -15.078 13.812 -3.777 533 HG22 THR 89 2HG2 THR 89 -15.242 15.472 -3.185 534 HG23 THR 89 3HG2 THR 89 -13.630 14.816 -3.485 535 H LYS 90 H LYS 90 -17.349 15.008 -3.682 536 HA LYS 90 HA LYS 90 -18.224 12.399 -4.195 537 HB2 LYS 90 2HB LYS 90 -18.192 13.450 -2.029 538 HB3 LYS 90 3HB LYS 90 -19.329 14.698 -2.565 539 HG2 LYS 90 2HG LYS 90 -20.937 12.584 -2.880 540 HG3 LYS 90 3HG LYS 90 -19.835 11.862 -1.708 541 HD2 LYS 90 2HD LYS 90 -21.249 14.533 -1.420 542 HD3 LYS 90 3HD LYS 90 -21.842 13.034 -0.698 543 HE2 LYS 90 2HE LYS 90 -19.118 14.285 -0.070 544 HE3 LYS 90 3HE LYS 90 -20.587 14.591 0.868 545 HZ1 LYS 90 HZ1 LYS 90 -20.700 12.222 1.374 546 HZ2 LYS 90 HZ2 LYS 90 -19.268 12.825 1.870 547 HZ3 LYS 90 HZ3 LYS 90 -19.341 11.921 0.514 548 H ARG 91 H ARG 91 -19.898 15.457 -4.827 549 HA ARG 91 HA ARG 91 -22.197 14.220 -6.079 550 HB2 ARG 91 2HB ARG 91 -21.143 17.072 -6.069 551 HB3 ARG 91 3HB ARG 91 -22.653 16.609 -6.868 552 HG2 ARG 91 2HG ARG 91 -23.658 15.907 -4.790 553 HG3 ARG 91 3HG ARG 91 -22.144 16.085 -3.914 554 HD2 ARG 91 2HD ARG 91 -23.557 17.996 -3.412 555 HD3 ARG 91 3HD ARG 91 -22.151 18.520 -4.331 556 HE ARG 91 HE ARG 91 -23.494 19.179 -6.074 557 HH11 ARG 91 1HH1 ARG 91 -25.522 17.186 -3.968 558 HH12 ARG 91 2HH1 ARG 91 -26.980 17.623 -4.808 559 HH21 ARG 91 1HH2 ARG 91 -25.398 19.702 -7.099 560 HH22 ARG 91 2HH2 ARG 91 -26.906 19.008 -6.574 561 H ALA 92 H ALA 92 -19.312 15.818 -7.496 562 HA ALA 92 HA ALA 92 -20.048 15.561 -10.224 563 HB1 ALA 92 1HB ALA 92 -17.618 15.840 -10.650 564 HB2 ALA 92 2HB ALA 92 -18.253 17.002 -9.492 565 HB3 ALA 92 3HB ALA 92 -17.296 15.616 -8.918 566 H VAL 93 H VAL 93 -18.069 13.330 -8.210 567 HA VAL 93 HA VAL 93 -17.742 11.376 -10.238 568 HB VAL 93 HB VAL 93 -17.782 10.554 -7.335 569 HG11 VAL 93 1HG1 VAL 93 -17.280 8.913 -9.207 570 HG12 VAL 93 2HG1 VAL 93 -15.860 9.895 -9.597 571 HG13 VAL 93 3HG1 VAL 93 -15.995 9.096 -8.023 572 HG21 VAL 93 1HG2 VAL 93 -16.277 12.083 -6.748 573 HG22 VAL 93 2HG2 VAL 93 -15.130 11.422 -7.917 574 HG23 VAL 93 3HG2 VAL 93 -16.166 12.749 -8.371 575 H ALA 94 H ALA 94 -20.461 12.002 -8.200 576 HA ALA 94 HA ALA 94 -21.749 9.381 -8.595 577 HB1 ALA 94 1HB ALA 94 -22.816 11.973 -7.393 578 HB2 ALA 94 2HB ALA 94 -23.611 10.387 -7.357 579 HB3 ALA 94 3HB ALA 94 -22.082 10.635 -6.504 580 H GLN 95 H GLN 95 -21.272 12.119 -10.567 581 HA GLN 95 HA GLN 95 -23.684 11.453 -12.228 582 HB2 GLN 95 2HB GLN 95 -24.133 13.778 -12.566 583 HB3 GLN 95 3HB GLN 95 -24.102 13.400 -10.849 584 HG2 GLN 95 2HG GLN 95 -22.902 15.421 -10.898 585 HG3 GLN 95 3HG GLN 95 -21.678 14.239 -10.868 586 HE21 GLN 95 1HE2 GLN 95 -20.104 14.389 -12.507 587 HE22 GLN 95 2HE2 GLN 95 -20.288 15.487 -13.875 588 H VAL 96 H VAL 96 -20.250 11.913 -12.254 589 HA VAL 96 HA VAL 96 -19.806 12.490 -14.993 590 HB VAL 96 HB VAL 96 -17.734 11.110 -14.761 591 HG11 VAL 96 1HG1 VAL 96 -18.005 13.043 -12.464 592 HG12 VAL 96 2HG1 VAL 96 -16.564 12.601 -13.338 593 HG13 VAL 96 3HG1 VAL 96 -17.831 13.525 -14.174 594 HG21 VAL 96 1HG2 VAL 96 -17.127 10.469 -12.388 595 HG22 VAL 96 2HG2 VAL 96 -18.838 10.525 -12.014 596 HG23 VAL 96 3HG2 VAL 96 -18.261 9.373 -13.229 597 H ASN 97 H ASN 97 -19.624 11.287 -16.866 598 HA ASN 97 HA ASN 97 -21.502 9.197 -17.175 599 HB2 ASN 97 2HB ASN 97 -20.622 9.096 -19.519 600 HB3 ASN 97 3HB ASN 97 -21.094 10.697 -18.967 601 HD21 ASN 97 1HD2 ASN 97 -18.238 8.645 -19.753 602 HD22 ASN 97 2HD2 ASN 97 -17.146 9.996 -19.900 603 H SER 98 H SER 98 -17.933 8.988 -17.128 604 HA SER 98 HA SER 98 -17.505 6.366 -16.230 605 HB2 SER 98 2HB SER 98 -16.980 5.233 -18.421 606 HB3 SER 98 3HB SER 98 -18.699 5.411 -18.077 607 HG SER 98 HG SER 98 -18.196 5.960 -20.244 608 H PHE 99 H PHE 99 -15.329 5.856 -16.160 609 HA PHE 99 HA PHE 99 -13.471 8.028 -16.990 610 HB2 PHE 99 2HB PHE 99 -12.901 5.729 -15.093 611 HB3 PHE 99 3HB PHE 99 -12.084 7.272 -15.227 612 HD1 PHE 99 HD1 PHE 99 -14.828 5.411 -13.710 613 HD2 PHE 99 HD2 PHE 99 -13.241 9.371 -14.384 614 HE1 PHE 99 HE1 PHE 99 -16.329 6.315 -11.971 615 HE2 PHE 99 HE2 PHE 99 -14.745 10.263 -12.639 616 HZ PHE 99 HZ PHE 99 -16.252 8.697 -11.393 617 HA PRO 100 HA PRO 100 -12.492 4.807 -20.107 618 HB2 PRO 100 2HB PRO 100 -10.799 6.940 -21.340 619 HB3 PRO 100 3HB PRO 100 -12.057 5.928 -22.097 620 HG2 PRO 100 2HG PRO 100 -12.509 8.552 -21.537 621 HG3 PRO 100 3HG PRO 100 -13.792 7.324 -21.270 622 HD2 PRO 100 2HD PRO 100 -11.868 8.490 -19.230 623 HD3 PRO 100 3HD PRO 100 -13.638 8.318 -19.137 624 H LEU 101 H LEU 101 -10.825 3.290 -19.968 625 HA LEU 101 HA LEU 101 -8.627 3.893 -18.175 626 HB2 LEU 101 2HB LEU 101 -8.824 1.408 -19.889 627 HB3 LEU 101 3HB LEU 101 -8.024 1.620 -18.340 628 HG LEU 101 HG LEU 101 -10.969 1.383 -18.927 629 HD11 LEU 101 1HD1 LEU 101 -9.136 -0.279 -17.173 630 HD12 LEU 101 2HD1 LEU 101 -9.658 -0.699 -18.817 631 HD13 LEU 101 3HD1 LEU 101 -10.854 -0.594 -17.509 632 HD21 LEU 101 1HD2 LEU 101 -10.879 3.070 -17.162 633 HD22 LEU 101 2HD2 LEU 101 -9.693 2.133 -16.274 634 HD23 LEU 101 3HD2 LEU 101 -11.355 1.541 -16.433 635 HA PRO 102 HA PRO 102 -5.575 4.734 -21.431 636 HB2 PRO 102 2HB PRO 102 -3.242 4.325 -20.073 637 HB3 PRO 102 3HB PRO 102 -4.284 5.750 -19.798 638 HG2 PRO 102 2HG PRO 102 -4.148 3.201 -18.158 639 HG3 PRO 102 3HG PRO 102 -4.158 4.904 -17.592 640 HD2 PRO 102 2HD PRO 102 -6.411 3.343 -17.686 641 HD3 PRO 102 3HD PRO 102 -6.454 5.108 -17.940 642 H LYS 103 H LYS 103 -5.367 1.802 -19.368 643 HA LYS 103 HA LYS 103 -4.708 0.080 -21.685 644 HB2 LYS 103 2HB LYS 103 -3.127 0.427 -19.105 645 HB3 LYS 103 3HB LYS 103 -3.204 -1.117 -19.899 646 HG2 LYS 103 2HG LYS 103 -1.249 -0.319 -20.784 647 HG3 LYS 103 3HG LYS 103 -2.404 0.037 -22.053 648 HD2 LYS 103 2HD LYS 103 -0.987 1.942 -21.839 649 HD3 LYS 103 3HD LYS 103 -2.539 2.391 -21.158 650 HE2 LYS 103 2HE LYS 103 -0.878 3.312 -19.736 651 HE3 LYS 103 3HE LYS 103 -1.673 2.001 -18.870 652 HZ1 LYS 103 HZ1 LYS 103 0.257 0.601 -19.433 653 HZ2 LYS 103 HZ2 LYS 103 0.758 1.945 -18.647 654 HZ3 LYS 103 HZ3 LYS 103 0.937 1.828 -20.284 655 H ASP 104 H ASP 104 -5.140 -2.185 -21.281 656 HA ASP 104 HA ASP 104 -7.576 -2.493 -19.601 657 HB2 ASP 104 2HB ASP 104 -7.797 -1.953 -22.055 658 HB3 ASP 104 3HB ASP 104 -6.992 -3.476 -22.417 659 H GLN 105 H GLN 105 -4.742 -3.617 -19.024 660 HA GLN 105 HA GLN 105 -5.160 -6.508 -19.361 661 HB2 GLN 105 2HB GLN 105 -2.853 -5.000 -18.119 662 HB3 GLN 105 3HB GLN 105 -3.008 -6.745 -18.132 663 HG2 GLN 105 2HG GLN 105 -1.570 -6.135 -19.954 664 HG3 GLN 105 3HG GLN 105 -3.070 -6.795 -20.603 665 HE21 GLN 105 1HE2 GLN 105 -2.003 -3.534 -19.491 666 HE22 GLN 105 2HE2 GLN 105 -2.500 -2.705 -20.965 667 HA PRO 106 HA PRO 106 -7.223 -6.797 -15.447 668 HB2 PRO 106 2HB PRO 106 -6.804 -9.419 -14.744 669 HB3 PRO 106 3HB PRO 106 -7.909 -8.896 -16.059 670 HG2 PRO 106 2HG PRO 106 -5.020 -9.804 -16.298 671 HG3 PRO 106 3HG PRO 106 -6.438 -10.385 -17.232 672 HD2 PRO 106 2HD PRO 106 -4.772 -8.500 -18.226 673 HD3 PRO 106 3HD PRO 106 -6.535 -8.369 -18.475 674 H ASP 107 H ASP 107 -3.840 -6.821 -15.707 675 HA ASP 107 HA ASP 107 -3.376 -7.008 -12.773 676 HB2 ASP 107 2HB ASP 107 -1.703 -7.922 -14.378 677 HB3 ASP 107 3HB ASP 107 -1.461 -6.293 -15.018 678 H VAL 108 H VAL 108 -3.743 -4.585 -15.345 679 HA VAL 108 HA VAL 108 -3.045 -2.394 -13.458 680 HB VAL 108 HB VAL 108 -2.966 -0.920 -15.253 681 HG11 VAL 108 1HG1 VAL 108 -1.049 -1.785 -16.511 682 HG12 VAL 108 2HG1 VAL 108 -0.954 -2.297 -14.816 683 HG13 VAL 108 3HG1 VAL 108 -1.481 -3.455 -16.065 684 HG21 VAL 108 1HG2 VAL 108 -3.839 -3.090 -17.156 685 HG22 VAL 108 2HG2 VAL 108 -4.755 -1.624 -16.692 686 HG23 VAL 108 3HG2 VAL 108 -3.260 -1.483 -17.605 687 H VAL 109 H VAL 109 -5.849 -3.697 -15.200 688 HA VAL 109 HA VAL 109 -7.726 -1.656 -14.632 689 HB VAL 109 HB VAL 109 -8.002 -4.679 -14.672 690 HG11 VAL 109 1HG1 VAL 109 -10.257 -2.624 -14.554 691 HG12 VAL 109 2HG1 VAL 109 -10.459 -4.338 -14.982 692 HG13 VAL 109 3HG1 VAL 109 -9.916 -3.902 -13.367 693 HG21 VAL 109 1HG2 VAL 109 -8.941 -4.342 -16.896 694 HG22 VAL 109 2HG2 VAL 109 -8.926 -2.580 -16.700 695 HG23 VAL 109 3HG2 VAL 109 -7.404 -3.475 -16.843 696 H GLU 110 H GLU 110 -6.085 -3.860 -12.474 697 HA GLU 110 HA GLU 110 -7.862 -3.504 -10.197 698 HB2 GLU 110 2HB GLU 110 -5.220 -4.828 -10.481 699 HB3 GLU 110 3HB GLU 110 -6.137 -4.809 -8.985 700 HG2 GLU 110 2HG GLU 110 -7.268 -5.904 -11.608 701 HG3 GLU 110 3HG GLU 110 -6.434 -6.858 -10.410 702 H LYS 111 H LYS 111 -5.432 -1.530 -11.514 703 HA LYS 111 HA LYS 111 -4.705 -0.353 -8.879 704 HB2 LYS 111 2HB LYS 111 -3.608 -0.033 -11.678 705 HB3 LYS 111 3HB LYS 111 -3.363 1.233 -10.477 706 HG2 LYS 111 2HG LYS 111 -1.460 -0.280 -10.569 707 HG3 LYS 111 3HG LYS 111 -2.214 -0.264 -8.967 708 HD2 LYS 111 2HD LYS 111 -3.221 -2.426 -9.293 709 HD3 LYS 111 3HD LYS 111 -2.912 -2.357 -11.034 710 HE2 LYS 111 2HE LYS 111 -0.436 -2.326 -10.522 711 HE3 LYS 111 3HE LYS 111 -0.835 -2.567 -8.809 712 HZ1 LYS 111 HZ1 LYS 111 -1.823 -4.687 -9.402 713 HZ2 LYS 111 HZ2 LYS 111 -0.320 -4.674 -10.056 714 HZ3 LYS 111 HZ3 LYS 111 -1.622 -4.418 -11.000 715 H LEU 112 H LEU 112 -6.007 0.647 -11.992 716 HA LEU 112 HA LEU 112 -6.738 3.263 -11.159 717 HB2 LEU 112 2HB LEU 112 -7.819 3.400 -13.420 718 HB3 LEU 112 3HB LEU 112 -6.192 2.836 -13.378 719 HG LEU 112 HG LEU 112 -7.017 0.558 -13.479 720 HD11 LEU 112 1HD1 LEU 112 -9.229 0.138 -14.629 721 HD12 LEU 112 2HD1 LEU 112 -9.683 1.756 -14.069 722 HD13 LEU 112 3HD1 LEU 112 -9.230 0.496 -12.909 723 HD21 LEU 112 1HD2 LEU 112 -7.284 0.508 -15.915 724 HD22 LEU 112 2HD2 LEU 112 -5.951 1.510 -15.374 725 HD23 LEU 112 3HD2 LEU 112 -7.492 2.275 -15.897 726 H LYS 113 H LYS 113 -8.546 0.244 -10.762 727 HA LYS 113 HA LYS 113 -11.093 1.518 -10.468 728 HB2 LYS 113 2HB LYS 113 -11.771 -0.655 -9.636 729 HB3 LYS 113 3HB LYS 113 -10.766 -0.832 -11.091 730 HG2 LYS 113 2HG LYS 113 -8.773 -1.329 -9.635 731 HG3 LYS 113 3HG LYS 113 -9.812 -1.190 -8.206 732 HD2 LYS 113 2HD LYS 113 -9.893 -3.264 -10.376 733 HD3 LYS 113 3HD LYS 113 -9.517 -3.470 -8.641 734 HE2 LYS 113 2HE LYS 113 -11.922 -2.786 -8.212 735 HE3 LYS 113 3HE LYS 113 -12.144 -2.806 -9.980 736 HZ1 LYS 113 HZ1 LYS 113 -12.764 -4.983 -9.238 737 HZ2 LYS 113 HZ2 LYS 113 -11.482 -5.101 -8.221 738 HZ3 LYS 113 HZ3 LYS 113 -11.227 -5.196 -9.815 739 H ASN 114 H ASN 114 -8.456 1.086 -8.259 740 HA ASN 114 HA ASN 114 -10.044 2.311 -6.045 741 HB2 ASN 114 2HB ASN 114 -7.817 0.277 -5.802 742 HB3 ASN 114 3HB ASN 114 -8.675 1.075 -4.474 743 HD21 ASN 114 1HD2 ASN 114 -11.358 0.886 -5.273 744 HD22 ASN 114 2HD2 ASN 114 -11.793 -0.804 -5.387 745 H ILE 115 H ILE 115 -9.346 4.387 -6.840 746 HA ILE 115 HA ILE 115 -6.472 5.024 -6.372 747 HB ILE 115 HB ILE 115 -6.797 7.086 -7.554 748 HG12 ILE 115 2HG1 ILE 115 -9.278 7.288 -7.199 749 HG13 ILE 115 3HG1 ILE 115 -8.663 7.744 -8.742 750 HG21 ILE 115 1HG2 ILE 115 -7.363 4.548 -9.131 751 HG22 ILE 115 2HG2 ILE 115 -6.856 6.090 -9.843 752 HG23 ILE 115 3HG2 ILE 115 -5.790 5.234 -8.705 753 HD11 ILE 115 1HD1 ILE 115 -10.107 5.152 -8.191 754 HD12 ILE 115 2HD1 ILE 115 -10.717 6.575 -9.058 755 HD13 ILE 115 3HD1 ILE 115 -9.403 5.634 -9.745 756 H ASN 116 H ASN 116 -5.854 6.755 -5.114 757 HA ASN 116 HA ASN 116 -7.999 8.000 -3.468 758 HB2 ASN 116 2HB ASN 116 -5.119 8.646 -2.990 759 HB3 ASN 116 3HB ASN 116 -6.515 8.642 -1.899 760 HD21 ASN 116 1HD2 ASN 116 -7.396 5.917 -2.088 761 HD22 ASN 116 2HD2 ASN 116 -6.088 4.934 -1.480 762 H LEU 117 H LEU 117 -8.642 10.002 -4.009 763 HA LEU 117 HA LEU 117 -6.915 11.777 -5.691 764 HB2 LEU 117 2HB LEU 117 -9.714 12.252 -4.605 765 HB3 LEU 117 3HB LEU 117 -8.761 13.365 -5.590 766 HG LEU 117 HG LEU 117 -9.845 10.639 -6.478 767 HD11 LEU 117 1HD1 LEU 117 -11.604 12.343 -6.182 768 HD12 LEU 117 2HD1 LEU 117 -11.370 11.940 -7.888 769 HD13 LEU 117 3HD1 LEU 117 -10.707 13.457 -7.235 770 HD21 LEU 117 1HD2 LEU 117 -7.792 11.068 -7.687 771 HD22 LEU 117 2HD2 LEU 117 -8.287 12.758 -7.994 772 HD23 LEU 117 3HD2 LEU 117 -9.144 11.399 -8.768 773 H THR 118 H THR 118 -5.380 12.598 -4.483 774 HA THR 118 HA THR 118 -5.948 13.606 -1.733 775 HB THR 118 HB THR 118 -3.569 11.912 -2.569 776 HG1 THR 118 HG1 THR 118 -4.484 10.541 -0.993 777 HG21 THR 118 1HG2 THR 118 -3.058 12.086 -0.074 778 HG22 THR 118 2HG2 THR 118 -4.243 13.408 0.007 779 HG23 THR 118 3HG2 THR 118 -2.784 13.578 -0.983 780 H VAL 119 H VAL 119 -5.364 15.616 -1.500 781 HA VAL 119 HA VAL 119 -3.423 16.910 -3.348 782 HB VAL 119 HB VAL 119 -4.934 18.679 -3.808 783 HG11 VAL 119 1HG1 VAL 119 -6.554 16.144 -4.215 784 HG12 VAL 119 2HG1 VAL 119 -6.633 17.642 -5.161 785 HG13 VAL 119 3HG1 VAL 119 -5.173 16.637 -5.231 786 HG21 VAL 119 1HG2 VAL 119 -6.998 17.334 -2.047 787 HG22 VAL 119 2HG2 VAL 119 -6.186 18.876 -1.709 788 HG23 VAL 119 3HG2 VAL 119 -7.288 18.748 -3.077 789 H ALA 120 H ALA 120 -2.451 18.816 -2.552 790 HA ALA 120 HA ALA 120 -2.989 19.917 0.069 791 HB1 ALA 120 1HB ALA 120 -1.895 17.793 0.748 792 HB2 ALA 120 2HB ALA 120 -0.528 18.150 -0.334 793 HB3 ALA 120 3HB ALA 120 -0.828 19.157 1.093 794 HA PRO 121 HA PRO 121 -0.666 23.214 -1.834 795 HB2 PRO 121 2HB PRO 121 -0.093 24.854 0.245 796 HB3 PRO 121 3HB PRO 121 -1.782 24.550 -0.262 797 HG2 PRO 121 2HG PRO 121 -0.241 23.185 1.983 798 HG3 PRO 121 3HG PRO 121 -1.874 23.918 2.061 799 HD2 PRO 121 2HD PRO 121 -1.480 21.249 1.658 800 HD3 PRO 121 3HD PRO 121 -2.827 22.129 0.891 801 H GLU 122 H GLU 122 1.465 24.266 -1.908 802 HA GLU 122 HA GLU 122 3.697 23.192 -0.374 803 HB2 GLU 122 2HB GLU 122 3.153 21.520 -2.292 804 HB3 GLU 122 3HB GLU 122 3.766 22.760 -3.385 805 HG2 GLU 122 2HG GLU 122 5.305 21.511 -1.050 806 HG3 GLU 122 3HG GLU 122 5.418 20.988 -2.724 Start of MODEL 16 1 H1 ALA 22 H ALA 22 16.227 5.978 -23.360 2 HA ALA 22 HA ALA 22 17.754 3.426 -23.632 3 HB1 ALA 22 1HB ALA 22 19.635 4.711 -22.778 4 HB2 ALA 22 2HB ALA 22 18.925 5.568 -24.162 5 HB3 ALA 22 3HB ALA 22 18.588 6.129 -22.507 6 H ALA 23 H ALA 23 15.216 4.006 -21.910 7 HA ALA 23 HA ALA 23 16.358 3.242 -19.268 8 HB1 ALA 23 1HB ALA 23 14.415 5.529 -19.791 9 HB2 ALA 23 2HB ALA 23 14.963 4.946 -18.191 10 HB3 ALA 23 3HB ALA 23 16.120 5.679 -19.325 11 H ARG 24 H ARG 24 13.056 4.114 -19.297 12 HA ARG 24 HA ARG 24 11.155 3.013 -18.910 13 HB2 ARG 24 2HB ARG 24 12.372 0.904 -20.727 14 HB3 ARG 24 3HB ARG 24 10.730 0.812 -20.117 15 HG2 ARG 24 2HG ARG 24 9.997 2.708 -21.221 16 HG3 ARG 24 3HG ARG 24 11.596 3.373 -21.453 17 HD2 ARG 24 2HD ARG 24 10.634 0.832 -22.795 18 HD3 ARG 24 3HD ARG 24 10.474 2.451 -23.515 19 HE ARG 24 HE ARG 24 13.105 2.411 -23.047 20 HH11 ARG 24 1HH1 ARG 24 10.995 0.082 -24.716 21 HH12 ARG 24 2HH1 ARG 24 12.215 -0.290 -25.900 22 HH21 ARG 24 1HH2 ARG 24 14.591 1.912 -24.728 23 HH22 ARG 24 2HH2 ARG 24 14.124 0.808 -25.983 24 H GLN 25 H GLN 25 13.255 2.873 -16.986 25 HA GLN 25 HA GLN 25 12.810 0.258 -15.571 26 HB2 GLN 25 2HB GLN 25 14.955 2.302 -15.012 27 HB3 GLN 25 3HB GLN 25 14.863 0.647 -14.440 28 HG2 GLN 25 2HG GLN 25 15.323 1.515 -17.318 29 HG3 GLN 25 3HG GLN 25 16.557 0.962 -16.229 30 HE21 GLN 25 1HE2 GLN 25 14.634 -0.050 -18.772 31 HE22 GLN 25 2HE2 GLN 25 14.589 -1.772 -18.409 32 H GLN 26 H GLN 26 12.177 3.632 -15.362 33 HA GLN 26 HA GLN 26 11.363 3.536 -12.487 34 HB2 GLN 26 2HB GLN 26 12.545 5.596 -12.149 35 HB3 GLN 26 3HB GLN 26 13.666 4.372 -12.734 36 HG2 GLN 26 2HG GLN 26 12.395 6.533 -14.489 37 HG3 GLN 26 3HG GLN 26 13.983 6.651 -13.728 38 HE21 GLN 26 1HE2 GLN 26 15.648 4.958 -14.396 39 HE22 GLN 26 2HE2 GLN 26 15.543 4.376 -16.042 40 H PHE 27 H PHE 27 10.390 4.399 -15.638 41 HA PHE 27 HA PHE 27 9.263 6.940 -15.203 42 HB2 PHE 27 2HB PHE 27 8.617 6.844 -17.429 43 HB3 PHE 27 3HB PHE 27 10.072 5.844 -17.348 44 HD1 PHE 27 HD1 PHE 27 6.560 5.977 -18.221 45 HD2 PHE 27 HD2 PHE 27 9.787 3.306 -17.214 46 HE1 PHE 27 HE1 PHE 27 5.262 4.074 -19.105 47 HE2 PHE 27 HE2 PHE 27 8.495 1.392 -18.119 48 HZ PHE 27 HZ PHE 27 6.218 1.773 -19.076 49 H VAL 28 H VAL 28 8.038 4.243 -13.844 50 HA VAL 28 HA VAL 28 5.243 4.267 -14.296 51 HB VAL 28 HB VAL 28 5.030 3.362 -11.959 52 HG11 VAL 28 1HG1 VAL 28 6.111 1.206 -12.494 53 HG12 VAL 28 2HG1 VAL 28 5.349 1.899 -13.938 54 HG13 VAL 28 3HG1 VAL 28 7.107 1.996 -13.731 55 HG21 VAL 28 1HG2 VAL 28 7.021 2.677 -10.713 56 HG22 VAL 28 2HG2 VAL 28 8.066 3.533 -11.860 57 HG23 VAL 28 3HG2 VAL 28 6.933 4.439 -10.837 58 H THR 29 H THR 29 7.170 6.404 -12.268 59 HA THR 29 HA THR 29 5.094 7.770 -10.909 60 HB THR 29 HB THR 29 7.455 7.935 -10.352 61 HG1 THR 29 HG1 THR 29 6.128 9.564 -9.613 62 HG21 THR 29 1HG2 THR 29 7.750 9.756 -12.776 63 HG22 THR 29 2HG2 THR 29 8.438 8.122 -12.640 64 HG23 THR 29 3HG2 THR 29 8.986 9.404 -11.540 65 H SER 30 H SER 30 6.230 8.158 -14.244 66 HA SER 30 HA SER 30 4.567 10.502 -14.771 67 HB2 SER 30 2HB SER 30 6.720 9.861 -16.000 68 HB3 SER 30 3HB SER 30 5.811 8.549 -16.751 69 HG SER 30 HG SER 30 5.343 11.363 -16.982 70 H GLU 31 H GLU 31 4.135 6.972 -15.041 71 HA GLU 31 HA GLU 31 1.556 7.153 -16.342 72 HB2 GLU 31 2HB GLU 31 2.626 4.897 -14.600 73 HB3 GLU 31 3HB GLU 31 1.211 4.853 -15.656 74 HG2 GLU 31 2HG GLU 31 2.788 5.444 -17.586 75 HG3 GLU 31 3HG GLU 31 4.123 5.080 -16.488 76 H VAL 32 H VAL 32 2.535 7.545 -12.929 77 HA VAL 32 HA VAL 32 -0.153 7.300 -11.845 78 HB VAL 32 HB VAL 32 2.243 8.842 -10.775 79 HG11 VAL 32 1HG1 VAL 32 0.289 9.821 -9.746 80 HG12 VAL 32 2HG1 VAL 32 -0.416 8.222 -9.429 81 HG13 VAL 32 3HG1 VAL 32 1.050 8.759 -8.571 82 HG21 VAL 32 1HG2 VAL 32 2.438 6.921 -9.213 83 HG22 VAL 32 2HG2 VAL 32 1.065 6.127 -10.024 84 HG23 VAL 32 3HG2 VAL 32 2.589 6.395 -10.885 85 H GLY 33 H GLY 33 1.487 9.762 -13.659 86 HA2 GLY 33 HA2 GLY 33 -0.401 11.948 -13.186 87 HA3 GLY 33 HA3 GLY 33 0.874 11.864 -14.434 88 H ARG 34 H ARG 34 -0.761 9.030 -14.776 89 HA ARG 34 HA ARG 34 -2.980 10.104 -16.492 90 HB2 ARG 34 2HB ARG 34 -1.480 7.474 -16.749 91 HB3 ARG 34 3HB ARG 34 -2.873 8.015 -17.708 92 HG2 ARG 34 2HG ARG 34 -1.535 9.973 -18.491 93 HG3 ARG 34 3HG ARG 34 -0.133 9.371 -17.570 94 HD2 ARG 34 2HD ARG 34 -0.095 7.336 -18.922 95 HD3 ARG 34 3HD ARG 34 -1.525 7.855 -19.820 96 HE ARG 34 HE ARG 34 1.223 8.964 -19.959 97 HH11 ARG 34 1HH1 ARG 34 1.750 10.188 -21.720 98 HH12 ARG 34 2HH1 ARG 34 0.521 10.911 -22.727 99 HH21 ARG 34 1HH2 ARG 34 -2.125 9.376 -21.074 100 HH22 ARG 34 2HH2 ARG 34 -1.655 10.423 -22.379 101 H TYR 35 H TYR 35 -2.082 7.202 -14.622 102 HA TYR 35 HA TYR 35 -4.499 5.874 -14.637 103 HB2 TYR 35 2HB TYR 35 -2.094 5.872 -12.810 104 HB3 TYR 35 3HB TYR 35 -3.528 5.025 -12.258 105 HD1 TYR 35 HD1 TYR 35 -1.425 5.318 -15.388 106 HD2 TYR 35 HD2 TYR 35 -3.879 2.852 -12.866 107 HE1 TYR 35 HE1 TYR 35 -0.963 3.381 -16.865 108 HE2 TYR 35 HE2 TYR 35 -3.554 0.943 -14.378 109 HH TYR 35 HH TYR 35 -1.346 1.165 -17.258 110 H GLY 36 H GLY 36 -3.566 8.060 -12.051 111 HA2 GLY 36 HA2 GLY 36 -6.272 8.088 -10.851 112 HA3 GLY 36 HA3 GLY 36 -4.812 8.932 -10.275 113 H ALA 37 H ALA 37 -4.622 9.870 -13.321 114 HA ALA 37 HA ALA 37 -5.798 12.447 -12.736 115 HB1 ALA 37 1HB ALA 37 -4.278 11.511 -15.188 116 HB2 ALA 37 2HB ALA 37 -4.651 13.175 -14.749 117 HB3 ALA 37 3HB ALA 37 -3.547 12.241 -13.723 118 H ILE 38 H ILE 38 -6.460 9.661 -14.850 119 HA ILE 38 HA ILE 38 -8.437 10.880 -16.519 120 HB ILE 38 HB ILE 38 -9.147 8.606 -17.035 121 HG12 ILE 38 2HG1 ILE 38 -7.660 7.829 -14.501 122 HG13 ILE 38 3HG1 ILE 38 -9.385 7.679 -14.817 123 HG21 ILE 38 1HG2 ILE 38 -6.754 9.494 -17.717 124 HG22 ILE 38 2HG2 ILE 38 -6.173 8.240 -16.592 125 HG23 ILE 38 3HG2 ILE 38 -7.161 7.799 -17.974 126 HD11 ILE 38 1HD1 ILE 38 -8.997 5.948 -16.467 127 HD12 ILE 38 2HD1 ILE 38 -7.220 6.072 -16.193 128 HD13 ILE 38 3HD1 ILE 38 -8.287 5.539 -14.902 129 H TYR 39 H TYR 39 -8.609 9.842 -13.243 130 HA TYR 39 HA TYR 39 -11.537 10.106 -13.081 131 HB2 TYR 39 2HB TYR 39 -9.476 9.753 -10.861 132 HB3 TYR 39 3HB TYR 39 -11.209 9.609 -10.703 133 HD1 TYR 39 HD1 TYR 39 -8.159 7.839 -11.704 134 HD2 TYR 39 HD2 TYR 39 -12.448 7.753 -11.795 135 HE1 TYR 39 HE1 TYR 39 -8.066 5.426 -12.472 136 HE2 TYR 39 HE2 TYR 39 -12.364 5.447 -12.703 137 HH TYR 39 HH TYR 39 -11.100 3.742 -13.437 138 H THR 40 H THR 40 -8.708 11.830 -11.672 139 HA THR 40 HA THR 40 -10.233 13.835 -10.387 140 HB THR 40 HB THR 40 -7.797 13.043 -10.048 141 HG1 THR 40 HG1 THR 40 -8.566 15.776 -9.898 142 HG21 THR 40 1HG2 THR 40 -7.123 13.881 -12.392 143 HG22 THR 40 2HG2 THR 40 -6.041 14.196 -11.023 144 HG23 THR 40 3HG2 THR 40 -7.079 15.493 -11.667 145 H GLN 41 H GLN 41 -8.901 13.774 -13.678 146 HA GLN 41 HA GLN 41 -9.423 16.550 -14.279 147 HB2 GLN 41 2HB GLN 41 -8.920 14.085 -15.989 148 HB3 GLN 41 3HB GLN 41 -9.113 15.714 -16.650 149 HG2 GLN 41 2HG GLN 41 -6.921 14.825 -14.717 150 HG3 GLN 41 3HG GLN 41 -6.731 15.062 -16.444 151 HE21 GLN 41 1HE2 GLN 41 -5.191 16.398 -14.354 152 HE22 GLN 41 2HE2 GLN 41 -5.567 18.105 -14.513 153 H LEU 42 H LEU 42 -11.229 13.477 -14.795 154 HA LEU 42 HA LEU 42 -13.360 14.789 -16.241 155 HB2 LEU 42 2HB LEU 42 -12.804 12.320 -16.328 156 HB3 LEU 42 3HB LEU 42 -13.438 12.201 -14.677 157 HG LEU 42 HG LEU 42 -15.675 12.882 -15.446 158 HD11 LEU 42 1HD1 LEU 42 -14.425 12.953 -18.241 159 HD12 LEU 42 2HD1 LEU 42 -15.177 14.320 -17.367 160 HD13 LEU 42 3HD1 LEU 42 -16.173 12.970 -17.914 161 HD21 LEU 42 1HD2 LEU 42 -14.451 10.590 -17.014 162 HD22 LEU 42 2HD2 LEU 42 -16.204 10.869 -16.808 163 HD23 LEU 42 3HD2 LEU 42 -15.200 10.538 -15.399 164 H ILE 43 H ILE 43 -12.773 14.186 -12.782 165 HA ILE 43 HA ILE 43 -15.357 15.089 -11.900 166 HB ILE 43 HB ILE 43 -12.660 14.553 -10.654 167 HG12 ILE 43 2HG1 ILE 43 -14.193 13.210 -9.148 168 HG13 ILE 43 3HG1 ILE 43 -15.574 13.779 -10.115 169 HG21 ILE 43 1HG2 ILE 43 -13.501 15.288 -8.461 170 HG22 ILE 43 2HG2 ILE 43 -13.282 16.662 -9.532 171 HG23 ILE 43 3HG2 ILE 43 -14.922 16.023 -9.237 172 HD11 ILE 43 1HD1 ILE 43 -15.040 11.559 -10.762 173 HD12 ILE 43 2HD1 ILE 43 -14.539 12.602 -12.101 174 HD13 ILE 43 3HD1 ILE 43 -13.327 11.931 -10.967 175 H ARG 44 H ARG 44 -12.240 16.843 -12.115 176 HA ARG 44 HA ARG 44 -13.402 19.319 -11.238 177 HB2 ARG 44 2HB ARG 44 -11.330 20.320 -11.577 178 HB3 ARG 44 3HB ARG 44 -11.045 18.670 -11.062 179 HG2 ARG 44 2HG ARG 44 -9.440 18.932 -12.678 180 HG3 ARG 44 3HG ARG 44 -10.732 18.124 -13.548 181 HD2 ARG 44 2HD ARG 44 -11.411 20.319 -14.528 182 HD3 ARG 44 3HD ARG 44 -10.118 21.116 -13.624 183 HE ARG 44 HE ARG 44 -8.887 19.063 -15.088 184 HH11 ARG 44 1HH1 ARG 44 -10.690 21.996 -15.972 185 HH12 ARG 44 2HH1 ARG 44 -9.937 22.047 -17.538 186 HH21 ARG 44 1HH2 ARG 44 -7.986 19.218 -17.004 187 HH22 ARG 44 2HH2 ARG 44 -8.373 20.511 -18.126 188 H GLN 45 H GLN 45 -13.427 17.835 -14.351 189 HA GLN 45 HA GLN 45 -14.057 20.089 -16.044 190 HB2 GLN 45 2HB GLN 45 -15.108 17.230 -15.982 191 HB3 GLN 45 3HB GLN 45 -15.575 18.364 -17.235 192 HG2 GLN 45 2HG GLN 45 -12.642 18.096 -16.777 193 HG3 GLN 45 3HG GLN 45 -13.466 16.676 -17.429 194 HE21 GLN 45 1HE2 GLN 45 -14.475 16.824 -19.564 195 HE22 GLN 45 2HE2 GLN 45 -14.050 18.148 -20.636 196 H ASN 46 H ASN 46 -16.007 18.289 -13.658 197 HA ASN 46 HA ASN 46 -18.459 19.770 -14.323 198 HB2 ASN 46 2HB ASN 46 -17.792 18.158 -11.843 199 HB3 ASN 46 3HB ASN 46 -19.403 18.656 -12.371 200 HD21 ASN 46 1HD2 ASN 46 -17.026 16.228 -12.555 201 HD22 ASN 46 2HD2 ASN 46 -17.877 15.241 -13.744 202 H LEU 47 H LEU 47 -15.879 20.029 -11.900 203 HA LEU 47 HA LEU 47 -17.374 21.959 -10.280 204 HB2 LEU 47 2HB LEU 47 -14.705 20.583 -9.872 205 HB3 LEU 47 3HB LEU 47 -15.642 21.482 -8.696 206 HG LEU 47 HG LEU 47 -16.474 18.896 -9.902 207 HD11 LEU 47 1HD1 LEU 47 -14.551 18.786 -8.460 208 HD12 LEU 47 2HD1 LEU 47 -15.950 18.082 -7.625 209 HD13 LEU 47 3HD1 LEU 47 -15.391 19.732 -7.214 210 HD21 LEU 47 1HD2 LEU 47 -18.517 20.059 -9.352 211 HD22 LEU 47 2HD2 LEU 47 -17.832 20.682 -7.840 212 HD23 LEU 47 3HD2 LEU 47 -18.199 18.958 -8.009 213 H LEU 48 H LEU 48 -17.294 23.862 -11.056 214 HA LEU 48 HA LEU 48 -14.883 24.988 -12.266 215 HB2 LEU 48 2HB LEU 48 -16.423 26.810 -13.014 216 HB3 LEU 48 3HB LEU 48 -16.812 25.197 -13.550 217 HG LEU 48 HG LEU 48 -18.631 25.010 -11.950 218 HD11 LEU 48 1HD1 LEU 48 -17.891 26.403 -10.077 219 HD12 LEU 48 2HD1 LEU 48 -19.444 26.995 -10.673 220 HD13 LEU 48 3HD1 LEU 48 -17.958 27.865 -11.099 221 HD21 LEU 48 1HD2 LEU 48 -20.141 26.652 -13.003 222 HD22 LEU 48 2HD2 LEU 48 -19.024 25.954 -14.189 223 HD23 LEU 48 3HD2 LEU 48 -18.739 27.595 -13.563 224 H VAL 49 H VAL 49 -14.910 24.673 -9.406 225 HA VAL 49 HA VAL 49 -15.405 27.349 -8.316 226 HB VAL 49 HB VAL 49 -14.480 25.023 -6.632 227 HG11 VAL 49 1HG1 VAL 49 -15.763 26.258 -4.892 228 HG12 VAL 49 2HG1 VAL 49 -14.413 27.213 -5.529 229 HG13 VAL 49 3HG1 VAL 49 -16.070 27.555 -6.053 230 HG21 VAL 49 1HG2 VAL 49 -17.333 25.743 -7.459 231 HG22 VAL 49 2HG2 VAL 49 -16.480 24.226 -7.847 232 HG23 VAL 49 3HG2 VAL 49 -16.892 24.583 -6.175 233 H GLU 50 H GLU 50 -12.596 25.179 -7.954 234 HA GLU 50 HA GLU 50 -10.376 25.465 -8.044 235 HB2 GLU 50 2HB GLU 50 -10.797 28.307 -9.037 236 HB3 GLU 50 3HB GLU 50 -9.343 27.330 -9.138 237 HG2 GLU 50 2HG GLU 50 -10.575 25.666 -10.566 238 HG3 GLU 50 3HG GLU 50 -11.973 26.753 -10.563 239 H ASP 51 H ASP 51 -11.643 28.602 -6.797 240 HA ASP 51 HA ASP 51 -9.519 29.142 -5.002 241 HB2 ASP 51 2HB ASP 51 -11.185 30.780 -5.805 242 HB3 ASP 51 3HB ASP 51 -12.460 29.941 -4.920 243 H SER 52 H SER 52 -12.580 27.390 -4.452 244 HA SER 52 HA SER 52 -11.972 26.793 -1.669 245 HB2 SER 52 2HB SER 52 -14.088 25.638 -3.521 246 HB3 SER 52 3HB SER 52 -14.001 25.410 -1.775 247 HG SER 52 HG SER 52 -15.453 27.125 -2.471 248 H PHE 53 H PHE 53 -10.504 25.521 -4.363 249 HA PHE 53 HA PHE 53 -10.228 22.772 -3.240 250 HB2 PHE 53 2HB PHE 53 -9.775 23.792 -6.051 251 HB3 PHE 53 3HB PHE 53 -9.650 22.131 -5.507 252 HD1 PHE 53 HD1 PHE 53 -12.304 22.397 -3.679 253 HD2 PHE 53 HD2 PHE 53 -11.368 23.234 -7.804 254 HE1 PHE 53 HE1 PHE 53 -14.627 21.927 -4.285 255 HE2 PHE 53 HE2 PHE 53 -13.684 22.685 -8.428 256 HZ PHE 53 HZ PHE 53 -15.328 22.000 -6.675 257 H ARG 54 H ARG 54 -8.470 25.701 -4.089 258 HA ARG 54 HA ARG 54 -5.857 24.332 -3.852 259 HB2 ARG 54 2HB ARG 54 -4.927 26.147 -5.023 260 HB3 ARG 54 3HB ARG 54 -6.432 25.688 -5.810 261 HG2 ARG 54 2HG ARG 54 -6.396 28.003 -5.923 262 HG3 ARG 54 3HG ARG 54 -7.557 27.630 -4.670 263 HD2 ARG 54 2HD ARG 54 -4.856 28.046 -3.560 264 HD3 ARG 54 3HD ARG 54 -5.341 29.401 -4.562 265 HE ARG 54 HE ARG 54 -6.631 28.492 -2.052 266 HH11 ARG 54 1HH1 ARG 54 -6.961 30.665 -4.867 267 HH12 ARG 54 2HH1 ARG 54 -8.277 31.524 -4.086 268 HH21 ARG 54 1HH2 ARG 54 -8.199 29.826 -1.129 269 HH22 ARG 54 2HH2 ARG 54 -8.894 31.116 -2.080 270 H GLY 55 H GLY 55 -4.130 25.195 -2.630 271 HA2 GLY 55 HA2 GLY 55 -3.061 26.322 -0.899 272 HA3 GLY 55 HA3 GLY 55 -4.553 27.209 -0.548 273 H LYS 56 H LYS 56 -6.020 24.565 -0.293 274 HA LYS 56 HA LYS 56 -5.089 23.712 2.412 275 HB2 LYS 56 2HB LYS 56 -7.456 22.943 2.732 276 HB3 LYS 56 3HB LYS 56 -7.258 24.667 2.507 277 HG2 LYS 56 2HG LYS 56 -9.206 23.976 1.358 278 HG3 LYS 56 3HG LYS 56 -8.037 24.485 0.167 279 HD2 LYS 56 2HD LYS 56 -7.584 22.234 -0.526 280 HD3 LYS 56 3HD LYS 56 -8.437 21.537 0.879 281 HE2 LYS 56 2HE LYS 56 -9.670 23.194 -1.339 282 HE3 LYS 56 3HE LYS 56 -9.675 21.424 -1.311 283 HZ1 LYS 56 HZ1 LYS 56 -11.147 21.492 0.587 284 HZ2 LYS 56 HZ2 LYS 56 -11.730 22.576 -0.521 285 HZ3 LYS 56 HZ3 LYS 56 -10.957 23.104 0.798 286 H GLN 57 H GLN 57 -6.199 21.265 2.686 287 HA GLN 57 HA GLN 57 -5.196 19.634 0.395 288 HB2 GLN 57 2HB GLN 57 -3.957 18.247 1.744 289 HB3 GLN 57 3HB GLN 57 -3.576 19.811 2.384 290 HG2 GLN 57 2HG GLN 57 -4.226 19.210 4.437 291 HG3 GLN 57 3HG GLN 57 -5.827 18.748 3.891 292 HE21 GLN 57 1HE2 GLN 57 -5.324 16.490 2.253 293 HE22 GLN 57 2HE2 GLN 57 -4.597 15.262 3.274 294 H CYS 58 H CYS 58 -6.119 17.517 0.201 295 HA CYS 58 HA CYS 58 -8.248 16.652 1.974 296 HB2 CYS 58 2HB CYS 58 -9.448 18.289 0.527 297 HB3 CYS 58 3HB CYS 58 -8.866 17.438 -0.909 298 HG CYS 58 HG CYS 58 -10.606 15.955 1.499 299 H ARG 59 H ARG 59 -8.648 14.487 1.776 300 HA ARG 59 HA ARG 59 -7.555 12.966 -0.495 301 HB2 ARG 59 2HB ARG 59 -6.975 11.082 1.001 302 HB3 ARG 59 3HB ARG 59 -5.894 12.457 1.073 303 HG2 ARG 59 2HG ARG 59 -8.064 12.406 3.142 304 HG3 ARG 59 3HG ARG 59 -6.869 11.122 3.257 305 HD2 ARG 59 2HD ARG 59 -6.302 14.094 3.165 306 HD3 ARG 59 3HD ARG 59 -6.419 13.147 4.639 307 HE ARG 59 HE ARG 59 -4.289 12.845 2.547 308 HH11 ARG 59 1HH1 ARG 59 -5.329 12.146 5.875 309 HH12 ARG 59 2HH1 ARG 59 -3.771 11.516 6.307 310 HH21 ARG 59 1HH2 ARG 59 -2.295 12.088 3.222 311 HH22 ARG 59 2HH2 ARG 59 -2.087 11.505 4.840 312 H VAL 60 H VAL 60 -9.072 11.731 -1.389 313 HA VAL 60 HA VAL 60 -11.097 10.398 0.311 314 HB VAL 60 HB VAL 60 -12.976 10.904 -1.116 315 HG11 VAL 60 1HG1 VAL 60 -13.363 13.239 -0.587 316 HG12 VAL 60 2HG1 VAL 60 -12.471 12.496 0.764 317 HG13 VAL 60 3HG1 VAL 60 -11.633 13.538 -0.380 318 HG21 VAL 60 1HG2 VAL 60 -12.939 12.477 -2.949 319 HG22 VAL 60 2HG2 VAL 60 -11.203 12.760 -2.741 320 HG23 VAL 60 3HG2 VAL 60 -11.802 11.169 -3.284 321 H ASN 61 H ASN 61 -12.206 8.624 -1.120 322 HA ASN 61 HA ASN 61 -10.248 7.617 -3.097 323 HB2 ASN 61 2HB ASN 61 -9.678 6.728 -0.926 324 HB3 ASN 61 3HB ASN 61 -11.346 6.242 -0.615 325 HD21 ASN 61 1HD2 ASN 61 -12.276 4.547 -2.077 326 HD22 ASN 61 2HD2 ASN 61 -11.170 3.369 -2.770 327 H LEU 62 H LEU 62 -11.002 6.659 -4.837 328 HA LEU 62 HA LEU 62 -13.979 6.297 -5.113 329 HB2 LEU 62 2HB LEU 62 -11.702 6.978 -6.963 330 HB3 LEU 62 3HB LEU 62 -13.140 6.189 -7.614 331 HG LEU 62 HG LEU 62 -14.552 8.013 -6.924 332 HD11 LEU 62 1HD1 LEU 62 -12.020 9.305 -5.791 333 HD12 LEU 62 2HD1 LEU 62 -13.500 8.885 -4.904 334 HD13 LEU 62 3HD1 LEU 62 -13.529 10.184 -6.092 335 HD21 LEU 62 1HD2 LEU 62 -13.388 8.079 -9.120 336 HD22 LEU 62 2HD2 LEU 62 -12.037 8.953 -8.379 337 HD23 LEU 62 3HD2 LEU 62 -13.631 9.718 -8.488 338 H LYS 63 H LYS 63 -14.756 4.319 -5.190 339 HA LYS 63 HA LYS 63 -13.062 2.058 -6.184 340 HB2 LYS 63 2HB LYS 63 -15.415 2.085 -4.264 341 HB3 LYS 63 3HB LYS 63 -14.816 0.624 -5.048 342 HG2 LYS 63 2HG LYS 63 -13.253 0.364 -3.469 343 HG3 LYS 63 3HG LYS 63 -12.504 1.876 -3.936 344 HD2 LYS 63 2HD LYS 63 -12.912 1.963 -1.607 345 HD3 LYS 63 3HD LYS 63 -14.053 3.094 -2.372 346 HE2 LYS 63 2HE LYS 63 -15.867 1.455 -2.131 347 HE3 LYS 63 3HE LYS 63 -14.739 0.229 -1.563 348 HZ1 LYS 63 HZ1 LYS 63 -15.265 2.765 -0.106 349 HZ2 LYS 63 HZ2 LYS 63 -14.317 1.536 0.407 350 HZ3 LYS 63 HZ3 LYS 63 -15.924 1.306 0.272 351 H LEU 64 H LEU 64 -13.405 1.962 -8.376 352 HA LEU 64 HA LEU 64 -16.147 2.407 -9.388 353 HB2 LEU 64 2HB LEU 64 -13.573 2.039 -10.952 354 HB3 LEU 64 3HB LEU 64 -15.133 2.566 -11.556 355 HG LEU 64 HG LEU 64 -13.996 4.483 -11.608 356 HD11 LEU 64 1HD1 LEU 64 -14.715 6.031 -9.887 357 HD12 LEU 64 2HD1 LEU 64 -15.165 4.687 -8.808 358 HD13 LEU 64 3HD1 LEU 64 -15.997 4.918 -10.365 359 HD21 LEU 64 1HD2 LEU 64 -12.636 3.914 -8.972 360 HD22 LEU 64 2HD2 LEU 64 -12.393 5.317 -10.025 361 HD23 LEU 64 3HD2 LEU 64 -11.957 3.714 -10.612 362 H ILE 65 H ILE 65 -16.954 1.037 -11.016 363 HA ILE 65 HA ILE 65 -16.133 -1.848 -10.896 364 HB ILE 65 HB ILE 65 -18.365 -2.162 -12.122 365 HG12 ILE 65 2HG1 ILE 65 -19.167 0.417 -10.701 366 HG13 ILE 65 3HG1 ILE 65 -18.717 0.410 -12.409 367 HG21 ILE 65 1HG2 ILE 65 -19.534 -2.384 -9.953 368 HG22 ILE 65 2HG2 ILE 65 -17.858 -2.938 -9.847 369 HG23 ILE 65 3HG2 ILE 65 -18.319 -1.352 -9.179 370 HD11 ILE 65 1HD1 ILE 65 -21.021 -1.130 -11.189 371 HD12 ILE 65 2HD1 ILE 65 -21.092 0.312 -12.224 372 HD13 ILE 65 3HD1 ILE 65 -20.496 -1.216 -12.901 373 HA PRO 66 HA PRO 66 -14.402 -0.977 -14.999 374 HB2 PRO 66 2HB PRO 66 -14.180 -3.987 -14.943 375 HB3 PRO 66 3HB PRO 66 -12.995 -2.777 -15.512 376 HG2 PRO 66 2HG PRO 66 -12.695 -3.930 -13.077 377 HG3 PRO 66 3HG PRO 66 -12.423 -2.171 -13.266 378 HD2 PRO 66 2HD PRO 66 -14.893 -3.592 -12.226 379 HD3 PRO 66 3HD PRO 66 -14.057 -2.150 -11.567 380 H THR 67 H THR 67 -15.715 -0.583 -16.656 381 HA THR 67 HA THR 67 -18.133 -2.285 -17.146 382 HB THR 67 HB THR 67 -17.594 0.671 -17.590 383 HG1 THR 67 HG1 THR 67 -17.997 -0.136 -15.445 384 HG21 THR 67 1HG2 THR 67 -20.086 -0.975 -18.197 385 HG22 THR 67 2HG2 THR 67 -19.106 -0.029 -19.349 386 HG23 THR 67 3HG2 THR 67 -20.032 0.810 -18.098 387 H GLY 68 H GLY 68 -15.322 -0.811 -18.658 388 HA2 GLY 68 HA2 GLY 68 -14.237 -2.240 -20.378 389 HA3 GLY 68 HA3 GLY 68 -15.816 -2.415 -21.172 390 H THR 69 H THR 69 -16.792 0.057 -21.371 391 HA THR 69 HA THR 69 -15.011 1.634 -23.093 392 HB THR 69 HB THR 69 -17.479 1.473 -23.395 393 HG1 THR 69 HG1 THR 69 -17.609 3.670 -23.952 394 HG21 THR 69 1HG2 THR 69 -18.986 2.877 -22.099 395 HG22 THR 69 2HG2 THR 69 -17.669 3.455 -21.076 396 HG23 THR 69 3HG2 THR 69 -18.193 1.755 -20.982 397 H GLY 70 H GLY 70 -15.929 1.686 -19.711 398 HA2 GLY 70 HA2 GLY 70 -13.577 3.290 -19.035 399 HA3 GLY 70 HA3 GLY 70 -15.114 4.009 -18.591 400 H ALA 71 H ALA 71 -13.918 3.692 -16.417 401 HA ALA 71 HA ALA 71 -15.239 1.325 -15.166 402 HB1 ALA 71 1HB ALA 71 -14.006 1.735 -13.210 403 HB2 ALA 71 2HB ALA 71 -12.829 1.928 -14.509 404 HB3 ALA 71 3HB ALA 71 -13.517 3.365 -13.727 405 H LEU 72 H LEU 72 -16.790 1.861 -13.438 406 HA LEU 72 HA LEU 72 -18.140 4.536 -13.686 407 HB2 LEU 72 2HB LEU 72 -19.136 1.831 -14.252 408 HB3 LEU 72 3HB LEU 72 -20.048 2.545 -12.945 409 HG LEU 72 HG LEU 72 -20.698 4.434 -14.306 410 HD11 LEU 72 1HD1 LEU 72 -20.123 4.387 -16.786 411 HD12 LEU 72 2HD1 LEU 72 -18.846 3.203 -16.391 412 HD13 LEU 72 3HD1 LEU 72 -18.810 4.843 -15.688 413 HD21 LEU 72 1HD2 LEU 72 -22.036 2.350 -14.416 414 HD22 LEU 72 2HD2 LEU 72 -21.048 1.790 -15.783 415 HD23 LEU 72 3HD2 LEU 72 -22.079 3.230 -15.953 416 H LEU 73 H LEU 73 -18.944 5.456 -11.812 417 HA LEU 73 HA LEU 73 -17.756 4.723 -9.360 418 HB2 LEU 73 2HB LEU 73 -18.645 6.958 -10.041 419 HB3 LEU 73 3HB LEU 73 -20.266 6.399 -9.708 420 HG LEU 73 HG LEU 73 -19.125 7.836 -7.940 421 HD11 LEU 73 1HD1 LEU 73 -20.030 6.706 -6.018 422 HD12 LEU 73 2HD1 LEU 73 -20.109 5.166 -6.889 423 HD13 LEU 73 3HD1 LEU 73 -21.128 6.531 -7.401 424 HD21 LEU 73 1HD2 LEU 73 -17.606 5.312 -7.174 425 HD22 LEU 73 2HD2 LEU 73 -17.489 6.935 -6.460 426 HD23 LEU 73 3HD2 LEU 73 -16.881 6.641 -8.094 427 H GLY 74 H GLY 74 -17.906 2.983 -8.272 428 HA2 GLY 74 HA2 GLY 74 -20.493 1.573 -7.831 429 HA3 GLY 74 HA3 GLY 74 -18.857 1.024 -7.377 430 H SER 75 H SER 75 -17.798 3.180 -6.002 431 HA SER 75 HA SER 75 -19.668 4.130 -3.937 432 HB2 SER 75 2HB SER 75 -17.517 2.071 -3.335 433 HB3 SER 75 3HB SER 75 -18.164 3.179 -2.117 434 HG SER 75 HG SER 75 -19.246 1.137 -2.118 435 H LEU 76 H LEU 76 -18.814 5.876 -2.754 436 HA LEU 76 HA LEU 76 -15.979 6.627 -3.281 437 HB2 LEU 76 2HB LEU 76 -17.621 8.047 -4.538 438 HB3 LEU 76 3HB LEU 76 -18.307 8.587 -3.009 439 HG LEU 76 HG LEU 76 -15.319 8.861 -3.329 440 HD11 LEU 76 1HD1 LEU 76 -16.018 9.521 -5.524 441 HD12 LEU 76 2HD1 LEU 76 -15.621 10.987 -4.617 442 HD13 LEU 76 3HD1 LEU 76 -17.320 10.522 -4.893 443 HD21 LEU 76 1HD2 LEU 76 -16.466 9.677 -1.260 444 HD22 LEU 76 2HD2 LEU 76 -17.445 10.771 -2.263 445 HD23 LEU 76 3HD2 LEU 76 -15.682 10.986 -2.153 446 H THR 77 H THR 77 -14.816 6.944 -1.573 447 HA THR 77 HA THR 77 -16.018 6.913 1.187 448 HB THR 77 HB THR 77 -13.394 5.817 0.069 449 HG1 THR 77 HG1 THR 77 -15.678 4.611 1.270 450 HG21 THR 77 1HG2 THR 77 -12.974 6.639 2.326 451 HG22 THR 77 2HG2 THR 77 -13.089 4.881 2.359 452 HG23 THR 77 3HG2 THR 77 -14.457 5.868 2.930 453 H VAL 78 H VAL 78 -15.812 8.899 2.134 454 HA VAL 78 HA VAL 78 -13.639 10.732 1.292 455 HB VAL 78 HB VAL 78 -14.524 12.361 2.875 456 HG11 VAL 78 1HG1 VAL 78 -15.230 12.320 0.484 457 HG12 VAL 78 2HG1 VAL 78 -16.622 11.308 0.910 458 HG13 VAL 78 3HG1 VAL 78 -16.481 12.961 1.532 459 HG21 VAL 78 1HG2 VAL 78 -16.789 10.376 3.332 460 HG22 VAL 78 2HG2 VAL 78 -15.637 10.951 4.544 461 HG23 VAL 78 3HG2 VAL 78 -16.790 12.082 3.835 462 H LEU 79 H LEU 79 -11.726 11.006 2.411 463 HA LEU 79 HA LEU 79 -11.368 9.333 4.863 464 HB2 LEU 79 2HB LEU 79 -9.285 10.408 2.935 465 HB3 LEU 79 3HB LEU 79 -8.981 9.385 4.322 466 HG LEU 79 HG LEU 79 -10.639 8.559 1.884 467 HD11 LEU 79 1HD1 LEU 79 -8.327 8.929 1.225 468 HD12 LEU 79 2HD1 LEU 79 -8.663 7.193 1.270 469 HD13 LEU 79 3HD1 LEU 79 -7.737 7.942 2.586 470 HD21 LEU 79 1HD2 LEU 79 -11.233 7.294 3.931 471 HD22 LEU 79 2HD2 LEU 79 -9.519 6.908 4.200 472 HD23 LEU 79 3HD2 LEU 79 -10.370 6.269 2.779 473 H ASP 80 H ASP 80 -10.419 12.518 3.488 474 HA ASP 80 HA ASP 80 -11.280 13.987 5.741 475 HB2 ASP 80 2HB ASP 80 -9.032 12.885 6.624 476 HB3 ASP 80 3HB ASP 80 -8.257 14.024 5.533 477 H GLY 81 H GLY 81 -10.557 16.302 5.611 478 HA2 GLY 81 HA2 GLY 81 -8.903 17.605 3.977 479 HA3 GLY 81 HA3 GLY 81 -10.234 17.343 2.857 480 H ASP 82 H ASP 82 -9.871 19.752 2.941 481 HA ASP 82 HA ASP 82 -11.513 21.119 4.991 482 HB2 ASP 82 2HB ASP 82 -9.635 22.359 4.183 483 HB3 ASP 82 3HB ASP 82 -10.038 22.028 2.519 484 H SER 83 H SER 83 -13.610 20.929 4.852 485 HA SER 83 HA SER 83 -14.714 18.970 3.452 486 HB2 SER 83 2HB SER 83 -16.314 21.311 4.518 487 HB3 SER 83 3HB SER 83 -16.862 19.636 4.360 488 HG SER 83 HG SER 83 -16.191 20.132 6.519 489 H ARG 84 H ARG 84 -14.653 22.214 2.221 490 HA ARG 84 HA ARG 84 -16.736 22.211 0.340 491 HB2 ARG 84 2HB ARG 84 -13.986 23.493 0.181 492 HB3 ARG 84 3HB ARG 84 -15.369 23.913 -0.841 493 HG2 ARG 84 2HG ARG 84 -16.656 24.649 1.110 494 HG3 ARG 84 3HG ARG 84 -15.354 24.177 2.205 495 HD2 ARG 84 2HD ARG 84 -15.136 26.309 0.047 496 HD3 ARG 84 3HD ARG 84 -15.418 26.612 1.764 497 HE ARG 84 HE ARG 84 -13.116 25.078 1.783 498 HH11 ARG 84 1HH1 ARG 84 -13.877 28.145 0.147 499 HH12 ARG 84 2HH1 ARG 84 -12.256 28.727 0.351 500 HH21 ARG 84 1HH2 ARG 84 -11.144 25.797 1.904 501 HH22 ARG 84 2HH2 ARG 84 -10.670 27.391 1.333 502 H LEU 85 H LEU 85 -13.538 20.547 0.074 503 HA LEU 85 HA LEU 85 -14.050 20.043 -2.811 504 HB2 LEU 85 2HB LEU 85 -11.822 20.623 -2.158 505 HB3 LEU 85 3HB LEU 85 -11.735 19.293 -0.997 506 HG LEU 85 HG LEU 85 -11.719 17.647 -2.724 507 HD11 LEU 85 1HD1 LEU 85 -11.683 18.136 -5.144 508 HD12 LEU 85 2HD1 LEU 85 -12.011 19.844 -4.829 509 HD13 LEU 85 3HD1 LEU 85 -13.241 18.616 -4.465 510 HD21 LEU 85 1HD2 LEU 85 -9.615 18.965 -2.184 511 HD22 LEU 85 2HD2 LEU 85 -9.893 19.922 -3.633 512 HD23 LEU 85 3HD2 LEU 85 -9.598 18.176 -3.772 513 H CYS 86 H CYS 86 -13.748 17.890 0.161 514 HA CYS 86 HA CYS 86 -14.535 15.577 -1.260 515 HB2 CYS 86 2HB CYS 86 -15.004 14.597 0.890 516 HB3 CYS 86 3HB CYS 86 -13.448 15.447 0.890 517 HG CYS 86 HG CYS 86 -14.576 15.747 3.239 518 H ALA 87 H ALA 87 -16.606 18.088 0.187 519 HA ALA 87 HA ALA 87 -19.112 16.806 -0.346 520 HB1 ALA 87 1HB ALA 87 -18.367 19.776 -0.281 521 HB2 ALA 87 2HB ALA 87 -20.013 19.117 -0.186 522 HB3 ALA 87 3HB ALA 87 -18.842 18.787 1.120 523 H ALA 88 H ALA 88 -17.131 18.994 -2.430 524 HA ALA 88 HA ALA 88 -19.054 19.091 -4.553 525 HB1 ALA 88 1HB ALA 88 -17.218 20.266 -5.723 526 HB2 ALA 88 2HB ALA 88 -17.425 20.864 -4.077 527 HB3 ALA 88 3HB ALA 88 -16.075 19.774 -4.467 528 H THR 89 H THR 89 -15.936 17.293 -4.279 529 HA THR 89 HA THR 89 -16.038 16.017 -6.828 530 HB THR 89 HB THR 89 -14.043 16.148 -5.360 531 HG1 THR 89 HG1 THR 89 -14.810 13.531 -6.188 532 HG21 THR 89 1HG2 THR 89 -13.644 14.694 -3.566 533 HG22 THR 89 2HG2 THR 89 -15.034 13.648 -3.947 534 HG23 THR 89 3HG2 THR 89 -15.304 15.250 -3.265 535 H LYS 90 H LYS 90 -17.309 14.900 -3.700 536 HA LYS 90 HA LYS 90 -18.205 12.342 -4.306 537 HB2 LYS 90 2HB LYS 90 -18.089 13.332 -2.112 538 HB3 LYS 90 3HB LYS 90 -19.268 14.571 -2.553 539 HG2 LYS 90 2HG LYS 90 -20.838 12.388 -2.896 540 HG3 LYS 90 3HG LYS 90 -19.650 11.705 -1.758 541 HD2 LYS 90 2HD LYS 90 -21.186 14.312 -1.382 542 HD3 LYS 90 3HD LYS 90 -21.676 12.749 -0.687 543 HE2 LYS 90 2HE LYS 90 -19.449 12.622 0.491 544 HE3 LYS 90 3HE LYS 90 -19.079 14.242 -0.103 545 HZ1 LYS 90 HZ1 LYS 90 -21.020 15.059 1.125 546 HZ2 LYS 90 HZ2 LYS 90 -19.984 14.324 2.142 547 HZ3 LYS 90 HZ3 LYS 90 -21.348 13.555 1.681 548 H ARG 91 H ARG 91 -19.944 15.405 -4.799 549 HA ARG 91 HA ARG 91 -22.246 14.160 -6.033 550 HB2 ARG 91 2HB ARG 91 -21.266 17.046 -6.178 551 HB3 ARG 91 3HB ARG 91 -22.843 16.483 -6.730 552 HG2 ARG 91 2HG ARG 91 -21.833 16.433 -3.858 553 HG3 ARG 91 3HG ARG 91 -22.998 17.573 -4.541 554 HD2 ARG 91 2HD ARG 91 -24.538 15.655 -4.989 555 HD3 ARG 91 3HD ARG 91 -23.368 14.566 -4.217 556 HE ARG 91 HE ARG 91 -23.977 16.747 -2.467 557 HH11 ARG 91 1HH1 ARG 91 -25.489 13.772 -3.636 558 HH12 ARG 91 2HH1 ARG 91 -26.460 13.590 -2.207 559 HH21 ARG 91 1HH2 ARG 91 -25.253 16.467 -0.656 560 HH22 ARG 91 2HH2 ARG 91 -26.317 15.102 -0.526 561 H ALA 92 H ALA 92 -19.346 15.703 -7.436 562 HA ALA 92 HA ALA 92 -20.083 15.510 -10.177 563 HB1 ALA 92 1HB ALA 92 -17.326 15.509 -8.865 564 HB2 ALA 92 2HB ALA 92 -17.665 15.807 -10.580 565 HB3 ALA 92 3HB ALA 92 -18.277 16.924 -9.366 566 H VAL 93 H VAL 93 -18.144 13.230 -8.184 567 HA VAL 93 HA VAL 93 -17.850 11.296 -10.233 568 HB VAL 93 HB VAL 93 -17.931 10.383 -7.351 569 HG11 VAL 93 1HG1 VAL 93 -16.172 8.917 -8.062 570 HG12 VAL 93 2HG1 VAL 93 -17.436 8.811 -9.284 571 HG13 VAL 93 3HG1 VAL 93 -15.983 9.767 -9.605 572 HG21 VAL 93 1HG2 VAL 93 -16.534 12.040 -6.779 573 HG22 VAL 93 2HG2 VAL 93 -15.298 11.138 -7.666 574 HG23 VAL 93 3HG2 VAL 93 -16.152 12.469 -8.454 575 H ALA 94 H ALA 94 -20.562 11.950 -8.201 576 HA ALA 94 HA ALA 94 -21.911 9.381 -8.656 577 HB1 ALA 94 1HB ALA 94 -22.175 10.603 -6.516 578 HB2 ALA 94 2HB ALA 94 -22.928 11.961 -7.381 579 HB3 ALA 94 3HB ALA 94 -23.722 10.381 -7.356 580 H GLN 95 H GLN 95 -21.366 12.113 -10.582 581 HA GLN 95 HA GLN 95 -23.786 11.525 -12.242 582 HB2 GLN 95 2HB GLN 95 -24.155 13.879 -12.602 583 HB3 GLN 95 3HB GLN 95 -24.155 13.508 -10.882 584 HG2 GLN 95 2HG GLN 95 -22.853 15.484 -10.944 585 HG3 GLN 95 3HG GLN 95 -21.705 14.250 -10.870 586 HE21 GLN 95 1HE2 GLN 95 -20.094 14.325 -12.513 587 HE22 GLN 95 2HE2 GLN 95 -20.234 15.402 -13.900 588 H VAL 96 H VAL 96 -20.344 11.878 -12.272 589 HA VAL 96 HA VAL 96 -19.903 12.475 -15.022 590 HB VAL 96 HB VAL 96 -17.818 11.118 -14.785 591 HG11 VAL 96 1HG1 VAL 96 -18.081 13.029 -12.455 592 HG12 VAL 96 2HG1 VAL 96 -16.641 12.613 -13.368 593 HG13 VAL 96 3HG1 VAL 96 -17.937 13.537 -14.155 594 HG21 VAL 96 1HG2 VAL 96 -17.214 10.461 -12.407 595 HG22 VAL 96 2HG2 VAL 96 -18.936 10.509 -12.051 596 HG23 VAL 96 3HG2 VAL 96 -18.323 9.376 -13.273 597 H ASN 97 H ASN 97 -19.647 11.239 -16.870 598 HA ASN 97 HA ASN 97 -21.550 9.131 -17.151 599 HB2 ASN 97 2HB ASN 97 -20.927 10.848 -18.860 600 HB3 ASN 97 3HB ASN 97 -19.424 9.984 -19.147 601 HD21 ASN 97 1HD2 ASN 97 -19.624 7.704 -20.084 602 HD22 ASN 97 2HD2 ASN 97 -21.095 7.323 -20.963 603 H SER 98 H SER 98 -17.955 9.037 -17.213 604 HA SER 98 HA SER 98 -17.507 6.373 -16.412 605 HB2 SER 98 2HB SER 98 -16.873 5.404 -18.689 606 HB3 SER 98 3HB SER 98 -18.607 5.506 -18.376 607 HG SER 98 HG SER 98 -17.056 7.382 -19.889 608 H PHE 99 H PHE 99 -15.328 6.019 -16.139 609 HA PHE 99 HA PHE 99 -13.540 8.255 -16.838 610 HB2 PHE 99 2HB PHE 99 -12.902 5.827 -15.150 611 HB3 PHE 99 3HB PHE 99 -12.077 7.385 -15.181 612 HD1 PHE 99 HD1 PHE 99 -14.790 5.426 -13.749 613 HD2 PHE 99 HD2 PHE 99 -13.340 9.451 -14.336 614 HE1 PHE 99 HE1 PHE 99 -16.396 6.253 -12.073 615 HE2 PHE 99 HE2 PHE 99 -14.905 10.264 -12.596 616 HZ PHE 99 HZ PHE 99 -16.444 8.635 -11.463 617 HA PRO 100 HA PRO 100 -12.186 5.467 -20.154 618 HB2 PRO 100 2HB PRO 100 -10.752 7.171 -21.696 619 HB3 PRO 100 3HB PRO 100 -12.543 7.169 -21.651 620 HG2 PRO 100 2HG PRO 100 -10.649 9.018 -20.163 621 HG3 PRO 100 3HG PRO 100 -12.132 9.445 -21.073 622 HD2 PRO 100 2HD PRO 100 -12.081 9.114 -18.342 623 HD3 PRO 100 3HD PRO 100 -13.513 8.720 -19.330 624 H LEU 101 H LEU 101 -10.688 4.068 -19.620 625 HA LEU 101 HA LEU 101 -8.264 4.822 -18.194 626 HB2 LEU 101 2HB LEU 101 -7.983 2.400 -17.868 627 HB3 LEU 101 3HB LEU 101 -9.428 3.100 -17.132 628 HG LEU 101 HG LEU 101 -9.429 1.505 -19.730 629 HD11 LEU 101 1HD1 LEU 101 -8.583 0.147 -17.860 630 HD12 LEU 101 2HD1 LEU 101 -10.165 -0.403 -18.396 631 HD13 LEU 101 3HD1 LEU 101 -10.039 0.552 -16.904 632 HD21 LEU 101 1HD2 LEU 101 -11.677 2.407 -17.894 633 HD22 LEU 101 2HD2 LEU 101 -11.868 1.064 -19.036 634 HD23 LEU 101 3HD2 LEU 101 -11.509 2.662 -19.650 635 HA PRO 102 HA PRO 102 -5.830 4.881 -21.779 636 HB2 PRO 102 2HB PRO 102 -3.284 4.856 -20.785 637 HB3 PRO 102 3HB PRO 102 -4.423 6.211 -20.531 638 HG2 PRO 102 2HG PRO 102 -3.802 3.934 -18.620 639 HG3 PRO 102 3HG PRO 102 -3.874 5.689 -18.270 640 HD2 PRO 102 2HD PRO 102 -5.980 4.031 -17.786 641 HD3 PRO 102 3HD PRO 102 -6.212 5.714 -18.352 642 H LYS 103 H LYS 103 -4.726 2.309 -19.505 643 HA LYS 103 HA LYS 103 -4.017 0.527 -21.772 644 HB2 LYS 103 2HB LYS 103 -3.254 0.669 -18.865 645 HB3 LYS 103 3HB LYS 103 -3.133 -0.852 -19.749 646 HG2 LYS 103 2HG LYS 103 -0.990 0.341 -19.681 647 HG3 LYS 103 3HG LYS 103 -1.562 0.008 -21.310 648 HD2 LYS 103 2HD LYS 103 -2.232 2.347 -21.616 649 HD3 LYS 103 3HD LYS 103 -1.950 2.677 -19.900 650 HE2 LYS 103 2HE LYS 103 -0.174 3.598 -21.132 651 HE3 LYS 103 3HE LYS 103 0.434 2.233 -20.180 652 HZ1 LYS 103 HZ1 LYS 103 0.429 0.903 -22.216 653 HZ2 LYS 103 HZ2 LYS 103 1.315 2.246 -22.467 654 HZ3 LYS 103 HZ3 LYS 103 -0.187 2.143 -23.094 655 H ASP 104 H ASP 104 -4.620 -1.795 -21.408 656 HA ASP 104 HA ASP 104 -7.431 -2.058 -20.466 657 HB2 ASP 104 2HB ASP 104 -8.007 -2.979 -22.526 658 HB3 ASP 104 3HB ASP 104 -6.992 -1.605 -22.939 659 H GLN 105 H GLN 105 -4.575 -3.297 -19.495 660 HA GLN 105 HA GLN 105 -5.038 -6.107 -20.033 661 HB2 GLN 105 2HB GLN 105 -2.952 -4.810 -18.224 662 HB3 GLN 105 3HB GLN 105 -3.075 -6.521 -18.616 663 HG2 GLN 105 2HG GLN 105 -1.463 -5.903 -20.107 664 HG3 GLN 105 3HG GLN 105 -2.896 -5.724 -21.120 665 HE21 GLN 105 1HE2 GLN 105 -3.384 -3.580 -21.925 666 HE22 GLN 105 2HE2 GLN 105 -2.320 -2.232 -21.537 667 HA PRO 106 HA PRO 106 -7.620 -6.671 -16.424 668 HB2 PRO 106 2HB PRO 106 -7.430 -9.390 -16.017 669 HB3 PRO 106 3HB PRO 106 -8.327 -8.652 -17.378 670 HG2 PRO 106 2HG PRO 106 -5.481 -9.707 -17.376 671 HG3 PRO 106 3HG PRO 106 -6.805 -10.085 -18.533 672 HD2 PRO 106 2HD PRO 106 -4.939 -8.201 -19.086 673 HD3 PRO 106 3HD PRO 106 -6.644 -7.949 -19.549 674 H ASP 107 H ASP 107 -4.268 -6.793 -16.339 675 HA ASP 107 HA ASP 107 -4.102 -7.341 -13.421 676 HB2 ASP 107 2HB ASP 107 -2.285 -8.082 -14.974 677 HB3 ASP 107 3HB ASP 107 -1.952 -6.375 -15.334 678 H VAL 108 H VAL 108 -4.026 -4.599 -15.740 679 HA VAL 108 HA VAL 108 -3.452 -2.691 -13.556 680 HB VAL 108 HB VAL 108 -3.078 -1.039 -15.170 681 HG11 VAL 108 1HG1 VAL 108 -1.144 -1.945 -16.372 682 HG12 VAL 108 2HG1 VAL 108 -1.230 -2.672 -14.761 683 HG13 VAL 108 3HG1 VAL 108 -1.755 -3.598 -16.189 684 HG21 VAL 108 1HG2 VAL 108 -4.788 -1.428 -16.838 685 HG22 VAL 108 2HG2 VAL 108 -3.196 -1.411 -17.610 686 HG23 VAL 108 3HG2 VAL 108 -4.007 -2.949 -17.331 687 H VAL 109 H VAL 109 -6.125 -3.636 -15.672 688 HA VAL 109 HA VAL 109 -7.971 -1.552 -15.094 689 HB VAL 109 HB VAL 109 -8.354 -4.534 -15.514 690 HG11 VAL 109 1HG1 VAL 109 -10.739 -4.020 -16.073 691 HG12 VAL 109 2HG1 VAL 109 -10.372 -3.820 -14.365 692 HG13 VAL 109 3HG1 VAL 109 -10.513 -2.382 -15.411 693 HG21 VAL 109 1HG2 VAL 109 -8.947 -2.213 -17.393 694 HG22 VAL 109 2HG2 VAL 109 -7.442 -3.127 -17.441 695 HG23 VAL 109 3HG2 VAL 109 -8.969 -3.945 -17.772 696 H GLU 110 H GLU 110 -6.680 -4.082 -13.040 697 HA GLU 110 HA GLU 110 -8.649 -3.800 -10.905 698 HB2 GLU 110 2HB GLU 110 -6.071 -5.347 -11.121 699 HB3 GLU 110 3HB GLU 110 -7.167 -5.422 -9.744 700 HG2 GLU 110 2HG GLU 110 -7.894 -6.151 -12.616 701 HG3 GLU 110 3HG GLU 110 -7.489 -7.257 -11.329 702 H LYS 111 H LYS 111 -5.955 -1.933 -11.805 703 HA LYS 111 HA LYS 111 -5.315 -1.144 -9.012 704 HB2 LYS 111 2HB LYS 111 -3.935 -0.686 -11.652 705 HB3 LYS 111 3HB LYS 111 -3.710 0.475 -10.352 706 HG2 LYS 111 2HG LYS 111 -1.931 -1.151 -10.319 707 HG3 LYS 111 3HG LYS 111 -2.885 -1.254 -8.828 708 HD2 LYS 111 2HD LYS 111 -3.968 -3.282 -9.545 709 HD3 LYS 111 3HD LYS 111 -3.407 -3.040 -11.206 710 HE2 LYS 111 2HE LYS 111 -1.014 -3.220 -10.238 711 HE3 LYS 111 3HE LYS 111 -1.781 -3.753 -8.728 712 HZ1 LYS 111 HZ1 LYS 111 -1.164 -5.661 -10.050 713 HZ2 LYS 111 HZ2 LYS 111 -1.930 -5.108 -11.382 714 HZ3 LYS 111 HZ3 LYS 111 -2.799 -5.574 -10.073 715 H LEU 112 H LEU 112 -6.400 0.264 -12.028 716 HA LEU 112 HA LEU 112 -6.738 2.903 -10.941 717 HB2 LEU 112 2HB LEU 112 -7.601 3.464 -13.213 718 HB3 LEU 112 3HB LEU 112 -6.051 2.690 -13.124 719 HG LEU 112 HG LEU 112 -7.155 0.577 -13.617 720 HD11 LEU 112 1HD1 LEU 112 -9.510 2.064 -14.663 721 HD12 LEU 112 2HD1 LEU 112 -9.469 1.070 -13.176 722 HD13 LEU 112 3HD1 LEU 112 -9.191 0.314 -14.723 723 HD21 LEU 112 1HD2 LEU 112 -7.167 0.866 -16.057 724 HD22 LEU 112 2HD2 LEU 112 -5.783 1.611 -15.268 725 HD23 LEU 112 3HD2 LEU 112 -7.144 2.641 -15.801 726 H LYS 113 H LYS 113 -8.849 0.180 -10.986 727 HA LYS 113 HA LYS 113 -11.354 1.511 -10.561 728 HB2 LYS 113 2HB LYS 113 -12.008 -0.627 -9.465 729 HB3 LYS 113 3HB LYS 113 -11.298 -0.849 -11.069 730 HG2 LYS 113 2HG LYS 113 -9.272 -1.670 -10.204 731 HG3 LYS 113 3HG LYS 113 -9.539 -1.047 -8.589 732 HD2 LYS 113 2HD LYS 113 -9.704 -3.532 -8.881 733 HD3 LYS 113 3HD LYS 113 -11.015 -2.739 -7.992 734 HE2 LYS 113 2HE LYS 113 -12.477 -2.814 -9.909 735 HE3 LYS 113 3HE LYS 113 -11.172 -3.438 -10.942 736 HZ1 LYS 113 HZ1 LYS 113 -12.632 -5.237 -10.198 737 HZ2 LYS 113 HZ2 LYS 113 -12.337 -4.902 -8.623 738 HZ3 LYS 113 HZ3 LYS 113 -11.124 -5.450 -9.597 739 H ASN 114 H ASN 114 -8.629 1.159 -8.443 740 HA ASN 114 HA ASN 114 -10.232 2.190 -6.135 741 HB2 ASN 114 2HB ASN 114 -8.009 0.159 -5.901 742 HB3 ASN 114 3HB ASN 114 -9.036 0.831 -4.623 743 HD21 ASN 114 1HD2 ASN 114 -11.579 0.550 -6.195 744 HD22 ASN 114 2HD2 ASN 114 -11.888 -1.179 -6.129 745 H ILE 115 H ILE 115 -9.505 4.299 -6.815 746 HA ILE 115 HA ILE 115 -6.636 4.891 -6.293 747 HB ILE 115 HB ILE 115 -6.927 6.995 -7.439 748 HG12 ILE 115 2HG1 ILE 115 -9.401 7.207 -7.114 749 HG13 ILE 115 3HG1 ILE 115 -8.762 7.688 -8.637 750 HG21 ILE 115 1HG2 ILE 115 -6.940 6.070 -9.751 751 HG22 ILE 115 2HG2 ILE 115 -5.901 5.181 -8.616 752 HG23 ILE 115 3HG2 ILE 115 -7.465 4.506 -9.088 753 HD11 ILE 115 1HD1 ILE 115 -10.287 5.140 -8.117 754 HD12 ILE 115 2HD1 ILE 115 -10.811 6.562 -9.033 755 HD13 ILE 115 3HD1 ILE 115 -9.510 5.553 -9.655 756 H ASN 116 H ASN 116 -6.038 6.594 -4.982 757 HA ASN 116 HA ASN 116 -8.206 7.892 -3.415 758 HB2 ASN 116 2HB ASN 116 -5.331 8.611 -3.008 759 HB3 ASN 116 3HB ASN 116 -6.704 8.683 -1.907 760 HD21 ASN 116 1HD2 ASN 116 -7.591 5.930 -1.931 761 HD22 ASN 116 2HD2 ASN 116 -6.281 5.006 -1.227 762 H LEU 117 H LEU 117 -8.821 9.910 -3.958 763 HA LEU 117 HA LEU 117 -7.141 11.589 -5.793 764 HB2 LEU 117 2HB LEU 117 -9.865 12.166 -4.595 765 HB3 LEU 117 3HB LEU 117 -8.959 13.232 -5.657 766 HG LEU 117 HG LEU 117 -10.123 10.499 -6.383 767 HD11 LEU 117 1HD1 LEU 117 -11.711 11.762 -7.765 768 HD12 LEU 117 2HD1 LEU 117 -10.975 13.288 -7.250 769 HD13 LEU 117 3HD1 LEU 117 -11.828 12.258 -6.073 770 HD21 LEU 117 1HD2 LEU 117 -8.622 12.498 -8.091 771 HD22 LEU 117 2HD2 LEU 117 -9.552 11.128 -8.749 772 HD23 LEU 117 3HD2 LEU 117 -8.137 10.829 -7.734 773 H THR 118 H THR 118 -5.534 12.521 -4.681 774 HA THR 118 HA THR 118 -6.042 13.599 -1.952 775 HB THR 118 HB THR 118 -3.634 11.929 -2.770 776 HG1 THR 118 HG1 THR 118 -4.504 10.533 -1.228 777 HG21 THR 118 1HG2 THR 118 -2.907 13.656 -1.221 778 HG22 THR 118 2HG2 THR 118 -3.137 12.171 -0.277 779 HG23 THR 118 3HG2 THR 118 -4.373 13.453 -0.230 780 H VAL 119 H VAL 119 -5.467 15.620 -1.788 781 HA VAL 119 HA VAL 119 -3.579 16.872 -3.716 782 HB VAL 119 HB VAL 119 -5.077 18.613 -4.168 783 HG11 VAL 119 1HG1 VAL 119 -5.528 16.512 -5.462 784 HG12 VAL 119 2HG1 VAL 119 -6.830 16.132 -4.308 785 HG13 VAL 119 3HG1 VAL 119 -6.934 17.575 -5.334 786 HG21 VAL 119 1HG2 VAL 119 -7.094 17.493 -2.217 787 HG22 VAL 119 2HG2 VAL 119 -6.161 18.993 -2.005 788 HG23 VAL 119 3HG2 VAL 119 -7.334 18.878 -3.301 789 H ALA 120 H ALA 120 -2.596 18.826 -2.990 790 HA ALA 120 HA ALA 120 -2.947 19.958 -0.358 791 HB1 ALA 120 1HB ALA 120 -0.732 19.143 0.542 792 HB2 ALA 120 2HB ALA 120 -1.897 17.828 0.337 793 HB3 ALA 120 3HB ALA 120 -0.588 18.062 -0.846 794 HA PRO 121 HA PRO 121 -0.719 23.148 -2.467 795 HB2 PRO 121 2HB PRO 121 0.199 24.773 -0.491 796 HB3 PRO 121 3HB PRO 121 -1.547 24.476 -0.739 797 HG2 PRO 121 2HG PRO 121 0.298 23.092 1.231 798 HG3 PRO 121 3HG PRO 121 -1.290 23.854 1.557 799 HD2 PRO 121 2HD PRO 121 -1.030 21.189 1.113 800 HD3 PRO 121 3HD PRO 121 -2.457 22.098 0.557 801 H GLU 122 H GLU 122 1.182 21.098 -0.305 802 HA GLU 122 HA GLU 122 3.620 21.428 -1.838 803 HB2 GLU 122 2HB GLU 122 3.535 23.424 -0.232 804 HB3 GLU 122 3HB GLU 122 3.622 22.277 1.095 805 HG2 GLU 122 2HG GLU 122 5.699 22.545 -1.132 806 HG3 GLU 122 3HG GLU 122 5.774 23.396 0.405 Start of MODEL 17 1 H1 ALA 22 H ALA 22 16.751 0.967 -16.686 2 HA ALA 22 HA ALA 22 14.702 -0.612 -17.855 3 HB1 ALA 22 1HB ALA 22 16.459 -1.804 -19.067 4 HB2 ALA 22 2HB ALA 22 17.420 -1.985 -17.578 5 HB3 ALA 22 3HB ALA 22 15.879 -2.834 -17.753 6 H ALA 23 H ALA 23 13.518 -1.467 -16.176 7 HA ALA 23 HA ALA 23 14.521 -1.964 -13.502 8 HB1 ALA 23 1HB ALA 23 13.427 -0.023 -12.411 9 HB2 ALA 23 2HB ALA 23 14.710 0.494 -13.517 10 HB3 ALA 23 3HB ALA 23 13.019 0.647 -14.012 11 H ARG 24 H ARG 24 11.433 -0.430 -13.911 12 HA ARG 24 HA ARG 24 9.321 -1.040 -13.697 13 HB2 ARG 24 2HB ARG 24 10.085 -3.733 -14.884 14 HB3 ARG 24 3HB ARG 24 8.451 -3.104 -14.687 15 HG2 ARG 24 2HG ARG 24 9.107 -1.090 -16.088 16 HG3 ARG 24 3HG ARG 24 10.652 -1.885 -16.406 17 HD2 ARG 24 2HD ARG 24 9.258 -2.348 -18.266 18 HD3 ARG 24 3HD ARG 24 9.367 -3.863 -17.336 19 HE ARG 24 HE ARG 24 7.086 -2.284 -16.531 20 HH11 ARG 24 1HH1 ARG 24 8.094 -4.381 -19.206 21 HH12 ARG 24 2HH1 ARG 24 6.460 -4.813 -19.595 22 HH21 ARG 24 1HH2 ARG 24 5.017 -2.877 -17.096 23 HH22 ARG 24 2HH2 ARG 24 4.748 -3.976 -18.422 24 H GLN 25 H GLN 25 11.168 -1.457 -11.476 25 HA GLN 25 HA GLN 25 9.875 -3.621 -9.880 26 HB2 GLN 25 2HB GLN 25 12.235 -1.900 -9.111 27 HB3 GLN 25 3HB GLN 25 11.708 -3.395 -8.361 28 HG2 GLN 25 2HG GLN 25 12.926 -3.117 -11.142 29 HG3 GLN 25 3HG GLN 25 13.717 -3.757 -9.721 30 HE21 GLN 25 1HE2 GLN 25 12.004 -4.629 -12.540 31 HE22 GLN 25 2HE2 GLN 25 11.528 -6.240 -12.029 32 H GLN 26 H GLN 26 9.872 -0.230 -10.241 33 HA GLN 26 HA GLN 26 8.364 0.300 -7.721 34 HB2 GLN 26 2HB GLN 26 9.789 2.164 -7.290 35 HB3 GLN 26 3HB GLN 26 10.785 0.721 -7.430 36 HG2 GLN 26 2HG GLN 26 10.402 2.824 -9.609 37 HG3 GLN 26 3HG GLN 26 11.784 2.725 -8.516 38 HE21 GLN 26 1HE2 GLN 26 13.188 0.738 -8.670 39 HE22 GLN 26 2HE2 GLN 26 13.296 -0.049 -10.232 40 H PHE 27 H PHE 27 8.822 1.051 -11.091 41 HA PHE 27 HA PHE 27 7.943 3.618 -11.328 42 HB2 PHE 27 2HB PHE 27 7.907 3.215 -13.595 43 HB3 PHE 27 3HB PHE 27 8.962 1.938 -13.032 44 HD1 PHE 27 HD1 PHE 27 6.059 2.769 -14.917 45 HD2 PHE 27 HD2 PHE 27 7.680 -0.366 -12.468 46 HE1 PHE 27 HE1 PHE 27 4.429 1.186 -15.884 47 HE2 PHE 27 HE2 PHE 27 6.029 -1.966 -13.413 48 HZ PHE 27 HZ PHE 27 4.403 -1.191 -15.145 49 H VAL 28 H VAL 28 5.804 1.102 -10.423 50 HA VAL 28 HA VAL 28 3.349 1.918 -11.605 51 HB VAL 28 HB VAL 28 2.252 1.004 -9.521 52 HG11 VAL 28 1HG1 VAL 28 2.683 -0.368 -11.554 53 HG12 VAL 28 2HG1 VAL 28 4.270 -0.822 -10.907 54 HG13 VAL 28 3HG1 VAL 28 2.795 -1.339 -10.071 55 HG21 VAL 28 1HG2 VAL 28 5.077 0.204 -8.691 56 HG22 VAL 28 2HG2 VAL 28 4.032 1.382 -7.847 57 HG23 VAL 28 3HG2 VAL 28 3.558 -0.312 -7.935 58 H THR 29 H THR 29 5.125 3.282 -8.856 59 HA THR 29 HA THR 29 3.185 5.136 -7.929 60 HB THR 29 HB THR 29 5.279 4.443 -6.828 61 HG1 THR 29 HG1 THR 29 5.591 6.505 -5.924 62 HG21 THR 29 1HG2 THR 29 6.822 4.841 -8.859 63 HG22 THR 29 2HG2 THR 29 7.396 5.471 -7.306 64 HG23 THR 29 3HG2 THR 29 6.672 6.571 -8.509 65 H SER 30 H SER 30 5.387 5.344 -10.698 66 HA SER 30 HA SER 30 4.666 8.122 -11.317 67 HB2 SER 30 2HB SER 30 6.891 6.986 -11.867 68 HB3 SER 30 3HB SER 30 6.020 6.024 -13.066 69 HG SER 30 HG SER 30 6.352 8.864 -13.022 70 H GLU 31 H GLU 31 3.601 4.883 -12.319 71 HA GLU 31 HA GLU 31 1.745 5.842 -14.317 72 HB2 GLU 31 2HB GLU 31 1.804 3.259 -12.735 73 HB3 GLU 31 3HB GLU 31 0.652 3.600 -14.030 74 HG2 GLU 31 2HG GLU 31 3.663 3.699 -14.435 75 HG3 GLU 31 3HG GLU 31 2.678 2.257 -14.675 76 H VAL 32 H VAL 32 1.489 5.630 -10.762 77 HA VAL 32 HA VAL 32 -1.384 5.970 -10.652 78 HB VAL 32 HB VAL 32 0.818 6.683 -8.693 79 HG11 VAL 32 1HG1 VAL 32 -0.955 7.031 -6.975 80 HG12 VAL 32 2HG1 VAL 32 -0.934 8.305 -8.188 81 HG13 VAL 32 3HG1 VAL 32 -2.178 7.023 -8.263 82 HG21 VAL 32 1HG2 VAL 32 0.258 4.280 -9.080 83 HG22 VAL 32 2HG2 VAL 32 -0.094 4.797 -7.434 84 HG23 VAL 32 3HG2 VAL 32 -1.419 4.610 -8.607 85 H GLY 33 H GLY 33 1.225 8.143 -11.348 86 HA2 GLY 33 HA2 GLY 33 -0.170 10.676 -11.188 87 HA3 GLY 33 HA3 GLY 33 1.318 10.336 -12.088 88 H ARG 34 H ARG 34 -0.321 8.095 -13.580 89 HA ARG 34 HA ARG 34 -1.900 9.871 -15.401 90 HB2 ARG 34 2HB ARG 34 -1.039 7.013 -15.906 91 HB3 ARG 34 3HB ARG 34 -1.700 8.182 -17.052 92 HG2 ARG 34 2HG ARG 34 0.423 9.594 -16.559 93 HG3 ARG 34 3HG ARG 34 1.055 8.171 -15.727 94 HD2 ARG 34 2HD ARG 34 0.296 8.411 -18.660 95 HD3 ARG 34 3HD ARG 34 1.918 8.267 -17.979 96 HE ARG 34 HE ARG 34 1.471 5.962 -17.371 97 HH11 ARG 34 1HH1 ARG 34 -0.885 7.305 -19.691 98 HH12 ARG 34 2HH1 ARG 34 -1.307 5.728 -20.271 99 HH21 ARG 34 1HH2 ARG 34 0.820 4.013 -18.098 100 HH22 ARG 34 2HH2 ARG 34 -0.351 3.887 -19.396 101 H TYR 35 H TYR 35 -2.042 6.679 -13.833 102 HA TYR 35 HA TYR 35 -4.592 5.814 -14.528 103 HB2 TYR 35 2HB TYR 35 -2.686 5.227 -12.253 104 HB3 TYR 35 3HB TYR 35 -4.296 4.533 -12.257 105 HD1 TYR 35 HD1 TYR 35 -1.703 5.030 -15.000 106 HD2 TYR 35 HD2 TYR 35 -4.245 2.328 -12.822 107 HE1 TYR 35 HE1 TYR 35 -1.191 3.251 -16.635 108 HE2 TYR 35 HE2 TYR 35 -3.891 0.611 -14.533 109 HH TYR 35 HH TYR 35 -1.652 1.131 -17.342 110 H GLY 36 H GLY 36 -3.744 7.655 -11.613 111 HA2 GLY 36 HA2 GLY 36 -6.544 7.973 -10.785 112 HA3 GLY 36 HA3 GLY 36 -5.131 8.710 -10.019 113 H ALA 37 H ALA 37 -4.452 9.672 -12.996 114 HA ALA 37 HA ALA 37 -5.660 12.258 -12.625 115 HB1 ALA 37 1HB ALA 37 -4.359 12.940 -14.542 116 HB2 ALA 37 2HB ALA 37 -3.354 12.010 -13.422 117 HB3 ALA 37 3HB ALA 37 -3.946 11.264 -14.926 118 H ILE 38 H ILE 38 -6.303 9.432 -14.692 119 HA ILE 38 HA ILE 38 -8.074 10.714 -16.530 120 HB ILE 38 HB ILE 38 -8.743 8.540 -17.183 121 HG12 ILE 38 2HG1 ILE 38 -8.069 7.669 -14.383 122 HG13 ILE 38 3HG1 ILE 38 -9.613 7.583 -15.224 123 HG21 ILE 38 1HG2 ILE 38 -5.973 7.912 -16.112 124 HG22 ILE 38 2HG2 ILE 38 -6.721 7.397 -17.630 125 HG23 ILE 38 3HG2 ILE 38 -6.232 9.086 -17.431 126 HD11 ILE 38 1HD1 ILE 38 -8.617 5.846 -16.749 127 HD12 ILE 38 2HD1 ILE 38 -7.185 5.824 -15.672 128 HD13 ILE 38 3HD1 ILE 38 -8.777 5.366 -15.055 129 H TYR 39 H TYR 39 -8.546 9.680 -13.287 130 HA TYR 39 HA TYR 39 -11.454 9.979 -13.283 131 HB2 TYR 39 2HB TYR 39 -9.487 9.614 -10.982 132 HB3 TYR 39 3HB TYR 39 -11.233 9.557 -10.870 133 HD1 TYR 39 HD1 TYR 39 -12.528 7.721 -11.881 134 HD2 TYR 39 HD2 TYR 39 -8.250 7.658 -11.805 135 HE1 TYR 39 HE1 TYR 39 -12.509 5.379 -12.758 136 HE2 TYR 39 HE2 TYR 39 -8.216 5.231 -12.489 137 HH TYR 39 HH TYR 39 -9.590 3.494 -13.231 138 H THR 40 H THR 40 -8.703 11.695 -11.734 139 HA THR 40 HA THR 40 -10.282 13.751 -10.571 140 HB THR 40 HB THR 40 -7.883 12.931 -10.066 141 HG1 THR 40 HG1 THR 40 -8.619 15.689 -10.022 142 HG21 THR 40 1HG2 THR 40 -6.052 14.071 -10.969 143 HG22 THR 40 2HG2 THR 40 -7.069 15.335 -11.722 144 HG23 THR 40 3HG2 THR 40 -7.045 13.686 -12.368 145 H GLN 41 H GLN 41 -8.792 13.595 -13.786 146 HA GLN 41 HA GLN 41 -9.304 16.373 -14.453 147 HB2 GLN 41 2HB GLN 41 -8.642 13.887 -16.065 148 HB3 GLN 41 3HB GLN 41 -8.870 15.472 -16.812 149 HG2 GLN 41 2HG GLN 41 -6.742 14.757 -14.745 150 HG3 GLN 41 3HG GLN 41 -6.469 15.016 -16.460 151 HE21 GLN 41 1HE2 GLN 41 -5.292 16.447 -14.092 152 HE22 GLN 41 2HE2 GLN 41 -5.707 18.135 -14.354 153 H LEU 42 H LEU 42 -11.194 13.360 -14.755 154 HA LEU 42 HA LEU 42 -13.301 14.691 -16.276 155 HB2 LEU 42 2HB LEU 42 -12.816 12.189 -16.243 156 HB3 LEU 42 3HB LEU 42 -13.457 12.195 -14.590 157 HG LEU 42 HG LEU 42 -15.664 12.962 -15.439 158 HD11 LEU 42 1HD1 LEU 42 -15.045 14.199 -17.466 159 HD12 LEU 42 2HD1 LEU 42 -16.119 12.882 -17.904 160 HD13 LEU 42 3HD1 LEU 42 -14.372 12.719 -18.194 161 HD21 LEU 42 1HD2 LEU 42 -15.380 10.616 -15.166 162 HD22 LEU 42 2HD2 LEU 42 -14.537 10.473 -16.731 163 HD23 LEU 42 3HD2 LEU 42 -16.273 10.875 -16.668 164 H ILE 43 H ILE 43 -12.632 14.216 -12.824 165 HA ILE 43 HA ILE 43 -15.229 15.158 -11.938 166 HB ILE 43 HB ILE 43 -12.578 14.511 -10.613 167 HG12 ILE 43 2HG1 ILE 43 -14.163 13.159 -9.207 168 HG13 ILE 43 3HG1 ILE 43 -15.501 13.741 -10.217 169 HG21 ILE 43 1HG2 ILE 43 -13.550 15.194 -8.435 170 HG22 ILE 43 2HG2 ILE 43 -13.249 16.591 -9.450 171 HG23 ILE 43 3HG2 ILE 43 -14.918 15.962 -9.293 172 HD11 ILE 43 1HD1 ILE 43 -13.220 11.915 -10.998 173 HD12 ILE 43 2HD1 ILE 43 -14.932 11.516 -10.836 174 HD13 ILE 43 3HD1 ILE 43 -14.413 12.565 -12.165 175 H ARG 44 H ARG 44 -12.034 16.750 -12.039 176 HA ARG 44 HA ARG 44 -12.984 19.271 -11.115 177 HB2 ARG 44 2HB ARG 44 -10.841 20.140 -11.677 178 HB3 ARG 44 3HB ARG 44 -10.634 18.477 -11.178 179 HG2 ARG 44 2HG ARG 44 -9.215 18.467 -12.926 180 HG3 ARG 44 3HG ARG 44 -10.685 17.890 -13.682 181 HD2 ARG 44 2HD ARG 44 -9.692 19.440 -15.156 182 HD3 ARG 44 3HD ARG 44 -11.112 20.242 -14.491 183 HE ARG 44 HE ARG 44 -8.260 20.796 -13.825 184 HH11 ARG 44 1HH1 ARG 44 -11.653 21.978 -13.432 185 HH12 ARG 44 2HH1 ARG 44 -11.014 23.582 -13.098 186 HH21 ARG 44 1HH2 ARG 44 -7.716 22.922 -13.304 187 HH22 ARG 44 2HH2 ARG 44 -9.013 24.065 -13.017 188 H GLN 45 H GLN 45 -13.273 17.814 -14.258 189 HA GLN 45 HA GLN 45 -13.752 20.369 -15.619 190 HB2 GLN 45 2HB GLN 45 -13.717 19.357 -17.548 191 HB3 GLN 45 3HB GLN 45 -12.701 18.303 -16.568 192 HG2 GLN 45 2HG GLN 45 -14.641 16.714 -16.409 193 HG3 GLN 45 3HG GLN 45 -15.592 17.790 -17.438 194 HE21 GLN 45 1HE2 GLN 45 -12.188 16.512 -17.463 195 HE22 GLN 45 2HE2 GLN 45 -12.209 16.220 -19.197 196 H ASN 46 H ASN 46 -15.780 18.252 -13.681 197 HA ASN 46 HA ASN 46 -18.237 19.663 -14.575 198 HB2 ASN 46 2HB ASN 46 -17.717 18.119 -12.008 199 HB3 ASN 46 3HB ASN 46 -19.268 18.675 -12.614 200 HD21 ASN 46 1HD2 ASN 46 -16.980 16.132 -12.656 201 HD22 ASN 46 2HD2 ASN 46 -17.967 15.095 -13.688 202 H LEU 47 H LEU 47 -15.773 19.794 -11.994 203 HA LEU 47 HA LEU 47 -17.272 21.786 -10.467 204 HB2 LEU 47 2HB LEU 47 -14.658 20.361 -9.928 205 HB3 LEU 47 3HB LEU 47 -15.610 21.303 -8.787 206 HG LEU 47 HG LEU 47 -16.496 18.748 -10.007 207 HD11 LEU 47 1HD1 LEU 47 -14.600 18.626 -8.522 208 HD12 LEU 47 2HD1 LEU 47 -16.041 17.953 -7.713 209 HD13 LEU 47 3HD1 LEU 47 -15.465 19.593 -7.299 210 HD21 LEU 47 1HD2 LEU 47 -18.257 18.879 -8.156 211 HD22 LEU 47 2HD2 LEU 47 -18.511 19.994 -9.515 212 HD23 LEU 47 3HD2 LEU 47 -17.830 20.591 -7.986 213 H LEU 48 H LEU 48 -17.097 23.476 -11.770 214 HA LEU 48 HA LEU 48 -14.584 24.689 -12.526 215 HB2 LEU 48 2HB LEU 48 -16.064 26.484 -13.521 216 HB3 LEU 48 3HB LEU 48 -16.302 24.842 -14.090 217 HG LEU 48 HG LEU 48 -18.343 24.590 -12.800 218 HD11 LEU 48 1HD1 LEU 48 -17.952 27.479 -11.875 219 HD12 LEU 48 2HD1 LEU 48 -17.938 26.038 -10.841 220 HD13 LEU 48 3HD1 LEU 48 -19.426 26.509 -11.669 221 HD21 LEU 48 1HD2 LEU 48 -18.288 27.151 -14.436 222 HD22 LEU 48 2HD2 LEU 48 -19.729 26.173 -14.074 223 HD23 LEU 48 3HD2 LEU 48 -18.419 25.498 -15.072 224 H VAL 49 H VAL 49 -14.766 24.410 -9.748 225 HA VAL 49 HA VAL 49 -15.523 27.043 -8.663 226 HB VAL 49 HB VAL 49 -14.680 24.821 -6.848 227 HG11 VAL 49 1HG1 VAL 49 -16.655 27.145 -6.660 228 HG12 VAL 49 2HG1 VAL 49 -16.301 25.985 -5.365 229 HG13 VAL 49 3HG1 VAL 49 -15.044 27.101 -5.943 230 HG21 VAL 49 1HG2 VAL 49 -17.432 25.156 -8.131 231 HG22 VAL 49 2HG2 VAL 49 -16.360 23.738 -8.267 232 HG23 VAL 49 3HG2 VAL 49 -17.084 24.144 -6.716 233 H GLU 50 H GLU 50 -12.803 24.931 -7.763 234 HA GLU 50 HA GLU 50 -10.576 25.107 -7.904 235 HB2 GLU 50 2HB GLU 50 -10.940 27.678 -9.464 236 HB3 GLU 50 3HB GLU 50 -9.499 26.668 -9.368 237 HG2 GLU 50 2HG GLU 50 -10.820 24.765 -10.351 238 HG3 GLU 50 3HG GLU 50 -12.172 25.876 -10.607 239 H ASP 51 H ASP 51 -11.824 28.405 -7.145 240 HA ASP 51 HA ASP 51 -9.512 29.058 -5.563 241 HB2 ASP 51 2HB ASP 51 -11.048 30.655 -6.798 242 HB3 ASP 51 3HB ASP 51 -12.217 30.418 -5.499 243 H SER 52 H SER 52 -12.446 27.390 -4.773 244 HA SER 52 HA SER 52 -11.929 27.480 -1.848 245 HB2 SER 52 2HB SER 52 -13.967 26.170 -1.667 246 HB3 SER 52 3HB SER 52 -14.261 27.611 -2.658 247 HG SER 52 HG SER 52 -15.117 25.620 -3.559 248 H PHE 53 H PHE 53 -10.740 25.740 -4.490 249 HA PHE 53 HA PHE 53 -10.452 23.143 -3.105 250 HB2 PHE 53 2HB PHE 53 -9.886 23.944 -5.950 251 HB3 PHE 53 3HB PHE 53 -9.739 22.336 -5.280 252 HD1 PHE 53 HD1 PHE 53 -12.549 22.918 -3.568 253 HD2 PHE 53 HD2 PHE 53 -11.336 22.980 -7.715 254 HE1 PHE 53 HE1 PHE 53 -14.791 22.197 -4.228 255 HE2 PHE 53 HE2 PHE 53 -13.574 22.213 -8.358 256 HZ PHE 53 HZ PHE 53 -15.300 21.777 -6.649 257 H ARG 54 H ARG 54 -8.726 26.005 -3.773 258 HA ARG 54 HA ARG 54 -6.021 24.808 -3.517 259 HB2 ARG 54 2HB ARG 54 -5.200 26.830 -4.426 260 HB3 ARG 54 3HB ARG 54 -6.584 26.286 -5.391 261 HG2 ARG 54 2HG ARG 54 -8.032 27.965 -4.346 262 HG3 ARG 54 3HG ARG 54 -6.708 28.507 -3.309 263 HD2 ARG 54 2HD ARG 54 -6.917 30.039 -5.162 264 HD3 ARG 54 3HD ARG 54 -5.394 29.156 -5.263 265 HE ARG 54 HE ARG 54 -6.344 27.739 -7.013 266 HH11 ARG 54 1HH1 ARG 54 -8.148 30.791 -6.536 267 HH12 ARG 54 2HH1 ARG 54 -8.556 30.859 -8.226 268 HH21 ARG 54 1HH2 ARG 54 -7.096 27.815 -9.052 269 HH22 ARG 54 2HH2 ARG 54 -8.044 29.170 -9.617 270 H GLY 55 H GLY 55 -4.427 25.831 -2.181 271 HA2 GLY 55 HA2 GLY 55 -3.570 26.876 -0.277 272 HA3 GLY 55 HA3 GLY 55 -5.183 27.559 0.056 273 H LYS 56 H LYS 56 -6.711 25.241 0.218 274 HA LYS 56 HA LYS 56 -5.768 23.875 2.676 275 HB2 LYS 56 2HB LYS 56 -8.046 23.052 2.827 276 HB3 LYS 56 3HB LYS 56 -7.989 24.786 2.695 277 HG2 LYS 56 2HG LYS 56 -9.824 24.089 1.429 278 HG3 LYS 56 3HG LYS 56 -8.624 24.624 0.270 279 HD2 LYS 56 2HD LYS 56 -8.126 22.403 -0.426 280 HD3 LYS 56 3HD LYS 56 -8.949 21.667 0.952 281 HE2 LYS 56 2HE LYS 56 -10.185 23.244 -1.293 282 HE3 LYS 56 3HE LYS 56 -10.164 21.467 -1.204 283 HZ1 LYS 56 HZ1 LYS 56 -11.646 21.577 0.687 284 HZ2 LYS 56 HZ2 LYS 56 -12.277 22.566 -0.477 285 HZ3 LYS 56 HZ3 LYS 56 -11.525 23.202 0.808 286 H GLN 57 H GLN 57 -6.640 21.411 2.566 287 HA GLN 57 HA GLN 57 -5.647 20.147 0.044 288 HB2 GLN 57 2HB GLN 57 -4.056 18.918 1.138 289 HB3 GLN 57 3HB GLN 57 -4.016 20.349 2.100 290 HG2 GLN 57 2HG GLN 57 -4.112 18.867 3.788 291 HG3 GLN 57 3HG GLN 57 -5.846 19.065 3.542 292 HE21 GLN 57 1HE2 GLN 57 -3.975 17.105 1.324 293 HE22 GLN 57 2HE2 GLN 57 -4.773 15.612 1.816 294 H CYS 58 H CYS 58 -6.370 17.883 -0.219 295 HA CYS 58 HA CYS 58 -8.072 16.803 1.826 296 HB2 CYS 58 2HB CYS 58 -10.105 16.550 0.790 297 HB3 CYS 58 3HB CYS 58 -9.637 18.090 0.061 298 HG CYS 58 HG CYS 58 -10.851 16.444 -1.667 299 H ARG 59 H ARG 59 -8.381 14.546 1.669 300 HA ARG 59 HA ARG 59 -7.198 13.158 -0.634 301 HB2 ARG 59 2HB ARG 59 -6.442 11.298 0.774 302 HB3 ARG 59 3HB ARG 59 -5.474 12.742 0.922 303 HG2 ARG 59 2HG ARG 59 -7.601 12.336 2.998 304 HG3 ARG 59 3HG ARG 59 -6.241 11.242 2.994 305 HD2 ARG 59 2HD ARG 59 -4.830 13.487 2.929 306 HD3 ARG 59 3HD ARG 59 -6.360 14.189 3.501 307 HE ARG 59 HE ARG 59 -5.455 11.813 4.965 308 HH11 ARG 59 1HH1 ARG 59 -5.339 15.351 4.958 309 HH12 ARG 59 2HH1 ARG 59 -4.813 15.413 6.614 310 HH21 ARG 59 1HH2 ARG 59 -4.778 11.984 7.097 311 HH22 ARG 59 2HH2 ARG 59 -4.488 13.544 7.788 312 H VAL 60 H VAL 60 -8.707 11.850 -1.546 313 HA VAL 60 HA VAL 60 -10.712 10.517 0.190 314 HB VAL 60 HB VAL 60 -12.567 11.084 -1.245 315 HG11 VAL 60 1HG1 VAL 60 -12.917 13.386 -0.600 316 HG12 VAL 60 2HG1 VAL 60 -12.021 12.568 0.704 317 HG13 VAL 60 3HG1 VAL 60 -11.171 13.653 -0.400 318 HG21 VAL 60 1HG2 VAL 60 -10.681 12.907 -2.802 319 HG22 VAL 60 2HG2 VAL 60 -11.370 11.364 -3.381 320 HG23 VAL 60 3HG2 VAL 60 -12.433 12.751 -3.034 321 H ASN 61 H ASN 61 -12.000 8.922 -1.422 322 HA ASN 61 HA ASN 61 -10.022 7.666 -3.169 323 HB2 ASN 61 2HB ASN 61 -9.431 6.760 -1.096 324 HB3 ASN 61 3HB ASN 61 -11.051 6.867 -0.441 325 HD21 ASN 61 1HD2 ASN 61 -10.392 5.235 -3.534 326 HD22 ASN 61 2HD2 ASN 61 -10.861 3.657 -2.937 327 H LEU 62 H LEU 62 -10.812 6.785 -4.908 328 HA LEU 62 HA LEU 62 -13.796 6.486 -5.189 329 HB2 LEU 62 2HB LEU 62 -11.525 7.187 -7.046 330 HB3 LEU 62 3HB LEU 62 -12.943 6.364 -7.693 331 HG LEU 62 HG LEU 62 -14.407 8.165 -6.912 332 HD11 LEU 62 1HD1 LEU 62 -13.219 9.095 -4.973 333 HD12 LEU 62 2HD1 LEU 62 -13.361 10.365 -6.189 334 HD13 LEU 62 3HD1 LEU 62 -11.816 9.509 -5.984 335 HD21 LEU 62 1HD2 LEU 62 -11.996 9.071 -8.551 336 HD22 LEU 62 2HD2 LEU 62 -13.586 9.867 -8.552 337 HD23 LEU 62 3HD2 LEU 62 -13.422 8.216 -9.174 338 H LYS 63 H LYS 63 -14.613 4.560 -5.385 339 HA LYS 63 HA LYS 63 -12.944 2.202 -6.135 340 HB2 LYS 63 2HB LYS 63 -15.381 2.404 -4.326 341 HB3 LYS 63 3HB LYS 63 -14.575 0.907 -4.775 342 HG2 LYS 63 2HG LYS 63 -12.547 1.588 -3.581 343 HG3 LYS 63 3HG LYS 63 -13.197 3.199 -3.283 344 HD2 LYS 63 2HD LYS 63 -14.985 2.293 -1.895 345 HD3 LYS 63 3HD LYS 63 -14.393 0.636 -2.162 346 HE2 LYS 63 2HE LYS 63 -12.286 1.135 -1.039 347 HE3 LYS 63 3HE LYS 63 -12.666 2.858 -0.988 348 HZ1 LYS 63 HZ1 LYS 63 -14.255 0.826 0.463 349 HZ2 LYS 63 HZ2 LYS 63 -14.361 2.466 0.610 350 HZ3 LYS 63 HZ3 LYS 63 -13.038 1.684 1.141 351 H LEU 64 H LEU 64 -13.339 1.957 -8.348 352 HA LEU 64 HA LEU 64 -16.092 2.395 -9.337 353 HB2 LEU 64 2HB LEU 64 -13.539 2.040 -10.932 354 HB3 LEU 64 3HB LEU 64 -15.116 2.557 -11.507 355 HG LEU 64 HG LEU 64 -14.014 4.475 -11.572 356 HD11 LEU 64 1HD1 LEU 64 -15.133 4.661 -8.765 357 HD12 LEU 64 2HD1 LEU 64 -15.970 4.920 -10.318 358 HD13 LEU 64 3HD1 LEU 64 -14.691 6.020 -9.824 359 HD21 LEU 64 1HD2 LEU 64 -12.383 5.341 -10.022 360 HD22 LEU 64 2HD2 LEU 64 -11.926 3.732 -10.584 361 HD23 LEU 64 3HD2 LEU 64 -12.598 3.967 -8.937 362 H ILE 65 H ILE 65 -16.925 1.035 -10.942 363 HA ILE 65 HA ILE 65 -16.124 -1.855 -10.829 364 HB ILE 65 HB ILE 65 -18.383 -2.208 -11.936 365 HG12 ILE 65 2HG1 ILE 65 -19.120 0.496 -10.752 366 HG13 ILE 65 3HG1 ILE 65 -18.685 0.316 -12.459 367 HG21 ILE 65 1HG2 ILE 65 -17.862 -2.780 -9.587 368 HG22 ILE 65 2HG2 ILE 65 -18.339 -1.152 -9.076 369 HG23 ILE 65 3HG2 ILE 65 -19.543 -2.254 -9.764 370 HD11 ILE 65 1HD1 ILE 65 -21.019 -1.024 -11.074 371 HD12 ILE 65 2HD1 ILE 65 -21.053 0.309 -12.252 372 HD13 ILE 65 3HD1 ILE 65 -20.511 -1.301 -12.764 373 HA PRO 66 HA PRO 66 -14.755 -1.121 -15.051 374 HB2 PRO 66 2HB PRO 66 -14.326 -3.661 -15.947 375 HB3 PRO 66 3HB PRO 66 -13.288 -2.888 -14.711 376 HG2 PRO 66 2HG PRO 66 -15.564 -4.827 -14.261 377 HG3 PRO 66 3HG PRO 66 -13.937 -4.828 -13.520 378 HD2 PRO 66 2HD PRO 66 -16.132 -3.778 -12.267 379 HD3 PRO 66 3HD PRO 66 -14.485 -3.110 -12.030 380 H THR 67 H THR 67 -16.023 -0.511 -16.696 381 HA THR 67 HA THR 67 -18.527 -2.025 -17.370 382 HB THR 67 HB THR 67 -17.838 0.922 -17.514 383 HG1 THR 67 HG1 THR 67 -18.453 -0.083 -15.519 384 HG21 THR 67 1HG2 THR 67 -20.363 -0.524 -18.456 385 HG22 THR 67 2HG2 THR 67 -19.246 0.434 -19.458 386 HG23 THR 67 3HG2 THR 67 -20.212 1.234 -18.212 387 H GLY 68 H GLY 68 -15.570 -0.643 -18.653 388 HA2 GLY 68 HA2 GLY 68 -14.409 -1.822 -20.410 389 HA3 GLY 68 HA3 GLY 68 -15.966 -2.222 -21.176 390 H THR 69 H THR 69 -17.139 0.376 -21.145 391 HA THR 69 HA THR 69 -15.623 1.999 -23.072 392 HB THR 69 HB THR 69 -17.474 3.654 -22.625 393 HG1 THR 69 HG1 THR 69 -19.226 2.866 -21.404 394 HG21 THR 69 1HG2 THR 69 -18.398 0.834 -23.367 395 HG22 THR 69 2HG2 THR 69 -17.624 1.993 -24.474 396 HG23 THR 69 3HG2 THR 69 -19.211 2.356 -23.776 397 H GLY 70 H GLY 70 -16.255 1.939 -19.623 398 HA2 GLY 70 HA2 GLY 70 -13.730 3.292 -19.089 399 HA3 GLY 70 HA3 GLY 70 -15.120 4.169 -18.514 400 H ALA 71 H ALA 71 -13.933 3.722 -16.397 401 HA ALA 71 HA ALA 71 -15.261 1.375 -15.144 402 HB1 ALA 71 1HB ALA 71 -14.028 1.791 -13.198 403 HB2 ALA 71 2HB ALA 71 -12.860 2.016 -14.484 404 HB3 ALA 71 3HB ALA 71 -13.576 3.432 -13.700 405 H LEU 72 H LEU 72 -16.789 1.931 -13.363 406 HA LEU 72 HA LEU 72 -18.120 4.609 -13.582 407 HB2 LEU 72 2HB LEU 72 -19.150 1.989 -14.320 408 HB3 LEU 72 3HB LEU 72 -19.986 2.507 -12.882 409 HG LEU 72 HG LEU 72 -20.699 4.578 -13.972 410 HD11 LEU 72 1HD1 LEU 72 -19.133 3.513 -16.352 411 HD12 LEU 72 2HD1 LEU 72 -18.910 5.063 -15.502 412 HD13 LEU 72 3HD1 LEU 72 -20.365 4.794 -16.469 413 HD21 LEU 72 1HD2 LEU 72 -22.257 3.561 -15.583 414 HD22 LEU 72 2HD2 LEU 72 -22.083 2.527 -14.157 415 HD23 LEU 72 3HD2 LEU 72 -21.248 2.099 -15.668 416 H LEU 73 H LEU 73 -18.908 5.500 -11.666 417 HA LEU 73 HA LEU 73 -17.684 4.764 -9.254 418 HB2 LEU 73 2HB LEU 73 -18.614 6.977 -9.935 419 HB3 LEU 73 3HB LEU 73 -20.232 6.401 -9.543 420 HG LEU 73 HG LEU 73 -19.038 7.885 -7.859 421 HD11 LEU 73 1HD1 LEU 73 -19.844 6.755 -5.877 422 HD12 LEU 73 2HD1 LEU 73 -19.940 5.205 -6.736 423 HD13 LEU 73 3HD1 LEU 73 -20.996 6.545 -7.207 424 HD21 LEU 73 1HD2 LEU 73 -17.450 5.403 -7.113 425 HD22 LEU 73 2HD2 LEU 73 -17.329 7.028 -6.422 426 HD23 LEU 73 3HD2 LEU 73 -16.793 6.734 -8.081 427 H GLY 74 H GLY 74 -17.786 3.014 -8.188 428 HA2 GLY 74 HA2 GLY 74 -20.336 1.554 -7.681 429 HA3 GLY 74 HA3 GLY 74 -18.676 0.991 -7.340 430 H SER 75 H SER 75 -17.687 3.357 -5.992 431 HA SER 75 HA SER 75 -19.470 4.244 -3.881 432 HB2 SER 75 2HB SER 75 -17.457 2.062 -3.293 433 HB3 SER 75 3HB SER 75 -17.843 3.278 -2.076 434 HG SER 75 HG SER 75 -19.849 1.739 -3.390 435 H LEU 76 H LEU 76 -18.549 5.924 -2.647 436 HA LEU 76 HA LEU 76 -15.743 6.684 -3.306 437 HB2 LEU 76 2HB LEU 76 -17.459 8.077 -4.501 438 HB3 LEU 76 3HB LEU 76 -18.072 8.635 -2.954 439 HG LEU 76 HG LEU 76 -15.106 8.919 -3.421 440 HD11 LEU 76 1HD1 LEU 76 -17.193 10.511 -4.937 441 HD12 LEU 76 2HD1 LEU 76 -15.880 9.544 -5.599 442 HD13 LEU 76 3HD1 LEU 76 -15.496 11.035 -4.722 443 HD21 LEU 76 1HD2 LEU 76 -17.214 10.796 -2.278 444 HD22 LEU 76 2HD2 LEU 76 -15.460 11.080 -2.290 445 HD23 LEU 76 3HD2 LEU 76 -16.136 9.756 -1.327 446 H THR 77 H THR 77 -14.519 6.697 -1.618 447 HA THR 77 HA THR 77 -15.630 6.860 1.170 448 HB THR 77 HB THR 77 -13.054 5.758 -0.019 449 HG1 THR 77 HG1 THR 77 -15.194 4.657 -0.076 450 HG21 THR 77 1HG2 THR 77 -13.951 5.863 2.904 451 HG22 THR 77 2HG2 THR 77 -12.529 6.676 2.218 452 HG23 THR 77 3HG2 THR 77 -12.581 4.905 2.287 453 H VAL 78 H VAL 78 -15.033 8.636 2.391 454 HA VAL 78 HA VAL 78 -13.045 10.562 1.257 455 HB VAL 78 HB VAL 78 -13.847 12.195 2.889 456 HG11 VAL 78 1HG1 VAL 78 -15.926 12.770 1.692 457 HG12 VAL 78 2HG1 VAL 78 -14.653 12.251 0.578 458 HG13 VAL 78 3HG1 VAL 78 -15.993 11.149 0.988 459 HG21 VAL 78 1HG2 VAL 78 -16.044 11.946 3.968 460 HG22 VAL 78 2HG2 VAL 78 -16.118 10.251 3.432 461 HG23 VAL 78 3HG2 VAL 78 -14.886 10.770 4.601 462 H LEU 79 H LEU 79 -11.105 10.916 2.317 463 HA LEU 79 HA LEU 79 -10.600 9.203 4.720 464 HB2 LEU 79 2HB LEU 79 -8.628 10.376 2.757 465 HB3 LEU 79 3HB LEU 79 -8.259 9.283 4.070 466 HG LEU 79 HG LEU 79 -9.975 8.588 1.642 467 HD11 LEU 79 1HD1 LEU 79 -8.028 7.287 0.889 468 HD12 LEU 79 2HD1 LEU 79 -7.073 7.885 2.265 469 HD13 LEU 79 3HD1 LEU 79 -7.643 9.005 1.014 470 HD21 LEU 79 1HD2 LEU 79 -9.691 6.251 2.385 471 HD22 LEU 79 2HD2 LEU 79 -10.550 7.192 3.611 472 HD23 LEU 79 3HD2 LEU 79 -8.826 6.806 3.834 473 H ASP 80 H ASP 80 -9.892 12.475 3.393 474 HA ASP 80 HA ASP 80 -10.765 13.791 5.725 475 HB2 ASP 80 2HB ASP 80 -8.386 12.881 6.480 476 HB3 ASP 80 3HB ASP 80 -7.795 14.125 5.388 477 H GLY 81 H GLY 81 -10.196 16.207 5.622 478 HA2 GLY 81 HA2 GLY 81 -8.829 17.679 3.872 479 HA3 GLY 81 HA3 GLY 81 -10.188 17.243 2.846 480 H ASP 82 H ASP 82 -10.140 19.658 2.866 481 HA ASP 82 HA ASP 82 -11.858 20.840 4.989 482 HB2 ASP 82 2HB ASP 82 -10.075 22.241 4.186 483 HB3 ASP 82 3HB ASP 82 -10.525 21.968 2.522 484 H SER 83 H SER 83 -13.918 20.325 4.827 485 HA SER 83 HA SER 83 -14.619 18.329 3.063 486 HB2 SER 83 2HB SER 83 -16.839 18.403 4.180 487 HB3 SER 83 3HB SER 83 -15.471 18.451 5.304 488 HG SER 83 HG SER 83 -17.094 19.999 5.864 489 H ARG 84 H ARG 84 -15.102 21.682 2.407 490 HA ARG 84 HA ARG 84 -17.326 21.536 0.649 491 HB2 ARG 84 2HB ARG 84 -16.320 23.594 1.571 492 HB3 ARG 84 3HB ARG 84 -14.906 23.392 0.528 493 HG2 ARG 84 2HG ARG 84 -16.252 23.696 -1.473 494 HG3 ARG 84 3HG ARG 84 -17.759 23.640 -0.530 495 HD2 ARG 84 2HD ARG 84 -17.170 25.702 0.625 496 HD3 ARG 84 3HD ARG 84 -15.598 25.757 -0.218 497 HE ARG 84 HE ARG 84 -17.695 25.609 -2.138 498 HH11 ARG 84 1HH1 ARG 84 -16.448 27.972 0.187 499 HH12 ARG 84 2HH1 ARG 84 -17.005 29.325 -0.751 500 HH21 ARG 84 1HH2 ARG 84 -18.418 27.417 -3.282 501 HH22 ARG 84 2HH2 ARG 84 -18.103 29.017 -2.669 502 H LEU 85 H LEU 85 -13.891 20.557 0.091 503 HA LEU 85 HA LEU 85 -14.434 20.159 -2.787 504 HB2 LEU 85 2HB LEU 85 -12.221 20.798 -2.167 505 HB3 LEU 85 3HB LEU 85 -12.066 19.451 -1.025 506 HG LEU 85 HG LEU 85 -12.039 17.838 -2.826 507 HD11 LEU 85 1HD1 LEU 85 -12.325 20.130 -4.826 508 HD12 LEU 85 2HD1 LEU 85 -13.559 18.902 -4.508 509 HD13 LEU 85 3HD1 LEU 85 -12.014 18.434 -5.214 510 HD21 LEU 85 1HD2 LEU 85 -10.236 20.208 -3.522 511 HD22 LEU 85 2HD2 LEU 85 -9.935 18.496 -3.899 512 HD23 LEU 85 3HD2 LEU 85 -9.931 19.060 -2.212 513 H CYS 86 H CYS 86 -13.954 17.939 0.067 514 HA CYS 86 HA CYS 86 -14.644 15.555 -1.099 515 HB2 CYS 86 2HB CYS 86 -15.574 16.509 1.643 516 HB3 CYS 86 3HB CYS 86 -15.347 14.839 1.101 517 HG CYS 86 HG CYS 86 -13.363 15.402 2.708 518 H ALA 87 H ALA 87 -17.022 18.043 -0.017 519 HA ALA 87 HA ALA 87 -19.349 16.505 -0.747 520 HB1 ALA 87 1HB ALA 87 -20.503 18.681 -0.492 521 HB2 ALA 87 2HB ALA 87 -19.377 18.407 0.850 522 HB3 ALA 87 3HB ALA 87 -18.939 19.532 -0.459 523 H ALA 88 H ALA 88 -17.478 18.991 -2.544 524 HA ALA 88 HA ALA 88 -19.164 19.052 -4.840 525 HB1 ALA 88 1HB ALA 88 -17.572 20.831 -4.190 526 HB2 ALA 88 2HB ALA 88 -16.201 19.754 -4.535 527 HB3 ALA 88 3HB ALA 88 -17.279 20.279 -5.835 528 H THR 89 H THR 89 -16.045 17.296 -4.349 529 HA THR 89 HA THR 89 -15.999 15.959 -6.883 530 HB THR 89 HB THR 89 -14.054 16.175 -5.398 531 HG1 THR 89 HG1 THR 89 -13.329 14.068 -5.909 532 HG21 THR 89 1HG2 THR 89 -15.305 15.361 -3.269 533 HG22 THR 89 2HG2 THR 89 -13.651 14.792 -3.529 534 HG23 THR 89 3HG2 THR 89 -15.034 13.727 -3.887 535 H LYS 90 H LYS 90 -17.333 14.860 -3.771 536 HA LYS 90 HA LYS 90 -18.163 12.274 -4.475 537 HB2 LYS 90 2HB LYS 90 -18.073 13.157 -2.232 538 HB3 LYS 90 3HB LYS 90 -19.271 14.391 -2.623 539 HG2 LYS 90 2HG LYS 90 -20.794 12.207 -3.054 540 HG3 LYS 90 3HG LYS 90 -19.595 11.484 -1.962 541 HD2 LYS 90 2HD LYS 90 -21.160 14.044 -1.432 542 HD3 LYS 90 3HD LYS 90 -21.629 12.439 -0.827 543 HE2 LYS 90 2HE LYS 90 -19.417 12.269 0.367 544 HE3 LYS 90 3HE LYS 90 -19.028 13.902 -0.169 545 HZ1 LYS 90 HZ1 LYS 90 -21.323 13.176 1.580 546 HZ2 LYS 90 HZ2 LYS 90 -20.983 14.694 1.076 547 HZ3 LYS 90 HZ3 LYS 90 -19.947 13.906 2.072 548 H ARG 91 H ARG 91 -19.954 15.329 -4.794 549 HA ARG 91 HA ARG 91 -22.251 14.138 -6.061 550 HB2 ARG 91 2HB ARG 91 -21.209 16.992 -6.000 551 HB3 ARG 91 3HB ARG 91 -22.760 16.540 -6.741 552 HG2 ARG 91 2HG ARG 91 -23.659 15.775 -4.624 553 HG3 ARG 91 3HG ARG 91 -22.095 15.912 -3.836 554 HD2 ARG 91 2HD ARG 91 -23.407 17.776 -3.142 555 HD3 ARG 91 3HD ARG 91 -22.117 18.368 -4.197 556 HE ARG 91 HE ARG 91 -24.524 17.817 -5.710 557 HH11 ARG 91 1HH1 ARG 91 -23.236 20.252 -3.490 558 HH12 ARG 91 2HH1 ARG 91 -24.274 21.499 -4.122 559 HH21 ARG 91 1HH2 ARG 91 -25.809 19.469 -6.481 560 HH22 ARG 91 2HH2 ARG 91 -25.727 21.056 -5.779 561 H ALA 92 H ALA 92 -19.368 15.743 -7.504 562 HA ALA 92 HA ALA 92 -20.138 15.499 -10.227 563 HB1 ALA 92 1HB ALA 92 -17.375 15.572 -8.935 564 HB2 ALA 92 2HB ALA 92 -17.698 15.785 -10.660 565 HB3 ALA 92 3HB ALA 92 -18.351 16.941 -9.488 566 H VAL 93 H VAL 93 -18.155 13.263 -8.230 567 HA VAL 93 HA VAL 93 -17.834 11.321 -10.276 568 HB VAL 93 HB VAL 93 -17.869 10.487 -7.377 569 HG11 VAL 93 1HG1 VAL 93 -16.090 9.027 -8.064 570 HG12 VAL 93 2HG1 VAL 93 -17.376 8.849 -9.252 571 HG13 VAL 93 3HG1 VAL 93 -15.951 9.821 -9.639 572 HG21 VAL 93 1HG2 VAL 93 -15.221 11.305 -7.910 573 HG22 VAL 93 2HG2 VAL 93 -16.217 12.637 -8.465 574 HG23 VAL 93 3HG2 VAL 93 -16.381 12.040 -6.806 575 H ALA 94 H ALA 94 -20.531 11.951 -8.217 576 HA ALA 94 HA ALA 94 -21.831 9.350 -8.606 577 HB1 ALA 94 1HB ALA 94 -22.164 10.620 -6.528 578 HB2 ALA 94 2HB ALA 94 -22.927 11.942 -7.445 579 HB3 ALA 94 3HB ALA 94 -23.690 10.340 -7.375 580 H GLN 95 H GLN 95 -21.349 12.066 -10.608 581 HA GLN 95 HA GLN 95 -23.760 11.427 -12.269 582 HB2 GLN 95 2HB GLN 95 -24.191 13.753 -12.604 583 HB3 GLN 95 3HB GLN 95 -24.175 13.375 -10.882 584 HG2 GLN 95 2HG GLN 95 -22.939 15.391 -10.926 585 HG3 GLN 95 3HG GLN 95 -21.744 14.195 -10.897 586 HE21 GLN 95 1HE2 GLN 95 -20.165 14.347 -12.536 587 HE22 GLN 95 2HE2 GLN 95 -20.342 15.443 -13.917 588 H VAL 96 H VAL 96 -20.330 11.859 -12.310 589 HA VAL 96 HA VAL 96 -19.853 12.521 -14.999 590 HB VAL 96 HB VAL 96 -17.820 11.063 -14.819 591 HG11 VAL 96 1HG1 VAL 96 -18.066 12.977 -12.485 592 HG12 VAL 96 2HG1 VAL 96 -16.617 12.494 -13.334 593 HG13 VAL 96 3HG1 VAL 96 -17.830 13.465 -14.180 594 HG21 VAL 96 1HG2 VAL 96 -17.252 10.376 -12.440 595 HG22 VAL 96 2HG2 VAL 96 -18.955 10.444 -12.084 596 HG23 VAL 96 3HG2 VAL 96 -18.377 9.321 -13.326 597 H ASN 97 H ASN 97 -19.545 11.375 -16.918 598 HA ASN 97 HA ASN 97 -21.505 9.364 -17.381 599 HB2 ASN 97 2HB ASN 97 -20.835 11.169 -18.958 600 HB3 ASN 97 3HB ASN 97 -19.286 10.365 -19.216 601 HD21 ASN 97 1HD2 ASN 97 -22.853 9.734 -19.379 602 HD22 ASN 97 2HD2 ASN 97 -22.731 8.671 -20.777 603 H SER 98 H SER 98 -17.931 9.113 -17.328 604 HA SER 98 HA SER 98 -17.572 6.555 -16.372 605 HB2 SER 98 2HB SER 98 -16.949 5.239 -18.396 606 HB3 SER 98 3HB SER 98 -18.683 5.511 -18.243 607 HG SER 98 HG SER 98 -18.038 5.881 -20.377 608 H PHE 99 H PHE 99 -15.403 6.000 -16.202 609 HA PHE 99 HA PHE 99 -13.534 8.193 -16.874 610 HB2 PHE 99 2HB PHE 99 -12.986 5.756 -15.167 611 HB3 PHE 99 3HB PHE 99 -12.123 7.294 -15.209 612 HD1 PHE 99 HD1 PHE 99 -13.373 9.402 -14.427 613 HD2 PHE 99 HD2 PHE 99 -14.815 5.406 -13.730 614 HE1 PHE 99 HE1 PHE 99 -14.885 10.257 -12.649 615 HE2 PHE 99 HE2 PHE 99 -16.375 6.267 -11.999 616 HZ PHE 99 HZ PHE 99 -16.370 8.654 -11.431 617 HA PRO 100 HA PRO 100 -12.353 5.349 -20.171 618 HB2 PRO 100 2HB PRO 100 -10.792 6.949 -21.720 619 HB3 PRO 100 3HB PRO 100 -12.574 7.050 -21.676 620 HG2 PRO 100 2HG PRO 100 -10.566 8.772 -20.182 621 HG3 PRO 100 3HG PRO 100 -12.015 9.305 -21.091 622 HD2 PRO 100 2HD PRO 100 -12.007 8.977 -18.362 623 HD3 PRO 100 3HD PRO 100 -13.455 8.643 -19.360 624 H LEU 101 H LEU 101 -11.010 3.841 -19.597 625 HA LEU 101 HA LEU 101 -8.341 4.343 -18.506 626 HB2 LEU 101 2HB LEU 101 -8.273 1.983 -18.020 627 HB3 LEU 101 3HB LEU 101 -9.616 2.804 -17.254 628 HG LEU 101 HG LEU 101 -9.801 0.957 -19.665 629 HD11 LEU 101 1HD1 LEU 101 -10.538 0.466 -16.748 630 HD12 LEU 101 2HD1 LEU 101 -9.132 -0.218 -17.601 631 HD13 LEU 101 3HD1 LEU 101 -10.769 -0.671 -18.090 632 HD21 LEU 101 1HD2 LEU 101 -11.980 2.299 -18.020 633 HD22 LEU 101 2HD2 LEU 101 -12.272 0.856 -19.020 634 HD23 LEU 101 3HD2 LEU 101 -11.751 2.342 -19.797 635 HA PRO 102 HA PRO 102 -6.728 3.851 -22.620 636 HB2 PRO 102 2HB PRO 102 -4.043 3.927 -22.133 637 HB3 PRO 102 3HB PRO 102 -5.099 5.355 -21.981 638 HG2 PRO 102 2HG PRO 102 -4.116 3.541 -19.767 639 HG3 PRO 102 3HG PRO 102 -4.157 5.337 -19.812 640 HD2 PRO 102 2HD PRO 102 -6.099 3.846 -18.584 641 HD3 PRO 102 3HD PRO 102 -6.464 5.394 -19.426 642 H LYS 103 H LYS 103 -5.140 1.823 -20.091 643 HA LYS 103 HA LYS 103 -5.051 -0.522 -21.901 644 HB2 LYS 103 2HB LYS 103 -4.013 -0.122 -19.066 645 HB3 LYS 103 3HB LYS 103 -3.688 -1.498 -20.112 646 HG2 LYS 103 2HG LYS 103 -2.628 1.330 -20.353 647 HG3 LYS 103 3HG LYS 103 -1.739 -0.174 -20.087 648 HD2 LYS 103 2HD LYS 103 -2.435 -0.919 -22.406 649 HD3 LYS 103 3HD LYS 103 -3.160 0.684 -22.639 650 HE2 LYS 103 2HE LYS 103 -0.950 1.761 -22.221 651 HE3 LYS 103 3HE LYS 103 -0.225 0.158 -21.994 652 HZ1 LYS 103 HZ1 LYS 103 -1.480 1.110 -24.508 653 HZ2 LYS 103 HZ2 LYS 103 -0.802 -0.367 -24.289 654 HZ3 LYS 103 HZ3 LYS 103 0.125 0.979 -24.239 655 H ASP 104 H ASP 104 -5.640 -2.600 -20.903 656 HA ASP 104 HA ASP 104 -8.136 -2.549 -19.314 657 HB2 ASP 104 2HB ASP 104 -8.617 -1.862 -21.697 658 HB3 ASP 104 3HB ASP 104 -8.019 -3.437 -22.221 659 H GLN 105 H GLN 105 -5.467 -3.908 -18.944 660 HA GLN 105 HA GLN 105 -6.148 -6.753 -19.328 661 HB2 GLN 105 2HB GLN 105 -3.628 -5.462 -18.256 662 HB3 GLN 105 3HB GLN 105 -3.953 -7.181 -18.231 663 HG2 GLN 105 2HG GLN 105 -2.583 -6.704 -20.150 664 HG3 GLN 105 3HG GLN 105 -4.171 -7.274 -20.671 665 HE21 GLN 105 1HE2 GLN 105 -2.785 -4.049 -19.771 666 HE22 GLN 105 2HE2 GLN 105 -3.269 -3.271 -21.274 667 HA PRO 106 HA PRO 106 -7.997 -7.011 -15.234 668 HB2 PRO 106 2HB PRO 106 -6.591 -9.685 -15.231 669 HB3 PRO 106 3HB PRO 106 -8.255 -9.293 -14.680 670 HG2 PRO 106 2HG PRO 106 -7.878 -10.395 -17.123 671 HG3 PRO 106 3HG PRO 106 -9.009 -9.012 -16.947 672 HD2 PRO 106 2HD PRO 106 -6.145 -9.014 -17.940 673 HD3 PRO 106 3HD PRO 106 -7.572 -8.146 -18.580 674 H ASP 107 H ASP 107 -4.543 -7.173 -15.725 675 HA ASP 107 HA ASP 107 -3.882 -7.262 -12.856 676 HB2 ASP 107 2HB ASP 107 -2.432 -8.257 -14.626 677 HB3 ASP 107 3HB ASP 107 -2.196 -6.652 -15.330 678 H VAL 108 H VAL 108 -4.261 -4.839 -15.395 679 HA VAL 108 HA VAL 108 -3.389 -2.661 -13.551 680 HB VAL 108 HB VAL 108 -3.236 -1.232 -15.424 681 HG11 VAL 108 1HG1 VAL 108 -1.390 -2.239 -16.648 682 HG12 VAL 108 2HG1 VAL 108 -1.310 -2.726 -14.945 683 HG13 VAL 108 3HG1 VAL 108 -1.914 -3.867 -16.176 684 HG21 VAL 108 1HG2 VAL 108 -3.579 -1.954 -17.755 685 HG22 VAL 108 2HG2 VAL 108 -4.296 -3.453 -17.171 686 HG23 VAL 108 3HG2 VAL 108 -5.080 -1.888 -16.822 687 H VAL 109 H VAL 109 -6.267 -3.838 -15.256 688 HA VAL 109 HA VAL 109 -8.046 -1.683 -14.764 689 HB VAL 109 HB VAL 109 -8.414 -4.694 -14.840 690 HG11 VAL 109 1HG1 VAL 109 -10.884 -4.276 -15.152 691 HG12 VAL 109 2HG1 VAL 109 -10.327 -3.914 -13.518 692 HG13 VAL 109 3HG1 VAL 109 -10.627 -2.586 -14.665 693 HG21 VAL 109 1HG2 VAL 109 -9.284 -2.519 -16.812 694 HG22 VAL 109 2HG2 VAL 109 -7.781 -3.418 -16.969 695 HG23 VAL 109 3HG2 VAL 109 -9.323 -4.281 -17.072 696 H GLU 110 H GLU 110 -6.672 -4.091 -12.603 697 HA GLU 110 HA GLU 110 -8.472 -3.585 -10.375 698 HB2 GLU 110 2HB GLU 110 -5.978 -5.180 -10.649 699 HB3 GLU 110 3HB GLU 110 -6.861 -5.057 -9.140 700 HG2 GLU 110 2HG GLU 110 -8.169 -6.001 -11.733 701 HG3 GLU 110 3HG GLU 110 -7.380 -7.053 -10.574 702 H LYS 111 H LYS 111 -5.899 -1.804 -11.611 703 HA LYS 111 HA LYS 111 -5.160 -0.708 -8.945 704 HB2 LYS 111 2HB LYS 111 -3.723 -0.988 -11.553 705 HB3 LYS 111 3HB LYS 111 -3.431 0.510 -10.676 706 HG2 LYS 111 2HG LYS 111 -1.791 -1.253 -10.126 707 HG3 LYS 111 3HG LYS 111 -2.678 -0.644 -8.721 708 HD2 LYS 111 2HD LYS 111 -4.098 -2.676 -8.694 709 HD3 LYS 111 3HD LYS 111 -3.354 -3.217 -10.195 710 HE2 LYS 111 2HE LYS 111 -2.427 -4.438 -8.370 711 HE3 LYS 111 3HE LYS 111 -1.173 -3.377 -9.035 712 HZ1 LYS 111 HZ1 LYS 111 -1.189 -3.347 -6.604 713 HZ2 LYS 111 HZ2 LYS 111 -2.740 -2.852 -6.567 714 HZ3 LYS 111 HZ3 LYS 111 -1.578 -1.868 -7.167 715 H LEU 112 H LEU 112 -6.266 0.341 -12.105 716 HA LEU 112 HA LEU 112 -6.729 3.061 -11.258 717 HB2 LEU 112 2HB LEU 112 -7.825 3.319 -13.474 718 HB3 LEU 112 3HB LEU 112 -6.259 2.602 -13.493 719 HG LEU 112 HG LEU 112 -7.405 0.385 -13.527 720 HD11 LEU 112 1HD1 LEU 112 -9.518 0.084 -14.513 721 HD12 LEU 112 2HD1 LEU 112 -9.766 1.846 -14.620 722 HD13 LEU 112 3HD1 LEU 112 -9.654 1.021 -13.037 723 HD21 LEU 112 1HD2 LEU 112 -7.488 2.174 -15.952 724 HD22 LEU 112 2HD2 LEU 112 -7.563 0.386 -15.999 725 HD23 LEU 112 3HD2 LEU 112 -6.108 1.183 -15.395 726 H LYS 113 H LYS 113 -8.802 0.148 -10.955 727 HA LYS 113 HA LYS 113 -11.173 1.671 -10.581 728 HB2 LYS 113 2HB LYS 113 -12.110 -0.428 -9.817 729 HB3 LYS 113 3HB LYS 113 -11.111 -0.680 -11.255 730 HG2 LYS 113 2HG LYS 113 -9.201 -1.414 -9.758 731 HG3 LYS 113 3HG LYS 113 -10.265 -1.221 -8.357 732 HD2 LYS 113 2HD LYS 113 -10.480 -3.193 -10.624 733 HD3 LYS 113 3HD LYS 113 -10.171 -3.493 -8.887 734 HE2 LYS 113 2HE LYS 113 -12.521 -2.507 -8.513 735 HE3 LYS 113 3HE LYS 113 -12.686 -2.564 -10.272 736 HZ1 LYS 113 HZ1 LYS 113 -12.309 -4.863 -8.425 737 HZ2 LYS 113 HZ2 LYS 113 -12.015 -5.032 -10.005 738 HZ3 LYS 113 HZ3 LYS 113 -13.546 -4.658 -9.479 739 H ASN 114 H ASN 114 -8.635 0.915 -8.347 740 HA ASN 114 HA ASN 114 -10.169 2.235 -6.124 741 HB2 ASN 114 2HB ASN 114 -8.043 0.090 -5.840 742 HB3 ASN 114 3HB ASN 114 -8.932 0.883 -4.539 743 HD21 ASN 114 1HD2 ASN 114 -11.579 0.777 -5.436 744 HD22 ASN 114 2HD2 ASN 114 -12.050 -0.906 -5.572 745 H ILE 115 H ILE 115 -9.402 4.268 -6.813 746 HA ILE 115 HA ILE 115 -6.504 4.778 -6.326 747 HB ILE 115 HB ILE 115 -6.729 6.870 -7.497 748 HG12 ILE 115 2HG1 ILE 115 -9.209 7.145 -7.150 749 HG13 ILE 115 3HG1 ILE 115 -8.558 7.612 -8.687 750 HG21 ILE 115 1HG2 ILE 115 -7.372 4.360 -9.068 751 HG22 ILE 115 2HG2 ILE 115 -6.831 5.891 -9.791 752 HG23 ILE 115 3HG2 ILE 115 -5.783 5.020 -8.655 753 HD11 ILE 115 1HD1 ILE 115 -10.129 5.077 -8.161 754 HD12 ILE 115 2HD1 ILE 115 -10.657 6.514 -9.057 755 HD13 ILE 115 3HD1 ILE 115 -9.365 5.510 -9.695 756 H ASN 116 H ASN 116 -5.848 6.569 -5.168 757 HA ASN 116 HA ASN 116 -7.935 7.858 -3.479 758 HB2 ASN 116 2HB ASN 116 -4.997 7.960 -2.797 759 HB3 ASN 116 3HB ASN 116 -6.425 8.271 -1.797 760 HD21 ASN 116 1HD2 ASN 116 -7.935 5.876 -2.177 761 HD22 ASN 116 2HD2 ASN 116 -6.982 4.558 -1.516 762 H LEU 117 H LEU 117 -8.405 9.863 -4.108 763 HA LEU 117 HA LEU 117 -6.519 11.429 -5.820 764 HB2 LEU 117 2HB LEU 117 -9.374 12.069 -5.013 765 HB3 LEU 117 3HB LEU 117 -8.357 12.982 -6.120 766 HG LEU 117 HG LEU 117 -9.521 10.181 -6.542 767 HD11 LEU 117 1HD1 LEU 117 -10.750 11.265 -8.383 768 HD12 LEU 117 2HD1 LEU 117 -9.979 12.813 -8.005 769 HD13 LEU 117 3HD1 LEU 117 -11.083 12.049 -6.833 770 HD21 LEU 117 1HD2 LEU 117 -7.331 10.104 -7.581 771 HD22 LEU 117 2HD2 LEU 117 -7.565 11.712 -8.287 772 HD23 LEU 117 3HD2 LEU 117 -8.534 10.335 -8.866 773 H THR 118 H THR 118 -5.180 12.751 -4.807 774 HA THR 118 HA THR 118 -5.854 13.884 -2.139 775 HB THR 118 HB THR 118 -3.238 12.501 -2.854 776 HG1 THR 118 HG1 THR 118 -3.960 11.078 -1.193 777 HG21 THR 118 1HG2 THR 118 -2.782 14.335 -1.325 778 HG22 THR 118 2HG2 THR 118 -2.860 12.863 -0.342 779 HG23 THR 118 3HG2 THR 118 -4.232 13.982 -0.378 780 H VAL 119 H VAL 119 -5.449 15.970 -2.036 781 HA VAL 119 HA VAL 119 -3.777 17.317 -4.122 782 HB VAL 119 HB VAL 119 -5.483 18.828 -4.644 783 HG11 VAL 119 1HG1 VAL 119 -5.690 16.640 -5.799 784 HG12 VAL 119 2HG1 VAL 119 -6.910 16.142 -4.594 785 HG13 VAL 119 3HG1 VAL 119 -7.236 17.509 -5.670 786 HG21 VAL 119 1HG2 VAL 119 -7.737 18.870 -3.700 787 HG22 VAL 119 2HG2 VAL 119 -7.263 17.623 -2.512 788 HG23 VAL 119 3HG2 VAL 119 -6.542 19.250 -2.477 789 H ALA 120 H ALA 120 -3.213 19.475 -3.679 790 HA ALA 120 HA ALA 120 -3.788 20.769 -1.176 791 HB1 ALA 120 1HB ALA 120 -1.525 20.791 -0.230 792 HB2 ALA 120 2HB ALA 120 -2.141 19.135 -0.337 793 HB3 ALA 120 3HB ALA 120 -0.956 19.700 -1.512 794 HA PRO 121 HA PRO 121 -0.999 23.686 -3.783 795 HB2 PRO 121 2HB PRO 121 -1.142 22.420 -6.518 796 HB3 PRO 121 3HB PRO 121 0.205 23.324 -5.751 797 HG2 PRO 121 2HG PRO 121 0.292 20.617 -5.942 798 HG3 PRO 121 3HG PRO 121 0.807 21.429 -4.419 799 HD2 PRO 121 2HD PRO 121 -1.877 20.167 -5.066 800 HD3 PRO 121 3HD PRO 121 -0.843 19.939 -3.630 801 H GLU 122 H GLU 122 -3.758 22.038 -5.341 802 HA GLU 122 HA GLU 122 -5.180 24.550 -5.893 803 HB2 GLU 122 2HB GLU 122 -3.674 24.195 -7.862 804 HB3 GLU 122 3HB GLU 122 -4.337 22.581 -8.050 805 HG2 GLU 122 2HG GLU 122 -5.395 23.878 -9.671 806 HG3 GLU 122 3HG GLU 122 -6.617 23.654 -8.433 Start of MODEL 18 1 H1 ALA 22 H ALA 22 12.894 0.495 -19.379 2 HA ALA 22 HA ALA 22 10.156 0.463 -19.097 3 HB1 ALA 22 1HB ALA 22 10.064 -1.988 -19.478 4 HB2 ALA 22 2HB ALA 22 11.239 -2.251 -18.170 5 HB3 ALA 22 3HB ALA 22 9.631 -1.570 -17.835 6 H ALA 23 H ALA 23 12.998 -0.718 -17.285 7 HA ALA 23 HA ALA 23 14.060 -0.089 -15.397 8 HB1 ALA 23 1HB ALA 23 12.265 2.383 -15.238 9 HB2 ALA 23 2HB ALA 23 13.798 2.087 -14.419 10 HB3 ALA 23 3HB ALA 23 13.770 2.244 -16.188 11 H ARG 24 H ARG 24 10.830 1.086 -14.518 12 HA ARG 24 HA ARG 24 9.216 0.392 -13.165 13 HB2 ARG 24 2HB ARG 24 10.479 -2.357 -13.358 14 HB3 ARG 24 3HB ARG 24 8.895 -2.015 -12.674 15 HG2 ARG 24 2HG ARG 24 8.013 -1.229 -14.764 16 HG3 ARG 24 3HG ARG 24 9.607 -1.322 -15.543 17 HD2 ARG 24 2HD ARG 24 9.709 -3.723 -15.191 18 HD3 ARG 24 3HD ARG 24 8.137 -3.709 -14.376 19 HE ARG 24 HE ARG 24 7.156 -2.887 -16.554 20 HH11 ARG 24 1HH1 ARG 24 10.090 -4.906 -16.652 21 HH12 ARG 24 2HH1 ARG 24 9.768 -5.356 -18.315 22 HH21 ARG 24 1HH2 ARG 24 6.894 -3.573 -18.736 23 HH22 ARG 24 2HH2 ARG 24 8.104 -4.662 -19.400 24 H GLN 25 H GLN 25 11.946 1.217 -12.018 25 HA GLN 25 HA GLN 25 11.825 -0.033 -9.320 26 HB2 GLN 25 2HB GLN 25 13.921 1.898 -10.347 27 HB3 GLN 25 3HB GLN 25 13.998 0.871 -8.920 28 HG2 GLN 25 2HG GLN 25 14.006 -0.047 -11.818 29 HG3 GLN 25 3HG GLN 25 15.366 -0.050 -10.720 30 HE21 GLN 25 1HE2 GLN 25 12.989 -2.024 -12.048 31 HE22 GLN 25 2HE2 GLN 25 13.022 -3.296 -10.824 32 H GLN 26 H GLN 26 11.042 2.925 -10.883 33 HA GLN 26 HA GLN 26 10.562 4.358 -8.297 34 HB2 GLN 26 2HB GLN 26 11.622 6.296 -9.218 35 HB3 GLN 26 3HB GLN 26 12.732 4.938 -9.261 36 HG2 GLN 26 2HG GLN 26 11.116 5.987 -11.636 37 HG3 GLN 26 3HG GLN 26 12.796 6.387 -11.290 38 HE21 GLN 26 1HE2 GLN 26 14.406 4.519 -11.315 39 HE22 GLN 26 2HE2 GLN 26 14.062 3.203 -12.428 40 H PHE 27 H PHE 27 9.377 3.624 -11.459 41 HA PHE 27 HA PHE 27 7.979 5.909 -12.133 42 HB2 PHE 27 2HB PHE 27 7.244 4.707 -13.927 43 HB3 PHE 27 3HB PHE 27 8.702 3.803 -13.484 44 HD1 PHE 27 HD1 PHE 27 8.264 1.820 -11.747 45 HD2 PHE 27 HD2 PHE 27 5.208 3.589 -14.187 46 HE1 PHE 27 HE1 PHE 27 6.875 -0.207 -11.457 47 HE2 PHE 27 HE2 PHE 27 3.828 1.546 -13.950 48 HZ PHE 27 HZ PHE 27 4.657 -0.374 -12.587 49 H VAL 28 H VAL 28 7.018 4.112 -9.504 50 HA VAL 28 HA VAL 28 4.173 4.001 -9.712 51 HB VAL 28 HB VAL 28 4.191 4.287 -7.193 52 HG11 VAL 28 1HG1 VAL 28 5.145 2.042 -6.802 53 HG12 VAL 28 2HG1 VAL 28 4.219 2.075 -8.318 54 HG13 VAL 28 3HG1 VAL 28 5.999 2.113 -8.356 55 HG21 VAL 28 1HG2 VAL 28 6.256 5.597 -6.892 56 HG22 VAL 28 2HG2 VAL 28 6.287 4.092 -5.965 57 HG23 VAL 28 3HG2 VAL 28 7.220 4.210 -7.462 58 H THR 29 H THR 29 6.320 6.709 -9.059 59 HA THR 29 HA THR 29 4.292 8.662 -8.457 60 HB THR 29 HB THR 29 6.597 8.923 -7.854 61 HG1 THR 29 HG1 THR 29 6.691 11.111 -8.466 62 HG21 THR 29 1HG2 THR 29 8.367 9.469 -9.355 63 HG22 THR 29 2HG2 THR 29 7.266 9.632 -10.739 64 HG23 THR 29 3HG2 THR 29 7.622 8.036 -10.071 65 H SER 30 H SER 30 5.957 7.832 -11.547 66 HA SER 30 HA SER 30 4.568 9.595 -13.225 67 HB2 SER 30 2HB SER 30 5.476 6.810 -14.029 68 HB3 SER 30 3HB SER 30 5.377 8.272 -15.028 69 HG SER 30 HG SER 30 7.530 7.924 -14.426 70 H GLU 31 H GLU 31 3.543 6.402 -12.004 71 HA GLU 31 HA GLU 31 1.162 6.204 -13.591 72 HB2 GLU 31 2HB GLU 31 1.687 5.141 -10.778 73 HB3 GLU 31 3HB GLU 31 0.313 4.716 -11.794 74 HG2 GLU 31 2HG GLU 31 1.934 3.872 -13.535 75 HG3 GLU 31 3HG GLU 31 3.221 4.047 -12.331 76 H VAL 32 H VAL 32 1.827 8.265 -10.717 77 HA VAL 32 HA VAL 32 -0.979 8.669 -10.085 78 HB VAL 32 HB VAL 32 1.379 10.507 -9.455 79 HG11 VAL 32 1HG1 VAL 32 -0.090 11.289 -7.591 80 HG12 VAL 32 2HG1 VAL 32 -0.718 11.714 -9.180 81 HG13 VAL 32 3HG1 VAL 32 -1.432 10.355 -8.272 82 HG21 VAL 32 1HG2 VAL 32 0.115 8.267 -7.803 83 HG22 VAL 32 2HG2 VAL 32 1.752 8.279 -8.482 84 HG23 VAL 32 3HG2 VAL 32 1.327 9.421 -7.213 85 H GLY 33 H GLY 33 1.239 10.037 -12.446 86 HA2 GLY 33 HA2 GLY 33 -0.398 12.308 -13.265 87 HA3 GLY 33 HA3 GLY 33 0.984 11.584 -14.132 88 H ARG 34 H ARG 34 -0.792 8.954 -13.744 89 HA ARG 34 HA ARG 34 -2.639 9.331 -16.070 90 HB2 ARG 34 2HB ARG 34 -1.025 6.920 -15.170 91 HB3 ARG 34 3HB ARG 34 -2.152 6.939 -16.525 92 HG2 ARG 34 2HG ARG 34 0.441 8.550 -16.349 93 HG3 ARG 34 3HG ARG 34 0.249 6.990 -17.137 94 HD2 ARG 34 2HD ARG 34 0.136 8.519 -18.883 95 HD3 ARG 34 3HD ARG 34 -1.541 8.038 -18.593 96 HE ARG 34 HE ARG 34 -1.039 10.354 -17.061 97 HH11 ARG 34 1HH1 ARG 34 -1.202 9.615 -20.526 98 HH12 ARG 34 2HH1 ARG 34 -1.688 11.239 -20.926 99 HH21 ARG 34 1HH2 ARG 34 -1.699 12.347 -17.611 100 HH22 ARG 34 2HH2 ARG 34 -1.965 12.794 -19.274 101 H TYR 35 H TYR 35 -2.170 6.839 -13.581 102 HA TYR 35 HA TYR 35 -4.602 5.600 -13.934 103 HB2 TYR 35 2HB TYR 35 -2.585 5.621 -11.657 104 HB3 TYR 35 3HB TYR 35 -4.066 4.679 -11.538 105 HD1 TYR 35 HD1 TYR 35 -1.060 5.164 -13.751 106 HD2 TYR 35 HD2 TYR 35 -4.311 2.622 -12.567 107 HE1 TYR 35 HE1 TYR 35 -0.309 3.451 -15.380 108 HE2 TYR 35 HE2 TYR 35 -3.705 0.988 -14.315 109 HH TYR 35 HH TYR 35 -0.722 1.411 -16.316 110 H GLY 36 H GLY 36 -3.908 7.748 -11.213 111 HA2 GLY 36 HA2 GLY 36 -6.740 8.073 -10.499 112 HA3 GLY 36 HA3 GLY 36 -5.345 8.802 -9.701 113 H ALA 37 H ALA 37 -4.620 9.653 -12.740 114 HA ALA 37 HA ALA 37 -5.644 12.333 -12.421 115 HB1 ALA 37 1HB ALA 37 -3.358 11.854 -13.265 116 HB2 ALA 37 2HB ALA 37 -4.066 11.151 -14.735 117 HB3 ALA 37 3HB ALA 37 -4.304 12.863 -14.358 118 H ILE 38 H ILE 38 -6.366 9.484 -14.473 119 HA ILE 38 HA ILE 38 -8.121 10.815 -16.313 120 HB ILE 38 HB ILE 38 -8.842 8.626 -16.958 121 HG12 ILE 38 2HG1 ILE 38 -7.992 7.754 -14.190 122 HG13 ILE 38 3HG1 ILE 38 -9.582 7.655 -14.932 123 HG21 ILE 38 1HG2 ILE 38 -6.836 7.666 -17.608 124 HG22 ILE 38 2HG2 ILE 38 -6.281 9.286 -17.175 125 HG23 ILE 38 3HG2 ILE 38 -6.044 7.927 -16.053 126 HD11 ILE 38 1HD1 ILE 38 -7.169 5.917 -15.500 127 HD12 ILE 38 2HD1 ILE 38 -8.751 5.463 -14.849 128 HD13 ILE 38 3HD1 ILE 38 -8.636 5.961 -16.542 129 H TYR 39 H TYR 39 -8.644 9.749 -13.074 130 HA TYR 39 HA TYR 39 -11.559 10.071 -13.140 131 HB2 TYR 39 2HB TYR 39 -9.679 9.681 -10.784 132 HB3 TYR 39 3HB TYR 39 -11.424 9.614 -10.738 133 HD1 TYR 39 HD1 TYR 39 -12.670 7.800 -11.863 134 HD2 TYR 39 HD2 TYR 39 -8.399 7.726 -11.583 135 HE1 TYR 39 HE1 TYR 39 -12.604 5.469 -12.784 136 HE2 TYR 39 HE2 TYR 39 -8.341 5.293 -12.284 137 HH TYR 39 HH TYR 39 -9.681 3.560 -13.035 138 H THR 40 H THR 40 -8.836 11.777 -11.518 139 HA THR 40 HA THR 40 -10.417 13.859 -10.404 140 HB THR 40 HB THR 40 -8.055 12.990 -9.830 141 HG1 THR 40 HG1 THR 40 -7.674 15.024 -8.837 142 HG21 THR 40 1HG2 THR 40 -7.091 13.675 -12.068 143 HG22 THR 40 2HG2 THR 40 -6.156 14.111 -10.635 144 HG23 THR 40 3HG2 THR 40 -7.127 15.346 -11.486 145 H GLN 41 H GLN 41 -8.817 13.662 -13.540 146 HA GLN 41 HA GLN 41 -9.296 16.438 -14.261 147 HB2 GLN 41 2HB GLN 41 -8.462 13.978 -15.826 148 HB3 GLN 41 3HB GLN 41 -8.587 15.592 -16.527 149 HG2 GLN 41 2HG GLN 41 -6.665 14.778 -14.315 150 HG3 GLN 41 3HG GLN 41 -6.255 15.067 -16.000 151 HE21 GLN 41 1HE2 GLN 41 -5.011 16.405 -13.772 152 HE22 GLN 41 2HE2 GLN 41 -5.498 18.091 -13.834 153 H LEU 42 H LEU 42 -11.199 13.449 -14.514 154 HA LEU 42 HA LEU 42 -13.094 14.729 -16.349 155 HB2 LEU 42 2HB LEU 42 -12.740 12.241 -16.246 156 HB3 LEU 42 3HB LEU 42 -13.460 12.271 -14.625 157 HG LEU 42 HG LEU 42 -15.580 13.120 -15.553 158 HD11 LEU 42 1HD1 LEU 42 -14.211 12.863 -18.279 159 HD12 LEU 42 2HD1 LEU 42 -14.854 14.352 -17.557 160 HD13 LEU 42 3HD1 LEU 42 -15.964 13.072 -18.036 161 HD21 LEU 42 1HD2 LEU 42 -14.501 10.614 -16.866 162 HD22 LEU 42 2HD2 LEU 42 -16.224 11.071 -16.794 163 HD23 LEU 42 3HD2 LEU 42 -15.353 10.765 -15.295 164 H ILE 43 H ILE 43 -12.755 14.259 -12.848 165 HA ILE 43 HA ILE 43 -15.355 15.184 -12.096 166 HB ILE 43 HB ILE 43 -12.725 14.661 -10.720 167 HG12 ILE 43 2HG1 ILE 43 -14.256 13.354 -9.239 168 HG13 ILE 43 3HG1 ILE 43 -15.636 13.922 -10.207 169 HG21 ILE 43 1HG2 ILE 43 -13.320 16.787 -9.651 170 HG22 ILE 43 2HG2 ILE 43 -14.991 16.200 -9.401 171 HG23 ILE 43 3HG2 ILE 43 -13.628 15.436 -8.559 172 HD11 ILE 43 1HD1 ILE 43 -15.150 11.704 -10.871 173 HD12 ILE 43 2HD1 ILE 43 -14.555 12.721 -12.191 174 HD13 ILE 43 3HD1 ILE 43 -13.418 12.011 -11.007 175 H ARG 44 H ARG 44 -12.329 16.919 -12.494 176 HA ARG 44 HA ARG 44 -13.290 19.482 -11.535 177 HB2 ARG 44 2HB ARG 44 -11.170 20.334 -12.148 178 HB3 ARG 44 3HB ARG 44 -10.972 18.699 -11.551 179 HG2 ARG 44 2HG ARG 44 -9.517 18.637 -13.278 180 HG3 ARG 44 3HG ARG 44 -10.972 17.932 -13.975 181 HD2 ARG 44 2HD ARG 44 -10.094 19.389 -15.605 182 HD3 ARG 44 3HD ARG 44 -11.486 20.232 -14.945 183 HE ARG 44 HE ARG 44 -8.609 20.854 -14.501 184 HH11 ARG 44 1HH1 ARG 44 -11.955 22.009 -13.922 185 HH12 ARG 44 2HH1 ARG 44 -11.351 23.603 -13.545 186 HH21 ARG 44 1HH2 ARG 44 -8.028 22.925 -13.965 187 HH22 ARG 44 2HH2 ARG 44 -9.255 24.091 -13.508 188 H GLN 45 H GLN 45 -13.724 17.853 -14.520 189 HA GLN 45 HA GLN 45 -14.325 20.092 -16.301 190 HB2 GLN 45 2HB GLN 45 -15.711 17.400 -16.120 191 HB3 GLN 45 3HB GLN 45 -15.803 18.516 -17.470 192 HG2 GLN 45 2HG GLN 45 -13.446 16.875 -16.570 193 HG3 GLN 45 3HG GLN 45 -14.401 16.622 -18.021 194 HE21 GLN 45 1HE2 GLN 45 -11.430 17.255 -17.420 195 HE22 GLN 45 2HE2 GLN 45 -11.096 18.446 -18.669 196 H ASN 46 H ASN 46 -16.161 18.292 -13.785 197 HA ASN 46 HA ASN 46 -18.604 19.890 -14.266 198 HB2 ASN 46 2HB ASN 46 -17.938 18.170 -11.848 199 HB3 ASN 46 3HB ASN 46 -19.519 18.709 -12.388 200 HD21 ASN 46 1HD2 ASN 46 -17.095 16.280 -12.677 201 HD22 ASN 46 2HD2 ASN 46 -18.087 15.264 -13.731 202 H LEU 47 H LEU 47 -15.979 19.656 -11.875 203 HA LEU 47 HA LEU 47 -16.994 21.907 -10.298 204 HB2 LEU 47 2HB LEU 47 -14.518 20.205 -9.935 205 HB3 LEU 47 3HB LEU 47 -15.342 21.231 -8.772 206 HG LEU 47 HG LEU 47 -16.426 18.690 -9.876 207 HD11 LEU 47 1HD1 LEU 47 -15.948 17.967 -7.598 208 HD12 LEU 47 2HD1 LEU 47 -15.338 19.603 -7.227 209 HD13 LEU 47 3HD1 LEU 47 -14.501 18.599 -8.426 210 HD21 LEU 47 1HD2 LEU 47 -17.668 20.699 -7.947 211 HD22 LEU 47 2HD2 LEU 47 -18.178 18.997 -8.030 212 HD23 LEU 47 3HD2 LEU 47 -18.374 20.054 -9.441 213 H LEU 48 H LEU 48 -16.686 23.230 -12.122 214 HA LEU 48 HA LEU 48 -14.053 24.253 -12.813 215 HB2 LEU 48 2HB LEU 48 -15.359 26.021 -14.066 216 HB3 LEU 48 3HB LEU 48 -15.591 24.352 -14.532 217 HG LEU 48 HG LEU 48 -17.758 24.247 -13.449 218 HD11 LEU 48 1HD1 LEU 48 -18.874 26.266 -12.544 219 HD12 LEU 48 2HD1 LEU 48 -17.352 27.167 -12.668 220 HD13 LEU 48 3HD1 LEU 48 -17.496 25.790 -11.547 221 HD21 LEU 48 1HD2 LEU 48 -18.963 25.753 -14.959 222 HD22 LEU 48 2HD2 LEU 48 -17.572 25.022 -15.777 223 HD23 LEU 48 3HD2 LEU 48 -17.477 26.704 -15.218 224 H VAL 49 H VAL 49 -14.410 24.249 -10.040 225 HA VAL 49 HA VAL 49 -15.241 26.969 -9.229 226 HB VAL 49 HB VAL 49 -14.567 24.721 -7.349 227 HG11 VAL 49 1HG1 VAL 49 -16.218 27.261 -7.034 228 HG12 VAL 49 2HG1 VAL 49 -15.994 26.006 -5.792 229 HG13 VAL 49 3HG1 VAL 49 -14.612 26.965 -6.341 230 HG21 VAL 49 1HG2 VAL 49 -17.269 25.435 -8.562 231 HG22 VAL 49 2HG2 VAL 49 -16.382 23.909 -8.796 232 HG23 VAL 49 3HG2 VAL 49 -17.011 24.315 -7.199 233 H GLU 50 H GLU 50 -12.599 24.925 -8.004 234 HA GLU 50 HA GLU 50 -10.380 25.151 -7.814 235 HB2 GLU 50 2HB GLU 50 -10.506 27.694 -9.457 236 HB3 GLU 50 3HB GLU 50 -9.111 26.669 -9.116 237 HG2 GLU 50 2HG GLU 50 -10.206 24.781 -10.322 238 HG3 GLU 50 3HG GLU 50 -11.553 25.842 -10.734 239 H ASP 51 H ASP 51 -11.915 28.364 -7.328 240 HA ASP 51 HA ASP 51 -10.001 29.277 -5.409 241 HB2 ASP 51 2HB ASP 51 -11.580 30.650 -6.827 242 HB3 ASP 51 3HB ASP 51 -12.891 30.164 -5.742 243 H SER 52 H SER 52 -12.804 27.257 -5.091 244 HA SER 52 HA SER 52 -12.804 27.248 -2.118 245 HB2 SER 52 2HB SER 52 -14.356 25.629 -4.187 246 HB3 SER 52 3HB SER 52 -14.578 25.527 -2.436 247 HG SER 52 HG SER 52 -14.852 27.975 -3.883 248 H PHE 53 H PHE 53 -10.858 25.821 -4.481 249 HA PHE 53 HA PHE 53 -10.497 23.253 -3.018 250 HB2 PHE 53 2HB PHE 53 -9.834 23.975 -5.877 251 HB3 PHE 53 3HB PHE 53 -9.661 22.398 -5.125 252 HD1 PHE 53 HD1 PHE 53 -11.241 23.023 -7.689 253 HD2 PHE 53 HD2 PHE 53 -12.491 22.724 -3.563 254 HE1 PHE 53 HE1 PHE 53 -13.441 22.267 -8.392 255 HE2 PHE 53 HE2 PHE 53 -14.735 22.049 -4.281 256 HZ PHE 53 HZ PHE 53 -15.219 21.768 -6.721 257 H ARG 54 H ARG 54 -8.931 26.211 -3.929 258 HA ARG 54 HA ARG 54 -6.217 25.284 -3.307 259 HB2 ARG 54 2HB ARG 54 -5.466 27.329 -4.178 260 HB3 ARG 54 3HB ARG 54 -6.689 26.658 -5.264 261 HG2 ARG 54 2HG ARG 54 -8.344 28.271 -4.374 262 HG3 ARG 54 3HG ARG 54 -7.154 28.901 -3.241 263 HD2 ARG 54 2HD ARG 54 -7.301 30.397 -5.130 264 HD3 ARG 54 3HD ARG 54 -5.711 29.619 -5.092 265 HE ARG 54 HE ARG 54 -6.348 28.172 -6.897 266 HH11 ARG 54 1HH1 ARG 54 -8.606 30.882 -6.499 267 HH12 ARG 54 2HH1 ARG 54 -9.054 30.842 -8.180 268 HH21 ARG 54 1HH2 ARG 54 -6.989 28.180 -9.013 269 HH22 ARG 54 2HH2 ARG 54 -8.160 29.326 -9.583 270 H GLY 55 H GLY 55 -4.840 26.347 -1.840 271 HA2 GLY 55 HA2 GLY 55 -4.221 27.544 0.092 272 HA3 GLY 55 HA3 GLY 55 -5.911 28.064 0.320 273 H LYS 56 H LYS 56 -6.317 24.900 -0.066 274 HA LYS 56 HA LYS 56 -5.542 23.955 2.634 275 HB2 LYS 56 2HB LYS 56 -7.844 23.006 2.889 276 HB3 LYS 56 3HB LYS 56 -7.751 24.755 2.932 277 HG2 LYS 56 2HG LYS 56 -9.698 24.179 1.737 278 HG3 LYS 56 3HG LYS 56 -8.588 24.877 0.586 279 HD2 LYS 56 2HD LYS 56 -8.085 22.732 -0.385 280 HD3 LYS 56 3HD LYS 56 -8.916 21.848 0.919 281 HE2 LYS 56 2HE LYS 56 -10.163 23.709 -1.118 282 HE3 LYS 56 3HE LYS 56 -10.172 21.931 -1.205 283 HZ1 LYS 56 HZ1 LYS 56 -11.665 21.876 0.661 284 HZ2 LYS 56 HZ2 LYS 56 -12.235 23.038 -0.376 285 HZ3 LYS 56 HZ3 LYS 56 -11.481 23.466 0.995 286 H GLN 57 H GLN 57 -6.482 21.412 2.585 287 HA GLN 57 HA GLN 57 -5.602 20.196 0.002 288 HB2 GLN 57 2HB GLN 57 -3.979 18.897 1.003 289 HB3 GLN 57 3HB GLN 57 -3.867 20.318 1.981 290 HG2 GLN 57 2HG GLN 57 -3.938 18.824 3.664 291 HG3 GLN 57 3HG GLN 57 -5.679 19.045 3.460 292 HE21 GLN 57 1HE2 GLN 57 -4.205 17.079 1.017 293 HE22 GLN 57 2HE2 GLN 57 -4.867 15.586 1.674 294 H CYS 58 H CYS 58 -6.338 17.920 -0.231 295 HA CYS 58 HA CYS 58 -8.355 16.915 1.630 296 HB2 CYS 58 2HB CYS 58 -9.690 18.457 0.241 297 HB3 CYS 58 3HB CYS 58 -9.048 17.714 -1.231 298 HG CYS 58 HG CYS 58 -10.090 15.376 -0.952 299 H ARG 59 H ARG 59 -8.461 14.717 1.554 300 HA ARG 59 HA ARG 59 -7.363 13.253 -0.745 301 HB2 ARG 59 2HB ARG 59 -6.490 11.511 0.681 302 HB3 ARG 59 3HB ARG 59 -5.623 12.999 0.916 303 HG2 ARG 59 2HG ARG 59 -7.811 12.396 2.888 304 HG3 ARG 59 3HG ARG 59 -6.397 11.363 2.872 305 HD2 ARG 59 2HD ARG 59 -5.077 13.630 3.059 306 HD3 ARG 59 3HD ARG 59 -6.673 14.272 3.533 307 HE ARG 59 HE ARG 59 -6.001 11.851 4.967 308 HH11 ARG 59 1HH1 ARG 59 -5.357 15.335 5.062 309 HH12 ARG 59 2HH1 ARG 59 -4.857 15.273 6.734 310 HH21 ARG 59 1HH2 ARG 59 -5.373 11.865 7.111 311 HH22 ARG 59 2HH2 ARG 59 -4.922 13.356 7.886 312 H VAL 60 H VAL 60 -8.786 11.806 -1.551 313 HA VAL 60 HA VAL 60 -10.718 10.476 0.245 314 HB VAL 60 HB VAL 60 -12.645 10.849 -1.193 315 HG11 VAL 60 1HG1 VAL 60 -11.466 13.548 -0.426 316 HG12 VAL 60 2HG1 VAL 60 -13.181 13.129 -0.593 317 HG13 VAL 60 3HG1 VAL 60 -12.211 12.434 0.724 318 HG21 VAL 60 1HG2 VAL 60 -10.936 12.815 -2.756 319 HG22 VAL 60 2HG2 VAL 60 -11.484 11.221 -3.342 320 HG23 VAL 60 3HG2 VAL 60 -12.674 12.501 -2.982 321 H ASN 61 H ASN 61 -11.860 8.660 -1.095 322 HA ASN 61 HA ASN 61 -9.998 7.632 -3.142 323 HB2 ASN 61 2HB ASN 61 -9.354 6.640 -1.043 324 HB3 ASN 61 3HB ASN 61 -11.003 6.276 -0.605 325 HD21 ASN 61 1HD2 ASN 61 -12.176 4.664 -2.045 326 HD22 ASN 61 2HD2 ASN 61 -11.202 3.369 -2.736 327 H LEU 62 H LEU 62 -10.822 6.689 -4.867 328 HA LEU 62 HA LEU 62 -13.822 6.435 -5.060 329 HB2 LEU 62 2HB LEU 62 -11.588 7.105 -6.972 330 HB3 LEU 62 3HB LEU 62 -13.006 6.262 -7.588 331 HG LEU 62 HG LEU 62 -14.473 8.070 -6.860 332 HD11 LEU 62 1HD1 LEU 62 -11.923 9.454 -5.872 333 HD12 LEU 62 2HD1 LEU 62 -13.309 8.967 -4.884 334 HD13 LEU 62 3HD1 LEU 62 -13.486 10.259 -6.075 335 HD21 LEU 62 1HD2 LEU 62 -13.604 9.787 -8.475 336 HD22 LEU 62 2HD2 LEU 62 -13.453 8.135 -9.098 337 HD23 LEU 62 3HD2 LEU 62 -12.031 8.972 -8.454 338 H LYS 63 H LYS 63 -14.722 4.534 -5.326 339 HA LYS 63 HA LYS 63 -13.064 2.146 -6.067 340 HB2 LYS 63 2HB LYS 63 -15.610 2.238 -4.386 341 HB3 LYS 63 3HB LYS 63 -14.655 0.814 -4.787 342 HG2 LYS 63 2HG LYS 63 -12.729 1.774 -3.490 343 HG3 LYS 63 3HG LYS 63 -13.749 3.175 -3.071 344 HD2 LYS 63 2HD LYS 63 -15.357 1.655 -1.955 345 HD3 LYS 63 3HD LYS 63 -14.305 0.275 -2.325 346 HE2 LYS 63 2HE LYS 63 -12.480 1.285 -1.009 347 HE3 LYS 63 3HE LYS 63 -13.464 2.728 -0.715 348 HZ1 LYS 63 HZ1 LYS 63 -14.128 -0.003 0.249 349 HZ2 LYS 63 HZ2 LYS 63 -15.017 1.351 0.528 350 HZ3 LYS 63 HZ3 LYS 63 -13.527 1.212 1.168 351 H LEU 64 H LEU 64 -13.396 2.008 -8.299 352 HA LEU 64 HA LEU 64 -16.138 2.445 -9.328 353 HB2 LEU 64 2HB LEU 64 -13.582 2.080 -10.907 354 HB3 LEU 64 3HB LEU 64 -15.146 2.610 -11.488 355 HG LEU 64 HG LEU 64 -14.031 4.509 -11.562 356 HD11 LEU 64 1HD1 LEU 64 -15.158 4.726 -8.751 357 HD12 LEU 64 2HD1 LEU 64 -15.988 4.987 -10.309 358 HD13 LEU 64 3HD1 LEU 64 -14.695 6.065 -9.810 359 HD21 LEU 64 1HD2 LEU 64 -11.966 3.746 -10.626 360 HD22 LEU 64 2HD2 LEU 64 -12.593 3.937 -8.964 361 HD23 LEU 64 3HD2 LEU 64 -12.388 5.355 -10.012 362 H ILE 65 H ILE 65 -16.932 1.080 -10.953 363 HA ILE 65 HA ILE 65 -16.099 -1.808 -10.818 364 HB ILE 65 HB ILE 65 -18.297 -2.161 -12.047 365 HG12 ILE 65 2HG1 ILE 65 -19.111 0.467 -10.750 366 HG13 ILE 65 3HG1 ILE 65 -18.691 0.368 -12.457 367 HG21 ILE 65 1HG2 ILE 65 -18.335 -1.237 -9.136 368 HG22 ILE 65 2HG2 ILE 65 -19.501 -2.332 -9.896 369 HG23 ILE 65 3HG2 ILE 65 -17.819 -2.840 -9.712 370 HD11 ILE 65 1HD1 ILE 65 -21.063 0.288 -12.234 371 HD12 ILE 65 2HD1 ILE 65 -20.474 -1.294 -12.803 372 HD13 ILE 65 3HD1 ILE 65 -20.981 -1.083 -11.105 373 HA PRO 66 HA PRO 66 -14.212 -0.944 -14.856 374 HB2 PRO 66 2HB PRO 66 -14.186 -3.971 -14.839 375 HB3 PRO 66 3HB PRO 66 -12.922 -2.832 -15.403 376 HG2 PRO 66 2HG PRO 66 -12.688 -4.002 -12.972 377 HG3 PRO 66 3HG PRO 66 -12.348 -2.250 -13.143 378 HD2 PRO 66 2HD PRO 66 -14.886 -3.578 -12.139 379 HD3 PRO 66 3HD PRO 66 -14.001 -2.180 -11.459 380 H THR 67 H THR 67 -15.312 -0.574 -16.676 381 HA THR 67 HA THR 67 -17.783 -2.088 -17.410 382 HB THR 67 HB THR 67 -17.638 0.908 -16.883 383 HG1 THR 67 HG1 THR 67 -17.785 -0.277 -14.971 384 HG21 THR 67 1HG2 THR 67 -20.095 0.815 -17.249 385 HG22 THR 67 2HG2 THR 67 -19.949 -0.882 -17.761 386 HG23 THR 67 3HG2 THR 67 -19.191 0.422 -18.711 387 H GLY 68 H GLY 68 -16.751 -2.817 -19.227 388 HA2 GLY 68 HA2 GLY 68 -16.061 -2.802 -21.459 389 HA3 GLY 68 HA3 GLY 68 -16.771 -1.182 -21.565 390 H THR 69 H THR 69 -15.365 0.231 -22.313 391 HA THR 69 HA THR 69 -12.450 0.019 -21.988 392 HB THR 69 HB THR 69 -12.514 2.114 -23.424 393 HG1 THR 69 HG1 THR 69 -14.543 2.608 -24.317 394 HG21 THR 69 1HG2 THR 69 -13.200 0.951 -25.472 395 HG22 THR 69 2HG2 THR 69 -14.038 -0.301 -24.529 396 HG23 THR 69 3HG2 THR 69 -12.272 -0.137 -24.433 397 H GLY 70 H GLY 70 -14.719 1.088 -19.851 398 HA2 GLY 70 HA2 GLY 70 -12.851 3.085 -18.655 399 HA3 GLY 70 HA3 GLY 70 -14.573 3.401 -18.775 400 H ALA 71 H ALA 71 -14.125 3.727 -16.397 401 HA ALA 71 HA ALA 71 -15.306 1.316 -15.140 402 HB1 ALA 71 1HB ALA 71 -13.551 3.236 -13.578 403 HB2 ALA 71 2HB ALA 71 -14.140 1.611 -13.123 404 HB3 ALA 71 3HB ALA 71 -12.911 1.766 -14.351 405 H LEU 72 H LEU 72 -16.799 1.910 -13.346 406 HA LEU 72 HA LEU 72 -18.089 4.610 -13.606 407 HB2 LEU 72 2HB LEU 72 -19.126 2.010 -14.365 408 HB3 LEU 72 3HB LEU 72 -19.958 2.478 -12.903 409 HG LEU 72 HG LEU 72 -20.653 4.619 -13.966 410 HD11 LEU 72 1HD1 LEU 72 -19.152 3.470 -16.361 411 HD12 LEU 72 2HD1 LEU 72 -18.876 5.022 -15.535 412 HD13 LEU 72 3HD1 LEU 72 -20.353 4.772 -16.480 413 HD21 LEU 72 1HD2 LEU 72 -22.265 3.603 -15.544 414 HD22 LEU 72 2HD2 LEU 72 -22.094 2.623 -14.069 415 HD23 LEU 72 3HD2 LEU 72 -21.300 2.106 -15.582 416 H LEU 73 H LEU 73 -18.948 5.508 -11.686 417 HA LEU 73 HA LEU 73 -17.709 4.742 -9.288 418 HB2 LEU 73 2HB LEU 73 -18.547 7.003 -9.948 419 HB3 LEU 73 3HB LEU 73 -20.180 6.489 -9.567 420 HG LEU 73 HG LEU 73 -18.989 7.903 -7.852 421 HD11 LEU 73 1HD1 LEU 73 -20.967 6.562 -7.230 422 HD12 LEU 73 2HD1 LEU 73 -19.821 6.780 -5.893 423 HD13 LEU 73 3HD1 LEU 73 -19.912 5.231 -6.748 424 HD21 LEU 73 1HD2 LEU 73 -17.307 6.980 -6.411 425 HD22 LEU 73 2HD2 LEU 73 -16.760 6.748 -8.075 426 HD23 LEU 73 3HD2 LEU 73 -17.428 5.380 -7.163 427 H GLY 74 H GLY 74 -17.874 3.017 -8.185 428 HA2 GLY 74 HA2 GLY 74 -20.469 1.640 -7.715 429 HA3 GLY 74 HA3 GLY 74 -18.826 1.030 -7.374 430 H SER 75 H SER 75 -17.805 3.343 -5.984 431 HA SER 75 HA SER 75 -19.563 4.227 -3.872 432 HB2 SER 75 2HB SER 75 -17.659 1.945 -3.327 433 HB3 SER 75 3HB SER 75 -17.940 3.168 -2.082 434 HG SER 75 HG SER 75 -20.036 1.737 -3.374 435 H LEU 76 H LEU 76 -18.558 5.803 -2.511 436 HA LEU 76 HA LEU 76 -15.779 6.592 -3.216 437 HB2 LEU 76 2HB LEU 76 -17.507 7.970 -4.408 438 HB3 LEU 76 3HB LEU 76 -18.113 8.536 -2.867 439 HG LEU 76 HG LEU 76 -15.150 8.832 -3.380 440 HD11 LEU 76 1HD1 LEU 76 -15.984 9.489 -5.530 441 HD12 LEU 76 2HD1 LEU 76 -15.588 10.961 -4.638 442 HD13 LEU 76 3HD1 LEU 76 -17.282 10.432 -4.818 443 HD21 LEU 76 1HD2 LEU 76 -15.440 10.973 -2.220 444 HD22 LEU 76 2HD2 LEU 76 -16.129 9.665 -1.247 445 HD23 LEU 76 3HD2 LEU 76 -17.204 10.731 -2.174 446 H THR 77 H THR 77 -14.549 6.901 -1.535 447 HA THR 77 HA THR 77 -15.665 6.828 1.256 448 HB THR 77 HB THR 77 -13.032 5.802 0.088 449 HG1 THR 77 HG1 THR 77 -15.115 4.638 -0.147 450 HG21 THR 77 1HG2 THR 77 -12.611 6.612 2.356 451 HG22 THR 77 2HG2 THR 77 -12.652 4.851 2.355 452 HG23 THR 77 3HG2 THR 77 -14.054 5.757 2.966 453 H VAL 78 H VAL 78 -15.457 8.796 2.225 454 HA VAL 78 HA VAL 78 -13.362 10.699 1.340 455 HB VAL 78 HB VAL 78 -14.196 12.235 3.056 456 HG11 VAL 78 1HG1 VAL 78 -15.005 12.350 0.738 457 HG12 VAL 78 2HG1 VAL 78 -16.305 11.208 1.109 458 HG13 VAL 78 3HG1 VAL 78 -16.285 12.808 1.880 459 HG21 VAL 78 1HG2 VAL 78 -15.168 10.711 4.700 460 HG22 VAL 78 2HG2 VAL 78 -16.390 11.842 4.110 461 HG23 VAL 78 3HG2 VAL 78 -16.387 10.164 3.514 462 H LEU 79 H LEU 79 -11.391 10.993 2.334 463 HA LEU 79 HA LEU 79 -10.804 9.245 4.695 464 HB2 LEU 79 2HB LEU 79 -8.938 10.517 2.667 465 HB3 LEU 79 3HB LEU 79 -8.451 9.494 3.999 466 HG LEU 79 HG LEU 79 -10.236 8.593 1.681 467 HD11 LEU 79 1HD1 LEU 79 -8.214 7.428 0.863 468 HD12 LEU 79 2HD1 LEU 79 -7.251 8.206 2.134 469 HD13 LEU 79 3HD1 LEU 79 -8.016 9.195 0.875 470 HD21 LEU 79 1HD2 LEU 79 -8.814 6.982 3.855 471 HD22 LEU 79 2HD2 LEU 79 -9.694 6.306 2.473 472 HD23 LEU 79 3HD2 LEU 79 -10.565 7.227 3.712 473 H ASP 80 H ASP 80 -10.072 12.528 3.421 474 HA ASP 80 HA ASP 80 -11.077 13.919 5.613 475 HB2 ASP 80 2HB ASP 80 -8.826 12.897 6.704 476 HB3 ASP 80 3HB ASP 80 -8.092 14.185 5.774 477 H GLY 81 H GLY 81 -10.549 16.282 5.505 478 HA2 GLY 81 HA2 GLY 81 -8.908 17.647 3.783 479 HA3 GLY 81 HA3 GLY 81 -10.273 17.226 2.758 480 H ASP 82 H ASP 82 -10.121 19.727 2.790 481 HA ASP 82 HA ASP 82 -11.778 20.891 4.963 482 HB2 ASP 82 2HB ASP 82 -9.930 22.249 4.206 483 HB3 ASP 82 3HB ASP 82 -10.431 22.110 2.539 484 H SER 83 H SER 83 -13.806 20.414 4.838 485 HA SER 83 HA SER 83 -14.504 18.445 3.091 486 HB2 SER 83 2HB SER 83 -16.678 18.416 4.280 487 HB3 SER 83 3HB SER 83 -15.285 18.545 5.365 488 HG SER 83 HG SER 83 -16.993 20.023 5.907 489 H ARG 84 H ARG 84 -15.109 21.753 2.404 490 HA ARG 84 HA ARG 84 -17.349 21.544 0.669 491 HB2 ARG 84 2HB ARG 84 -16.341 23.619 1.519 492 HB3 ARG 84 3HB ARG 84 -14.930 23.378 0.490 493 HG2 ARG 84 2HG ARG 84 -16.227 23.697 -1.514 494 HG3 ARG 84 3HG ARG 84 -17.761 23.580 -0.628 495 HD2 ARG 84 2HD ARG 84 -17.291 25.692 0.538 496 HD3 ARG 84 3HD ARG 84 -15.671 25.745 -0.161 497 HE ARG 84 HE ARG 84 -16.478 26.581 -2.115 498 HH11 ARG 84 1HH1 ARG 84 -19.335 25.401 -0.384 499 HH12 ARG 84 2HH1 ARG 84 -20.409 26.110 -1.553 500 HH21 ARG 84 1HH2 ARG 84 -17.856 27.433 -3.526 501 HH22 ARG 84 2HH2 ARG 84 -19.581 27.294 -3.313 502 H LEU 85 H LEU 85 -13.902 20.589 0.114 503 HA LEU 85 HA LEU 85 -14.448 20.059 -2.733 504 HB2 LEU 85 2HB LEU 85 -12.277 20.814 -2.151 505 HB3 LEU 85 3HB LEU 85 -12.054 19.506 -0.973 506 HG LEU 85 HG LEU 85 -11.877 17.859 -2.683 507 HD11 LEU 85 1HD1 LEU 85 -12.436 19.957 -4.839 508 HD12 LEU 85 2HD1 LEU 85 -13.557 18.664 -4.403 509 HD13 LEU 85 3HD1 LEU 85 -11.984 18.269 -5.099 510 HD21 LEU 85 1HD2 LEU 85 -9.888 18.607 -3.819 511 HD22 LEU 85 2HD2 LEU 85 -9.908 19.406 -2.225 512 HD23 LEU 85 3HD2 LEU 85 -10.361 20.316 -3.667 513 H CYS 86 H CYS 86 -13.896 17.857 0.162 514 HA CYS 86 HA CYS 86 -14.666 15.467 -0.875 515 HB2 CYS 86 2HB CYS 86 -15.789 16.577 1.742 516 HB3 CYS 86 3HB CYS 86 -15.549 14.885 1.303 517 HG CYS 86 HG CYS 86 -13.755 15.537 3.101 518 H ALA 87 H ALA 87 -17.026 18.023 0.100 519 HA ALA 87 HA ALA 87 -19.372 16.565 -0.678 520 HB1 ALA 87 1HB ALA 87 -19.352 18.496 0.877 521 HB2 ALA 87 2HB ALA 87 -18.872 19.574 -0.453 522 HB3 ALA 87 3HB ALA 87 -20.462 18.775 -0.478 523 H ALA 88 H ALA 88 -17.475 19.050 -2.491 524 HA ALA 88 HA ALA 88 -19.150 19.050 -4.781 525 HB1 ALA 88 1HB ALA 88 -16.184 19.767 -4.486 526 HB2 ALA 88 2HB ALA 88 -17.271 20.298 -5.787 527 HB3 ALA 88 3HB ALA 88 -17.556 20.837 -4.126 528 H THR 89 H THR 89 -16.050 17.283 -4.281 529 HA THR 89 HA THR 89 -16.018 15.982 -6.832 530 HB THR 89 HB THR 89 -14.072 16.209 -5.324 531 HG1 THR 89 HG1 THR 89 -13.300 14.172 -5.991 532 HG21 THR 89 1HG2 THR 89 -15.037 13.678 -3.945 533 HG22 THR 89 2HG2 THR 89 -15.273 15.274 -3.225 534 HG23 THR 89 3HG2 THR 89 -13.630 14.702 -3.554 535 H LYS 90 H LYS 90 -17.340 14.880 -3.720 536 HA LYS 90 HA LYS 90 -18.149 12.288 -4.417 537 HB2 LYS 90 2HB LYS 90 -18.057 13.165 -2.170 538 HB3 LYS 90 3HB LYS 90 -19.273 14.385 -2.554 539 HG2 LYS 90 2HG LYS 90 -20.784 12.202 -3.007 540 HG3 LYS 90 3HG LYS 90 -19.582 11.461 -1.936 541 HD2 LYS 90 2HD LYS 90 -21.149 14.013 -1.372 542 HD3 LYS 90 3HD LYS 90 -21.605 12.399 -0.776 543 HE2 LYS 90 2HE LYS 90 -19.383 12.258 0.395 544 HE3 LYS 90 3HE LYS 90 -19.036 13.925 -0.103 545 HZ1 LYS 90 HZ1 LYS 90 -21.302 13.074 1.622 546 HZ2 LYS 90 HZ2 LYS 90 -21.016 14.615 1.160 547 HZ3 LYS 90 HZ3 LYS 90 -19.954 13.834 2.136 548 H ARG 91 H ARG 91 -19.948 15.327 -4.749 549 HA ARG 91 HA ARG 91 -22.235 14.107 -6.008 550 HB2 ARG 91 2HB ARG 91 -21.214 16.988 -6.008 551 HB3 ARG 91 3HB ARG 91 -22.752 16.519 -6.728 552 HG2 ARG 91 2HG ARG 91 -22.048 16.160 -3.781 553 HG3 ARG 91 3HG ARG 91 -23.005 17.481 -4.456 554 HD2 ARG 91 2HD ARG 91 -24.650 15.783 -5.315 555 HD3 ARG 91 3HD ARG 91 -23.711 14.516 -4.503 556 HE ARG 91 HE ARG 91 -24.299 16.535 -2.608 557 HH11 ARG 91 1HH1 ARG 91 -26.082 14.086 -4.435 558 HH12 ARG 91 2HH1 ARG 91 -27.308 13.941 -3.204 559 HH21 ARG 91 1HH2 ARG 91 -25.918 16.299 -1.075 560 HH22 ARG 91 2HH2 ARG 91 -27.232 15.188 -1.347 561 H ALA 92 H ALA 92 -19.400 15.746 -7.450 562 HA ALA 92 HA ALA 92 -20.172 15.518 -10.176 563 HB1 ALA 92 1HB ALA 92 -17.766 15.857 -10.627 564 HB2 ALA 92 2HB ALA 92 -18.371 16.969 -9.393 565 HB3 ALA 92 3HB ALA 92 -17.390 15.570 -8.916 566 H VAL 93 H VAL 93 -18.136 13.297 -8.228 567 HA VAL 93 HA VAL 93 -17.774 11.364 -10.256 568 HB VAL 93 HB VAL 93 -17.860 10.572 -7.345 569 HG11 VAL 93 1HG1 VAL 93 -15.915 9.834 -9.558 570 HG12 VAL 93 2HG1 VAL 93 -16.088 9.061 -7.975 571 HG13 VAL 93 3HG1 VAL 93 -17.356 8.888 -9.187 572 HG21 VAL 93 1HG2 VAL 93 -16.304 12.038 -6.746 573 HG22 VAL 93 2HG2 VAL 93 -15.179 11.387 -7.957 574 HG23 VAL 93 3HG2 VAL 93 -16.240 12.725 -8.375 575 H ALA 94 H ALA 94 -20.514 11.947 -8.209 576 HA ALA 94 HA ALA 94 -21.776 9.309 -8.621 577 HB1 ALA 94 1HB ALA 94 -23.614 10.258 -7.328 578 HB2 ALA 94 2HB ALA 94 -22.073 10.546 -6.502 579 HB3 ALA 94 3HB ALA 94 -22.859 11.873 -7.386 580 H GLN 95 H GLN 95 -21.350 12.077 -10.561 581 HA GLN 95 HA GLN 95 -23.772 11.401 -12.194 582 HB2 GLN 95 2HB GLN 95 -24.240 13.741 -12.516 583 HB3 GLN 95 3HB GLN 95 -24.201 13.342 -10.796 584 HG2 GLN 95 2HG GLN 95 -22.998 15.377 -10.830 585 HG3 GLN 95 3HG GLN 95 -21.783 14.200 -10.830 586 HE21 GLN 95 1HE2 GLN 95 -20.217 14.354 -12.476 587 HE22 GLN 95 2HE2 GLN 95 -20.428 15.459 -13.847 588 H VAL 96 H VAL 96 -20.340 11.892 -12.272 589 HA VAL 96 HA VAL 96 -19.963 12.597 -14.981 590 HB VAL 96 HB VAL 96 -17.860 11.218 -14.844 591 HG11 VAL 96 1HG1 VAL 96 -18.099 13.099 -12.491 592 HG12 VAL 96 2HG1 VAL 96 -16.677 12.705 -13.436 593 HG13 VAL 96 3HG1 VAL 96 -17.982 13.627 -14.194 594 HG21 VAL 96 1HG2 VAL 96 -18.943 10.558 -12.103 595 HG22 VAL 96 2HG2 VAL 96 -18.299 9.456 -13.336 596 HG23 VAL 96 3HG2 VAL 96 -17.229 10.579 -12.459 597 H ASN 97 H ASN 97 -19.637 11.471 -16.897 598 HA ASN 97 HA ASN 97 -21.558 9.448 -17.411 599 HB2 ASN 97 2HB ASN 97 -20.752 11.204 -18.982 600 HB3 ASN 97 3HB ASN 97 -19.224 10.342 -19.156 601 HD21 ASN 97 1HD2 ASN 97 -19.326 8.091 -20.179 602 HD22 ASN 97 2HD2 ASN 97 -20.673 7.795 -21.264 603 H SER 98 H SER 98 -17.976 9.204 -17.315 604 HA SER 98 HA SER 98 -17.592 6.625 -16.347 605 HB2 SER 98 2HB SER 98 -16.965 5.389 -18.439 606 HB3 SER 98 3HB SER 98 -18.703 5.595 -18.226 607 HG SER 98 HG SER 98 -17.880 6.034 -20.389 608 H PHE 99 H PHE 99 -15.436 6.125 -16.182 609 HA PHE 99 HA PHE 99 -13.553 8.296 -16.910 610 HB2 PHE 99 2HB PHE 99 -13.050 5.884 -15.148 611 HB3 PHE 99 3HB PHE 99 -12.167 7.405 -15.200 612 HD1 PHE 99 HD1 PHE 99 -14.878 5.554 -13.663 613 HD2 PHE 99 HD2 PHE 99 -13.427 9.547 -14.451 614 HE1 PHE 99 HE1 PHE 99 -16.404 6.458 -11.939 615 HE2 PHE 99 HE2 PHE 99 -14.917 10.429 -12.694 616 HZ PHE 99 HZ PHE 99 -16.395 8.845 -11.421 617 HA PRO 100 HA PRO 100 -12.366 5.256 -20.104 618 HB2 PRO 100 2HB PRO 100 -10.908 6.847 -21.784 619 HB3 PRO 100 3HB PRO 100 -12.687 6.927 -21.673 620 HG2 PRO 100 2HG PRO 100 -10.657 8.731 -20.319 621 HG3 PRO 100 3HG PRO 100 -12.141 9.193 -21.219 622 HD2 PRO 100 2HD PRO 100 -12.061 8.988 -18.479 623 HD3 PRO 100 3HD PRO 100 -13.529 8.602 -19.435 624 H LEU 101 H LEU 101 -10.685 3.783 -19.918 625 HA LEU 101 HA LEU 101 -8.472 4.454 -18.190 626 HB2 LEU 101 2HB LEU 101 -8.833 1.872 -19.715 627 HB3 LEU 101 3HB LEU 101 -7.960 2.125 -18.209 628 HG LEU 101 HG LEU 101 -10.952 2.128 -18.702 629 HD11 LEU 101 1HD1 LEU 101 -10.999 0.226 -17.176 630 HD12 LEU 101 2HD1 LEU 101 -9.225 0.297 -17.051 631 HD13 LEU 101 3HD1 LEU 101 -9.989 -0.069 -18.606 632 HD21 LEU 101 1HD2 LEU 101 -10.707 3.871 -17.061 633 HD22 LEU 101 2HD2 LEU 101 -9.498 2.956 -16.174 634 HD23 LEU 101 3HD2 LEU 101 -11.201 2.431 -16.187 635 HA PRO 102 HA PRO 102 -5.544 5.222 -21.524 636 HB2 PRO 102 2HB PRO 102 -3.161 5.032 -20.215 637 HB3 PRO 102 3HB PRO 102 -4.302 6.394 -19.983 638 HG2 PRO 102 2HG PRO 102 -3.915 3.976 -18.213 639 HG3 PRO 102 3HG PRO 102 -4.107 5.678 -17.733 640 HD2 PRO 102 2HD PRO 102 -6.166 3.818 -17.754 641 HD3 PRO 102 3HD PRO 102 -6.422 5.571 -17.977 642 H LYS 103 H LYS 103 -5.408 2.287 -19.520 643 HA LYS 103 HA LYS 103 -4.074 0.741 -21.688 644 HB2 LYS 103 2HB LYS 103 -4.284 0.045 -18.751 645 HB3 LYS 103 3HB LYS 103 -3.198 -0.644 -19.948 646 HG2 LYS 103 2HG LYS 103 -3.007 2.001 -18.518 647 HG3 LYS 103 3HG LYS 103 -1.913 0.635 -18.442 648 HD2 LYS 103 2HD LYS 103 -2.250 2.468 -20.849 649 HD3 LYS 103 3HD LYS 103 -0.948 2.522 -19.671 650 HE2 LYS 103 2HE LYS 103 -0.399 0.114 -20.260 651 HE3 LYS 103 3HE LYS 103 -1.575 0.215 -21.576 652 HZ1 LYS 103 HZ1 LYS 103 0.745 2.045 -21.318 653 HZ2 LYS 103 HZ2 LYS 103 -0.238 1.905 -22.624 654 HZ3 LYS 103 HZ3 LYS 103 0.786 0.693 -22.179 655 H ASP 104 H ASP 104 -4.703 -1.775 -21.181 656 HA ASP 104 HA ASP 104 -7.585 -2.119 -20.646 657 HB2 ASP 104 2HB ASP 104 -7.212 -1.356 -23.042 658 HB3 ASP 104 3HB ASP 104 -6.337 -2.851 -23.321 659 H GLN 105 H GLN 105 -5.006 -3.230 -19.406 660 HA GLN 105 HA GLN 105 -5.268 -6.092 -20.108 661 HB2 GLN 105 2HB GLN 105 -3.135 -4.753 -18.464 662 HB3 GLN 105 3HB GLN 105 -3.318 -6.478 -18.690 663 HG2 GLN 105 2HG GLN 105 -1.646 -5.697 -20.214 664 HG3 GLN 105 3HG GLN 105 -3.042 -6.276 -21.121 665 HE21 GLN 105 1HE2 GLN 105 -2.128 -3.151 -19.570 666 HE22 GLN 105 2HE2 GLN 105 -2.394 -2.187 -21.018 667 HA PRO 106 HA PRO 106 -7.900 -6.633 -16.456 668 HB2 PRO 106 2HB PRO 106 -6.725 -9.414 -16.622 669 HB3 PRO 106 3HB PRO 106 -8.425 -8.935 -16.321 670 HG2 PRO 106 2HG PRO 106 -7.689 -9.727 -18.792 671 HG3 PRO 106 3HG PRO 106 -8.710 -8.262 -18.610 672 HD2 PRO 106 2HD PRO 106 -5.719 -8.436 -19.050 673 HD3 PRO 106 3HD PRO 106 -6.929 -7.369 -19.831 674 H ASP 107 H ASP 107 -4.508 -6.697 -16.318 675 HA ASP 107 HA ASP 107 -4.373 -7.227 -13.387 676 HB2 ASP 107 2HB ASP 107 -2.486 -8.029 -14.700 677 HB3 ASP 107 3HB ASP 107 -2.272 -6.443 -15.441 678 H VAL 108 H VAL 108 -3.620 -4.513 -15.652 679 HA VAL 108 HA VAL 108 -3.465 -2.629 -13.454 680 HB VAL 108 HB VAL 108 -3.065 -0.918 -15.084 681 HG11 VAL 108 1HG1 VAL 108 -1.193 -2.450 -14.436 682 HG12 VAL 108 2HG1 VAL 108 -1.539 -3.446 -15.858 683 HG13 VAL 108 3HG1 VAL 108 -0.989 -1.767 -16.059 684 HG21 VAL 108 1HG2 VAL 108 -2.952 -1.439 -17.513 685 HG22 VAL 108 2HG2 VAL 108 -3.814 -2.955 -17.196 686 HG23 VAL 108 3HG2 VAL 108 -4.594 -1.399 -16.842 687 H VAL 109 H VAL 109 -6.014 -3.593 -15.681 688 HA VAL 109 HA VAL 109 -7.871 -1.460 -15.187 689 HB VAL 109 HB VAL 109 -8.260 -4.404 -15.815 690 HG11 VAL 109 1HG1 VAL 109 -10.397 -2.226 -15.750 691 HG12 VAL 109 2HG1 VAL 109 -10.588 -3.799 -16.548 692 HG13 VAL 109 3HG1 VAL 109 -10.364 -3.736 -14.801 693 HG21 VAL 109 1HG2 VAL 109 -8.653 -1.926 -17.566 694 HG22 VAL 109 2HG2 VAL 109 -7.169 -2.862 -17.557 695 HG23 VAL 109 3HG2 VAL 109 -8.680 -3.622 -18.083 696 H GLU 110 H GLU 110 -6.766 -4.086 -13.149 697 HA GLU 110 HA GLU 110 -8.883 -3.609 -11.150 698 HB2 GLU 110 2HB GLU 110 -6.666 -5.668 -11.197 699 HB3 GLU 110 3HB GLU 110 -7.915 -5.511 -9.959 700 HG2 GLU 110 2HG GLU 110 -9.673 -5.794 -11.714 701 HG3 GLU 110 3HG GLU 110 -8.409 -6.155 -12.886 702 H LYS 111 H LYS 111 -6.107 -1.973 -11.861 703 HA LYS 111 HA LYS 111 -5.475 -1.376 -9.010 704 HB2 LYS 111 2HB LYS 111 -3.961 -1.022 -11.581 705 HB3 LYS 111 3HB LYS 111 -3.714 0.153 -10.312 706 HG2 LYS 111 2HG LYS 111 -2.047 -1.616 -10.232 707 HG3 LYS 111 3HG LYS 111 -2.991 -1.529 -8.742 708 HD2 LYS 111 2HD LYS 111 -4.272 -3.499 -9.351 709 HD3 LYS 111 3HD LYS 111 -3.585 -3.480 -10.975 710 HE2 LYS 111 2HE LYS 111 -1.303 -3.867 -9.944 711 HE3 LYS 111 3HE LYS 111 -2.096 -3.984 -8.363 712 HZ1 LYS 111 HZ1 LYS 111 -2.486 -5.824 -10.672 713 HZ2 LYS 111 HZ2 LYS 111 -3.377 -5.891 -9.292 714 HZ3 LYS 111 HZ3 LYS 111 -1.768 -6.175 -9.259 715 H LEU 112 H LEU 112 -6.326 0.219 -12.051 716 HA LEU 112 HA LEU 112 -6.752 2.823 -10.987 717 HB2 LEU 112 2HB LEU 112 -7.816 3.315 -13.203 718 HB3 LEU 112 3HB LEU 112 -6.241 2.615 -13.229 719 HG LEU 112 HG LEU 112 -7.300 0.434 -13.562 720 HD11 LEU 112 1HD1 LEU 112 -9.439 0.276 -14.766 721 HD12 LEU 112 2HD1 LEU 112 -9.761 1.944 -14.260 722 HD13 LEU 112 3HD1 LEU 112 -9.529 0.674 -13.068 723 HD21 LEU 112 1HD2 LEU 112 -7.395 2.374 -15.875 724 HD22 LEU 112 2HD2 LEU 112 -7.277 0.599 -15.992 725 HD23 LEU 112 3HD2 LEU 112 -5.968 1.496 -15.264 726 H LYS 113 H LYS 113 -8.918 0.055 -10.870 727 HA LYS 113 HA LYS 113 -11.321 1.552 -10.510 728 HB2 LYS 113 2HB LYS 113 -12.137 -0.593 -9.603 729 HB3 LYS 113 3HB LYS 113 -11.299 -0.815 -11.145 730 HG2 LYS 113 2HG LYS 113 -9.294 -1.634 -10.065 731 HG3 LYS 113 3HG LYS 113 -9.893 -1.199 -8.458 732 HD2 LYS 113 2HD LYS 113 -11.048 -3.364 -10.252 733 HD3 LYS 113 3HD LYS 113 -9.979 -3.573 -8.835 734 HE2 LYS 113 2HE LYS 113 -11.674 -2.299 -7.475 735 HE3 LYS 113 3HE LYS 113 -12.756 -2.336 -8.865 736 HZ1 LYS 113 HZ1 LYS 113 -11.738 -4.730 -7.412 737 HZ2 LYS 113 HZ2 LYS 113 -12.714 -4.794 -8.734 738 HZ3 LYS 113 HZ3 LYS 113 -13.264 -4.152 -7.331 739 H ASN 114 H ASN 114 -8.720 0.831 -8.308 740 HA ASN 114 HA ASN 114 -10.214 2.170 -6.092 741 HB2 ASN 114 2HB ASN 114 -8.108 0.017 -5.814 742 HB3 ASN 114 3HB ASN 114 -8.971 0.836 -4.499 743 HD21 ASN 114 1HD2 ASN 114 -11.600 0.784 -5.127 744 HD22 ASN 114 2HD2 ASN 114 -12.139 -0.868 -5.412 745 H ILE 115 H ILE 115 -9.438 4.233 -6.697 746 HA ILE 115 HA ILE 115 -6.526 4.725 -6.292 747 HB ILE 115 HB ILE 115 -6.747 6.787 -7.497 748 HG12 ILE 115 2HG1 ILE 115 -9.203 7.141 -7.125 749 HG13 ILE 115 3HG1 ILE 115 -8.594 7.499 -8.691 750 HG21 ILE 115 1HG2 ILE 115 -7.432 4.277 -9.036 751 HG22 ILE 115 2HG2 ILE 115 -6.876 5.796 -9.776 752 HG23 ILE 115 3HG2 ILE 115 -5.837 4.921 -8.632 753 HD11 ILE 115 1HD1 ILE 115 -10.693 6.454 -8.976 754 HD12 ILE 115 2HD1 ILE 115 -9.462 5.345 -9.566 755 HD13 ILE 115 3HD1 ILE 115 -10.219 5.050 -7.993 756 H ASN 116 H ASN 116 -5.836 6.424 -5.036 757 HA ASN 116 HA ASN 116 -7.924 7.829 -3.423 758 HB2 ASN 116 2HB ASN 116 -5.061 8.340 -2.796 759 HB3 ASN 116 3HB ASN 116 -6.489 8.275 -1.765 760 HD21 ASN 116 1HD2 ASN 116 -7.432 5.657 -1.990 761 HD22 ASN 116 2HD2 ASN 116 -6.166 4.595 -1.432 762 H LEU 117 H LEU 117 -8.443 9.797 -4.074 763 HA LEU 117 HA LEU 117 -6.618 11.382 -5.843 764 HB2 LEU 117 2HB LEU 117 -9.455 12.025 -4.974 765 HB3 LEU 117 3HB LEU 117 -8.465 12.913 -6.119 766 HG LEU 117 HG LEU 117 -9.671 10.128 -6.452 767 HD11 LEU 117 1HD1 LEU 117 -11.198 12.016 -6.783 768 HD12 LEU 117 2HD1 LEU 117 -10.891 11.167 -8.308 769 HD13 LEU 117 3HD1 LEU 117 -10.095 12.723 -7.980 770 HD21 LEU 117 1HD2 LEU 117 -7.502 9.948 -7.491 771 HD22 LEU 117 2HD2 LEU 117 -7.682 11.546 -8.266 772 HD23 LEU 117 3HD2 LEU 117 -8.693 10.163 -8.761 773 H THR 118 H THR 118 -5.220 12.642 -4.811 774 HA THR 118 HA THR 118 -5.948 13.910 -2.217 775 HB THR 118 HB THR 118 -3.287 12.546 -2.778 776 HG1 THR 118 HG1 THR 118 -4.769 11.017 -2.242 777 HG21 THR 118 1HG2 THR 118 -4.385 14.185 -0.454 778 HG22 THR 118 2HG2 THR 118 -2.895 14.461 -1.377 779 HG23 THR 118 3HG2 THR 118 -3.004 13.077 -0.280 780 H VAL 119 H VAL 119 -5.565 15.972 -2.179 781 HA VAL 119 HA VAL 119 -3.833 17.269 -4.234 782 HB VAL 119 HB VAL 119 -5.497 18.773 -4.810 783 HG11 VAL 119 1HG1 VAL 119 -7.312 17.480 -5.741 784 HG12 VAL 119 2HG1 VAL 119 -5.821 16.533 -5.848 785 HG13 VAL 119 3HG1 VAL 119 -7.031 16.169 -4.594 786 HG21 VAL 119 1HG2 VAL 119 -7.354 17.750 -2.648 787 HG22 VAL 119 2HG2 VAL 119 -6.523 19.320 -2.642 788 HG23 VAL 119 3HG2 VAL 119 -7.716 18.993 -3.877 789 H ALA 120 H ALA 120 -3.042 19.323 -3.737 790 HA ALA 120 HA ALA 120 -3.728 20.731 -1.273 791 HB1 ALA 120 1HB ALA 120 -0.924 19.591 -1.619 792 HB2 ALA 120 2HB ALA 120 -1.480 20.634 -0.294 793 HB3 ALA 120 3HB ALA 120 -2.128 18.992 -0.465 794 HA PRO 121 HA PRO 121 -1.952 23.135 -4.925 795 HB2 PRO 121 2HB PRO 121 -4.152 24.367 -6.013 796 HB3 PRO 121 3HB PRO 121 -3.647 22.701 -6.425 797 HG2 PRO 121 2HG PRO 121 -5.769 23.573 -4.465 798 HG3 PRO 121 3HG PRO 121 -5.862 22.277 -5.691 799 HD2 PRO 121 2HD PRO 121 -5.298 21.787 -3.042 800 HD3 PRO 121 3HD PRO 121 -4.646 20.810 -4.389 801 H GLU 122 H GLU 122 -1.360 25.288 -4.956 802 HA GLU 122 HA GLU 122 -1.777 26.774 -2.488 803 HB2 GLU 122 2HB GLU 122 0.436 26.589 -3.499 804 HB3 GLU 122 3HB GLU 122 -0.138 27.372 -4.980 805 HG2 GLU 122 2HG GLU 122 1.143 28.924 -3.606 806 HG3 GLU 122 3HG GLU 122 -0.517 29.468 -3.749 Start of MODEL 19 1 H1 ALA 22 H ALA 22 15.631 -3.981 -12.016 2 HA ALA 22 HA ALA 22 15.814 -1.090 -11.352 3 HB1 ALA 22 1HB ALA 22 16.741 -2.337 -13.949 4 HB2 ALA 22 2HB ALA 22 16.747 -0.612 -13.530 5 HB3 ALA 22 3HB ALA 22 17.823 -1.717 -12.670 6 H ALA 23 H ALA 23 12.409 -2.046 -12.763 7 HA ALA 23 HA ALA 23 13.720 -3.503 -10.632 8 HB1 ALA 23 1HB ALA 23 12.503 -0.770 -9.978 9 HB2 ALA 23 2HB ALA 23 12.987 -1.997 -8.792 10 HB3 ALA 23 3HB ALA 23 14.218 -1.221 -9.804 11 H ARG 24 H ARG 24 10.716 -1.716 -11.364 12 HA ARG 24 HA ARG 24 8.614 -2.285 -11.574 13 HB2 ARG 24 2HB ARG 24 9.433 -5.213 -11.508 14 HB3 ARG 24 3HB ARG 24 7.917 -4.536 -12.109 15 HG2 ARG 24 2HG ARG 24 9.184 -3.285 -13.872 16 HG3 ARG 24 3HG ARG 24 10.674 -4.077 -13.319 17 HD2 ARG 24 2HD ARG 24 9.963 -5.368 -15.154 18 HD3 ARG 24 3HD ARG 24 9.564 -6.301 -13.725 19 HE ARG 24 HE ARG 24 7.264 -5.950 -14.087 20 HH11 ARG 24 1HH1 ARG 24 9.080 -4.194 -16.593 21 HH12 ARG 24 2HH1 ARG 24 7.636 -3.896 -17.509 22 HH21 ARG 24 1HH2 ARG 24 5.493 -5.553 -15.353 23 HH22 ARG 24 2HH2 ARG 24 5.649 -4.653 -16.833 24 H GLN 25 H GLN 25 9.996 -2.402 -8.753 25 HA GLN 25 HA GLN 25 7.938 -3.945 -7.267 26 HB2 GLN 25 2HB GLN 25 10.369 -2.558 -6.112 27 HB3 GLN 25 3HB GLN 25 9.362 -3.787 -5.360 28 HG2 GLN 25 2HG GLN 25 11.275 -4.157 -7.680 29 HG3 GLN 25 3HG GLN 25 11.473 -4.782 -6.050 30 HE21 GLN 25 1HE2 GLN 25 10.588 -5.696 -9.164 31 HE22 GLN 25 2HE2 GLN 25 9.588 -7.078 -8.734 32 H GLN 26 H GLN 26 8.725 -0.707 -8.005 33 HA GLN 26 HA GLN 26 6.848 0.443 -5.981 34 HB2 GLN 26 2HB GLN 26 8.488 1.997 -5.307 35 HB3 GLN 26 3HB GLN 26 9.139 0.364 -5.125 36 HG2 GLN 26 2HG GLN 26 9.784 2.302 -7.394 37 HG3 GLN 26 3HG GLN 26 10.789 2.009 -5.980 38 HE21 GLN 26 1HE2 GLN 26 11.803 -0.180 -5.742 39 HE22 GLN 26 2HE2 GLN 26 12.057 -1.118 -7.189 40 H PHE 27 H PHE 27 8.333 0.727 -9.174 41 HA PHE 27 HA PHE 27 7.917 3.340 -9.820 42 HB2 PHE 27 2HB PHE 27 8.497 2.698 -11.908 43 HB3 PHE 27 3HB PHE 27 8.978 1.211 -11.059 44 HD1 PHE 27 HD1 PHE 27 6.858 2.703 -13.596 45 HD2 PHE 27 HD2 PHE 27 7.321 -0.709 -11.029 46 HE1 PHE 27 HE1 PHE 27 5.085 1.529 -14.872 47 HE2 PHE 27 HE2 PHE 27 5.597 -1.952 -12.377 48 HZ PHE 27 HZ PHE 27 4.484 -0.819 -14.289 49 H VAL 28 H VAL 28 5.390 1.088 -9.409 50 HA VAL 28 HA VAL 28 3.250 2.155 -10.937 51 HB VAL 28 HB VAL 28 1.775 1.373 -9.033 52 HG11 VAL 28 1HG1 VAL 28 2.132 -1.007 -9.567 53 HG12 VAL 28 2HG1 VAL 28 2.310 0.005 -11.015 54 HG13 VAL 28 3HG1 VAL 28 3.753 -0.639 -10.202 55 HG21 VAL 28 1HG2 VAL 28 3.357 1.562 -7.146 56 HG22 VAL 28 2HG2 VAL 28 2.704 -0.071 -7.306 57 HG23 VAL 28 3HG2 VAL 28 4.362 0.271 -7.848 58 H THR 29 H THR 29 4.776 3.430 -8.036 59 HA THR 29 HA THR 29 2.858 5.416 -7.353 60 HB THR 29 HB THR 29 4.849 4.701 -6.035 61 HG1 THR 29 HG1 THR 29 3.722 6.475 -5.382 62 HG21 THR 29 1HG2 THR 29 6.398 6.773 -7.654 63 HG22 THR 29 2HG2 THR 29 6.596 5.026 -7.869 64 HG23 THR 29 3HG2 THR 29 6.984 5.772 -6.311 65 H SER 30 H SER 30 5.413 5.499 -9.854 66 HA SER 30 HA SER 30 4.807 8.224 -10.651 67 HB2 SER 30 2HB SER 30 6.286 6.009 -12.135 68 HB3 SER 30 3HB SER 30 6.278 7.727 -12.551 69 HG SER 30 HG SER 30 8.144 7.182 -11.332 70 H GLU 31 H GLU 31 3.585 5.044 -11.645 71 HA GLU 31 HA GLU 31 1.989 6.100 -13.834 72 HB2 GLU 31 2HB GLU 31 1.917 3.509 -12.268 73 HB3 GLU 31 3HB GLU 31 0.701 3.877 -13.483 74 HG2 GLU 31 2HG GLU 31 3.605 4.184 -14.228 75 HG3 GLU 31 3HG GLU 31 2.911 2.564 -14.109 76 H VAL 32 H VAL 32 1.517 5.955 -10.304 77 HA VAL 32 HA VAL 32 -1.311 6.051 -10.373 78 HB VAL 32 HB VAL 32 0.429 5.758 -8.337 79 HG11 VAL 32 1HG1 VAL 32 0.308 7.519 -6.693 80 HG12 VAL 32 2HG1 VAL 32 0.906 8.289 -8.165 81 HG13 VAL 32 3HG1 VAL 32 -0.787 8.491 -7.702 82 HG21 VAL 32 1HG2 VAL 32 -2.446 6.714 -8.145 83 HG22 VAL 32 2HG2 VAL 32 -1.904 5.040 -8.411 84 HG23 VAL 32 3HG2 VAL 32 -1.565 5.841 -6.867 85 H GLY 33 H GLY 33 1.003 8.526 -10.784 86 HA2 GLY 33 HA2 GLY 33 -0.679 10.876 -10.619 87 HA3 GLY 33 HA3 GLY 33 0.945 10.766 -11.356 88 H ARG 34 H ARG 34 -0.429 8.413 -13.042 89 HA ARG 34 HA ARG 34 -1.962 10.132 -14.974 90 HB2 ARG 34 2HB ARG 34 -0.790 7.355 -15.336 91 HB3 ARG 34 3HB ARG 34 -1.586 8.347 -16.566 92 HG2 ARG 34 2HG ARG 34 0.228 10.042 -16.363 93 HG3 ARG 34 3HG ARG 34 1.023 9.051 -15.121 94 HD2 ARG 34 2HD ARG 34 1.202 7.193 -16.779 95 HD3 ARG 34 3HD ARG 34 0.616 8.294 -18.033 96 HE ARG 34 HE ARG 34 2.533 9.771 -17.525 97 HH11 ARG 34 1HH1 ARG 34 4.746 9.819 -17.520 98 HH12 ARG 34 2HH1 ARG 34 5.669 8.411 -17.065 99 HH21 ARG 34 1HH2 ARG 34 2.924 6.350 -16.508 100 HH22 ARG 34 2HH2 ARG 34 4.657 6.510 -16.495 101 H TYR 35 H TYR 35 -2.009 6.892 -13.475 102 HA TYR 35 HA TYR 35 -4.511 5.967 -14.244 103 HB2 TYR 35 2HB TYR 35 -2.649 5.417 -11.929 104 HB3 TYR 35 3HB TYR 35 -4.261 4.711 -11.911 105 HD1 TYR 35 HD1 TYR 35 -1.541 5.195 -14.515 106 HD2 TYR 35 HD2 TYR 35 -4.362 2.548 -12.631 107 HE1 TYR 35 HE1 TYR 35 -1.012 3.450 -16.189 108 HE2 TYR 35 HE2 TYR 35 -3.960 0.854 -14.379 109 HH TYR 35 HH TYR 35 -2.723 0.318 -16.289 110 H GLY 36 H GLY 36 -3.848 7.779 -11.248 111 HA2 GLY 36 HA2 GLY 36 -6.680 8.028 -10.560 112 HA3 GLY 36 HA3 GLY 36 -5.312 8.783 -9.734 113 H ALA 37 H ALA 37 -4.527 9.811 -12.657 114 HA ALA 37 HA ALA 37 -5.807 12.352 -12.278 115 HB1 ALA 37 1HB ALA 37 -3.954 11.428 -14.502 116 HB2 ALA 37 2HB ALA 37 -4.436 13.089 -14.165 117 HB3 ALA 37 3HB ALA 37 -3.472 12.214 -12.975 118 H ILE 38 H ILE 38 -6.290 9.585 -14.446 119 HA ILE 38 HA ILE 38 -8.015 10.851 -16.335 120 HB ILE 38 HB ILE 38 -8.640 8.674 -17.030 121 HG12 ILE 38 2HG1 ILE 38 -8.081 7.814 -14.215 122 HG13 ILE 38 3HG1 ILE 38 -9.580 7.703 -15.120 123 HG21 ILE 38 1HG2 ILE 38 -6.593 7.578 -17.421 124 HG22 ILE 38 2HG2 ILE 38 -6.085 9.244 -17.125 125 HG23 ILE 38 3HG2 ILE 38 -5.918 8.017 -15.840 126 HD11 ILE 38 1HD1 ILE 38 -8.455 5.986 -16.604 127 HD12 ILE 38 2HD1 ILE 38 -7.121 5.963 -15.402 128 HD13 ILE 38 3HD1 ILE 38 -8.772 5.507 -14.937 129 H TYR 39 H TYR 39 -8.591 9.810 -13.111 130 HA TYR 39 HA TYR 39 -11.509 10.093 -13.232 131 HB2 TYR 39 2HB TYR 39 -9.665 9.679 -10.847 132 HB3 TYR 39 3HB TYR 39 -11.409 9.593 -10.824 133 HD1 TYR 39 HD1 TYR 39 -12.619 7.730 -11.865 134 HD2 TYR 39 HD2 TYR 39 -8.334 7.768 -11.709 135 HE1 TYR 39 HE1 TYR 39 -12.539 5.408 -12.756 136 HE2 TYR 39 HE2 TYR 39 -8.250 5.342 -12.429 137 HH TYR 39 HH TYR 39 -11.299 3.692 -13.455 138 H THR 40 H THR 40 -8.836 11.812 -11.532 139 HA THR 40 HA THR 40 -10.429 13.890 -10.443 140 HB THR 40 HB THR 40 -8.007 13.115 -9.912 141 HG1 THR 40 HG1 THR 40 -7.734 15.152 -8.924 142 HG21 THR 40 1HG2 THR 40 -6.194 14.297 -10.758 143 HG22 THR 40 2HG2 THR 40 -7.224 15.503 -11.582 144 HG23 THR 40 3HG2 THR 40 -7.129 13.844 -12.181 145 H GLN 41 H GLN 41 -8.880 13.687 -13.601 146 HA GLN 41 HA GLN 41 -9.341 16.456 -14.329 147 HB2 GLN 41 2HB GLN 41 -8.619 13.943 -15.890 148 HB3 GLN 41 3HB GLN 41 -8.817 15.523 -16.654 149 HG2 GLN 41 2HG GLN 41 -6.770 14.854 -14.493 150 HG3 GLN 41 3HG GLN 41 -6.431 15.052 -16.206 151 HE21 GLN 41 1HE2 GLN 41 -5.348 16.593 -13.844 152 HE22 GLN 41 2HE2 GLN 41 -5.791 18.259 -14.166 153 H LEU 42 H LEU 42 -11.217 13.439 -14.672 154 HA LEU 42 HA LEU 42 -13.210 14.697 -16.382 155 HB2 LEU 42 2HB LEU 42 -12.752 12.223 -16.279 156 HB3 LEU 42 3HB LEU 42 -13.464 12.224 -14.657 157 HG LEU 42 HG LEU 42 -15.613 13.024 -15.605 158 HD11 LEU 42 1HD1 LEU 42 -15.964 12.913 -18.103 159 HD12 LEU 42 2HD1 LEU 42 -14.219 12.711 -18.326 160 HD13 LEU 42 3HD1 LEU 42 -14.873 14.223 -17.644 161 HD21 LEU 42 1HD2 LEU 42 -14.462 10.505 -16.845 162 HD22 LEU 42 2HD2 LEU 42 -16.195 10.926 -16.841 163 HD23 LEU 42 3HD2 LEU 42 -15.361 10.671 -15.306 164 H ILE 43 H ILE 43 -12.825 14.240 -12.865 165 HA ILE 43 HA ILE 43 -15.454 15.101 -12.111 166 HB ILE 43 HB ILE 43 -12.802 14.613 -10.740 167 HG12 ILE 43 2HG1 ILE 43 -14.294 13.276 -9.271 168 HG13 ILE 43 3HG1 ILE 43 -15.699 13.825 -10.229 169 HG21 ILE 43 1HG2 ILE 43 -15.103 16.104 -9.397 170 HG22 ILE 43 2HG2 ILE 43 -13.695 15.382 -8.582 171 HG23 ILE 43 3HG2 ILE 43 -13.451 16.735 -9.674 172 HD11 ILE 43 1HD1 ILE 43 -13.441 11.979 -11.074 173 HD12 ILE 43 2HD1 ILE 43 -15.163 11.614 -10.905 174 HD13 ILE 43 3HD1 ILE 43 -14.631 12.664 -12.227 175 H ARG 44 H ARG 44 -12.436 16.883 -12.510 176 HA ARG 44 HA ARG 44 -13.516 19.390 -11.534 177 HB2 ARG 44 2HB ARG 44 -11.448 20.347 -12.008 178 HB3 ARG 44 3HB ARG 44 -11.195 18.710 -11.407 179 HG2 ARG 44 2HG ARG 44 -9.602 18.897 -13.040 180 HG3 ARG 44 3HG ARG 44 -10.897 18.004 -13.836 181 HD2 ARG 44 2HD ARG 44 -11.587 19.999 -15.062 182 HD3 ARG 44 3HD ARG 44 -10.434 20.996 -14.143 183 HE ARG 44 HE ARG 44 -8.963 18.921 -15.358 184 HH11 ARG 44 1HH1 ARG 44 -10.748 21.776 -16.473 185 HH12 ARG 44 2HH1 ARG 44 -9.759 21.919 -17.899 186 HH21 ARG 44 1HH2 ARG 44 -7.796 19.130 -17.118 187 HH22 ARG 44 2HH2 ARG 44 -8.087 20.400 -18.289 188 H GLN 45 H GLN 45 -13.784 17.804 -14.528 189 HA GLN 45 HA GLN 45 -14.431 20.014 -16.318 190 HB2 GLN 45 2HB GLN 45 -15.834 17.328 -16.094 191 HB3 GLN 45 3HB GLN 45 -15.956 18.445 -17.445 192 HG2 GLN 45 2HG GLN 45 -13.605 16.766 -16.634 193 HG3 GLN 45 3HG GLN 45 -14.577 16.594 -18.078 194 HE21 GLN 45 1HE2 GLN 45 -11.601 17.376 -17.191 195 HE22 GLN 45 2HE2 GLN 45 -11.218 18.515 -18.476 196 H ASN 46 H ASN 46 -16.261 18.298 -13.733 197 HA ASN 46 HA ASN 46 -18.718 19.813 -14.316 198 HB2 ASN 46 2HB ASN 46 -18.017 18.192 -11.851 199 HB3 ASN 46 3HB ASN 46 -19.620 18.677 -12.399 200 HD21 ASN 46 1HD2 ASN 46 -17.164 16.280 -12.616 201 HD22 ASN 46 2HD2 ASN 46 -18.100 15.243 -13.691 202 H LEU 47 H LEU 47 -16.066 19.951 -11.965 203 HA LEU 47 HA LEU 47 -17.469 21.893 -10.274 204 HB2 LEU 47 2HB LEU 47 -14.840 20.427 -9.945 205 HB3 LEU 47 3HB LEU 47 -15.733 21.328 -8.729 206 HG LEU 47 HG LEU 47 -16.646 18.803 -10.005 207 HD11 LEU 47 1HD1 LEU 47 -15.620 19.556 -7.283 208 HD12 LEU 47 2HD1 LEU 47 -14.736 18.683 -8.546 209 HD13 LEU 47 3HD1 LEU 47 -16.144 17.914 -7.779 210 HD21 LEU 47 1HD2 LEU 47 -18.683 19.978 -9.454 211 HD22 LEU 47 2HD2 LEU 47 -17.983 20.606 -7.943 212 HD23 LEU 47 3HD2 LEU 47 -18.379 18.882 -8.092 213 H LEU 48 H LEU 48 -17.394 23.607 -11.521 214 HA LEU 48 HA LEU 48 -14.933 24.880 -12.384 215 HB2 LEU 48 2HB LEU 48 -16.472 26.697 -13.205 216 HB3 LEU 48 3HB LEU 48 -16.721 25.085 -13.836 217 HG LEU 48 HG LEU 48 -18.691 24.736 -12.449 218 HD11 LEU 48 1HD1 LEU 48 -18.206 26.086 -10.452 219 HD12 LEU 48 2HD1 LEU 48 -19.738 26.598 -11.178 220 HD13 LEU 48 3HD1 LEU 48 -18.285 27.578 -11.428 221 HD21 LEU 48 1HD2 LEU 48 -18.908 25.743 -14.674 222 HD22 LEU 48 2HD2 LEU 48 -18.761 27.373 -13.972 223 HD23 LEU 48 3HD2 LEU 48 -20.161 26.355 -13.591 224 H VAL 49 H VAL 49 -14.952 24.463 -9.615 225 HA VAL 49 HA VAL 49 -15.844 26.931 -8.319 226 HB VAL 49 HB VAL 49 -14.521 24.639 -6.894 227 HG11 VAL 49 1HG1 VAL 49 -15.829 25.467 -4.969 228 HG12 VAL 49 2HG1 VAL 49 -14.722 26.710 -5.583 229 HG13 VAL 49 3HG1 VAL 49 -16.462 26.805 -5.959 230 HG21 VAL 49 1HG2 VAL 49 -17.479 25.022 -7.561 231 HG22 VAL 49 2HG2 VAL 49 -16.441 23.697 -8.109 232 HG23 VAL 49 3HG2 VAL 49 -16.855 23.832 -6.403 233 H GLU 50 H GLU 50 -12.729 25.233 -8.434 234 HA GLU 50 HA GLU 50 -10.592 25.892 -8.507 235 HB2 GLU 50 2HB GLU 50 -11.580 28.707 -9.118 236 HB3 GLU 50 3HB GLU 50 -9.965 28.049 -9.371 237 HG2 GLU 50 2HG GLU 50 -10.944 26.355 -10.940 238 HG3 GLU 50 3HG GLU 50 -12.516 27.155 -10.777 239 H ASP 51 H ASP 51 -11.960 28.876 -6.958 240 HA ASP 51 HA ASP 51 -9.596 29.107 -5.374 241 HB2 ASP 51 2HB ASP 51 -11.080 30.969 -6.191 242 HB3 ASP 51 3HB ASP 51 -12.239 30.535 -4.929 243 H SER 52 H SER 52 -12.704 27.630 -4.595 244 HA SER 52 HA SER 52 -11.975 27.194 -1.751 245 HB2 SER 52 2HB SER 52 -14.351 26.261 -3.386 246 HB3 SER 52 3HB SER 52 -14.068 25.836 -1.701 247 HG SER 52 HG SER 52 -14.383 28.485 -2.724 248 H PHE 53 H PHE 53 -10.860 25.798 -4.550 249 HA PHE 53 HA PHE 53 -10.284 23.172 -3.279 250 HB2 PHE 53 2HB PHE 53 -9.910 24.047 -6.148 251 HB3 PHE 53 3HB PHE 53 -9.637 22.447 -5.484 252 HD1 PHE 53 HD1 PHE 53 -11.370 23.064 -7.886 253 HD2 PHE 53 HD2 PHE 53 -12.400 22.742 -3.697 254 HE1 PHE 53 HE1 PHE 53 -13.573 22.167 -8.475 255 HE2 PHE 53 HE2 PHE 53 -14.646 21.992 -4.311 256 HZ PHE 53 HZ PHE 53 -15.239 21.646 -6.697 257 H ARG 54 H ARG 54 -8.950 26.260 -3.980 258 HA ARG 54 HA ARG 54 -6.112 25.458 -3.755 259 HB2 ARG 54 2HB ARG 54 -7.432 28.161 -4.142 260 HB3 ARG 54 3HB ARG 54 -5.683 27.887 -4.037 261 HG2 ARG 54 2HG ARG 54 -5.891 26.296 -6.010 262 HG3 ARG 54 3HG ARG 54 -7.548 26.861 -6.212 263 HD2 ARG 54 2HD ARG 54 -5.024 28.538 -6.412 264 HD3 ARG 54 3HD ARG 54 -6.106 28.069 -7.729 265 HE ARG 54 HE ARG 54 -7.448 29.527 -5.592 266 HH11 ARG 54 1HH1 ARG 54 -5.577 30.022 -8.556 267 HH12 ARG 54 2HH1 ARG 54 -6.183 31.638 -8.773 268 HH21 ARG 54 1HH2 ARG 54 -8.126 31.640 -5.891 269 HH22 ARG 54 2HH2 ARG 54 -7.590 32.535 -7.290 270 H GLY 55 H GLY 55 -4.732 26.470 -2.201 271 HA2 GLY 55 HA2 GLY 55 -4.069 27.432 -0.195 272 HA3 GLY 55 HA3 GLY 55 -5.746 27.923 0.111 273 H LYS 56 H LYS 56 -6.040 24.711 -0.390 274 HA LYS 56 HA LYS 56 -5.285 23.767 2.318 275 HB2 LYS 56 2HB LYS 56 -7.585 22.891 2.616 276 HB3 LYS 56 3HB LYS 56 -7.478 24.629 2.591 277 HG2 LYS 56 2HG LYS 56 -9.418 24.016 1.412 278 HG3 LYS 56 3HG LYS 56 -8.314 24.688 0.245 279 HD2 LYS 56 2HD LYS 56 -7.825 22.576 -0.728 280 HD3 LYS 56 3HD LYS 56 -8.563 21.669 0.627 281 HE2 LYS 56 2HE LYS 56 -9.939 23.444 -1.403 282 HE3 LYS 56 3HE LYS 56 -9.890 21.681 -1.475 283 HZ1 LYS 56 HZ1 LYS 56 -11.970 22.683 -0.590 284 HZ2 LYS 56 HZ2 LYS 56 -11.190 23.206 0.726 285 HZ3 LYS 56 HZ3 LYS 56 -11.316 21.591 0.464 286 H GLN 57 H GLN 57 -6.142 21.290 2.386 287 HA GLN 57 HA GLN 57 -5.264 19.932 -0.137 288 HB2 GLN 57 2HB GLN 57 -3.651 18.735 0.942 289 HB3 GLN 57 3HB GLN 57 -3.612 20.154 1.917 290 HG2 GLN 57 2HG GLN 57 -3.689 18.639 3.579 291 HG3 GLN 57 3HG GLN 57 -5.424 18.869 3.378 292 HE21 GLN 57 1HE2 GLN 57 -3.939 16.916 0.929 293 HE22 GLN 57 2HE2 GLN 57 -4.618 15.415 1.569 294 H CYS 58 H CYS 58 -6.071 17.698 -0.327 295 HA CYS 58 HA CYS 58 -8.047 16.743 1.580 296 HB2 CYS 58 2HB CYS 58 -9.432 18.292 0.233 297 HB3 CYS 58 3HB CYS 58 -8.865 17.519 -1.254 298 HG CYS 58 HG CYS 58 -10.434 15.913 1.207 299 H ARG 59 H ARG 59 -8.283 14.545 1.483 300 HA ARG 59 HA ARG 59 -7.312 13.101 -0.877 301 HB2 ARG 59 2HB ARG 59 -6.437 11.286 0.451 302 HB3 ARG 59 3HB ARG 59 -5.493 12.737 0.636 303 HG2 ARG 59 2HG ARG 59 -7.560 12.262 2.756 304 HG3 ARG 59 3HG ARG 59 -6.268 11.090 2.647 305 HD2 ARG 59 2HD ARG 59 -4.709 13.210 2.709 306 HD3 ARG 59 3HD ARG 59 -6.184 14.019 3.293 307 HE ARG 59 HE ARG 59 -5.522 11.519 4.673 308 HH11 ARG 59 1HH1 ARG 59 -5.034 15.034 4.829 309 HH12 ARG 59 2HH1 ARG 59 -4.569 14.955 6.508 310 HH21 ARG 59 1HH2 ARG 59 -4.914 11.526 6.814 311 HH22 ARG 59 2HH2 ARG 59 -4.533 13.026 7.599 312 H VAL 60 H VAL 60 -8.829 11.775 -1.681 313 HA VAL 60 HA VAL 60 -10.728 10.439 0.168 314 HB VAL 60 HB VAL 60 -12.692 10.921 -1.175 315 HG11 VAL 60 1HG1 VAL 60 -11.338 13.543 -0.469 316 HG12 VAL 60 2HG1 VAL 60 -13.079 13.245 -0.573 317 HG13 VAL 60 3HG1 VAL 60 -12.098 12.479 0.706 318 HG21 VAL 60 1HG2 VAL 60 -12.739 12.553 -2.977 319 HG22 VAL 60 2HG2 VAL 60 -10.988 12.804 -2.840 320 HG23 VAL 60 3HG2 VAL 60 -11.622 11.226 -3.380 321 H ASN 61 H ASN 61 -11.951 8.676 -1.214 322 HA ASN 61 HA ASN 61 -10.083 7.627 -3.245 323 HB2 ASN 61 2HB ASN 61 -9.380 6.721 -1.148 324 HB3 ASN 61 3HB ASN 61 -11.024 6.320 -0.670 325 HD21 ASN 61 1HD2 ASN 61 -12.162 4.657 -2.068 326 HD22 ASN 61 2HD2 ASN 61 -11.184 3.381 -2.770 327 H LEU 62 H LEU 62 -10.894 6.684 -4.926 328 HA LEU 62 HA LEU 62 -13.882 6.354 -5.104 329 HB2 LEU 62 2HB LEU 62 -11.678 7.122 -6.995 330 HB3 LEU 62 3HB LEU 62 -13.058 6.238 -7.648 331 HG LEU 62 HG LEU 62 -14.598 7.946 -6.941 332 HD11 LEU 62 1HD1 LEU 62 -13.660 8.802 -4.870 333 HD12 LEU 62 2HD1 LEU 62 -13.771 10.137 -6.011 334 HD13 LEU 62 3HD1 LEU 62 -12.202 9.365 -5.697 335 HD21 LEU 62 1HD2 LEU 62 -13.473 8.167 -9.107 336 HD22 LEU 62 2HD2 LEU 62 -12.112 9.031 -8.357 337 HD23 LEU 62 3HD2 LEU 62 -13.716 9.785 -8.427 338 H LYS 63 H LYS 63 -14.747 4.434 -5.366 339 HA LYS 63 HA LYS 63 -13.061 2.095 -6.169 340 HB2 LYS 63 2HB LYS 63 -15.569 2.125 -4.457 341 HB3 LYS 63 3HB LYS 63 -14.593 0.718 -4.856 342 HG2 LYS 63 2HG LYS 63 -12.679 1.702 -3.574 343 HG3 LYS 63 3HG LYS 63 -13.693 3.105 -3.166 344 HD2 LYS 63 2HD LYS 63 -15.311 1.610 -2.015 345 HD3 LYS 63 3HD LYS 63 -14.238 0.230 -2.341 346 HE2 LYS 63 2HE LYS 63 -12.435 1.265 -1.036 347 HE3 LYS 63 3HE LYS 63 -13.383 2.740 -0.833 348 HZ1 LYS 63 HZ1 LYS 63 -14.997 1.491 0.462 349 HZ2 LYS 63 HZ2 LYS 63 -13.516 1.341 1.132 350 HZ3 LYS 63 HZ3 LYS 63 -14.147 0.102 0.275 351 H LEU 64 H LEU 64 -13.431 1.933 -8.391 352 HA LEU 64 HA LEU 64 -16.187 2.389 -9.385 353 HB2 LEU 64 2HB LEU 64 -13.632 2.067 -10.982 354 HB3 LEU 64 3HB LEU 64 -15.207 2.609 -11.550 355 HG LEU 64 HG LEU 64 -14.072 4.522 -11.571 356 HD11 LEU 64 1HD1 LEU 64 -16.046 4.961 -10.333 357 HD12 LEU 64 2HD1 LEU 64 -14.757 6.025 -9.785 358 HD13 LEU 64 3HD1 LEU 64 -15.234 4.653 -8.777 359 HD21 LEU 64 1HD2 LEU 64 -12.684 3.931 -8.955 360 HD22 LEU 64 2HD2 LEU 64 -12.452 5.329 -10.002 361 HD23 LEU 64 3HD2 LEU 64 -12.015 3.718 -10.596 362 H ILE 65 H ILE 65 -17.007 1.062 -11.022 363 HA ILE 65 HA ILE 65 -16.203 -1.834 -10.989 364 HB ILE 65 HB ILE 65 -18.449 -2.120 -12.148 365 HG12 ILE 65 2HG1 ILE 65 -19.216 0.454 -10.729 366 HG13 ILE 65 3HG1 ILE 65 -18.801 0.443 -12.438 367 HG21 ILE 65 1HG2 ILE 65 -17.921 -2.899 -9.881 368 HG22 ILE 65 2HG2 ILE 65 -18.332 -1.303 -9.216 369 HG23 ILE 65 3HG2 ILE 65 -19.579 -2.327 -9.956 370 HD11 ILE 65 1HD1 ILE 65 -20.579 -1.151 -12.910 371 HD12 ILE 65 2HD1 ILE 65 -21.076 -1.117 -11.189 372 HD13 ILE 65 3HD1 ILE 65 -21.173 0.358 -12.178 373 HA PRO 66 HA PRO 66 -14.555 -0.912 -15.124 374 HB2 PRO 66 2HB PRO 66 -14.381 -3.923 -15.165 375 HB3 PRO 66 3HB PRO 66 -13.163 -2.716 -15.677 376 HG2 PRO 66 2HG PRO 66 -12.916 -4.008 -13.307 377 HG3 PRO 66 3HG PRO 66 -12.569 -2.246 -13.407 378 HD2 PRO 66 2HD PRO 66 -15.097 -3.619 -12.445 379 HD3 PRO 66 3HD PRO 66 -14.186 -2.254 -11.704 380 H THR 67 H THR 67 -15.840 -0.539 -16.823 381 HA THR 67 HA THR 67 -18.337 -2.148 -17.231 382 HB THR 67 HB THR 67 -17.781 0.822 -17.564 383 HG1 THR 67 HG1 THR 67 -18.091 -0.030 -15.429 384 HG21 THR 67 1HG2 THR 67 -20.231 1.004 -17.934 385 HG22 THR 67 2HG2 THR 67 -20.332 -0.768 -18.079 386 HG23 THR 67 3HG2 THR 67 -19.404 0.178 -19.267 387 H GLY 68 H GLY 68 -15.594 -0.614 -18.844 388 HA2 GLY 68 HA2 GLY 68 -14.613 -1.761 -20.743 389 HA3 GLY 68 HA3 GLY 68 -16.236 -2.148 -21.356 390 H THR 69 H THR 69 -17.379 0.494 -21.008 391 HA THR 69 HA THR 69 -16.114 2.181 -23.054 392 HB THR 69 HB THR 69 -17.821 3.840 -22.216 393 HG1 THR 69 HG1 THR 69 -19.387 2.994 -20.778 394 HG21 THR 69 1HG2 THR 69 -19.762 2.679 -23.157 395 HG22 THR 69 2HG2 THR 69 -18.970 1.103 -22.946 396 HG23 THR 69 3HG2 THR 69 -18.327 2.281 -24.106 397 H GLY 70 H GLY 70 -16.193 1.875 -19.577 398 HA2 GLY 70 HA2 GLY 70 -13.602 3.057 -19.171 399 HA3 GLY 70 HA3 GLY 70 -14.874 4.117 -18.595 400 H ALA 71 H ALA 71 -13.957 3.720 -16.408 401 HA ALA 71 HA ALA 71 -15.342 1.378 -15.173 402 HB1 ALA 71 1HB ALA 71 -12.936 1.962 -14.472 403 HB2 ALA 71 2HB ALA 71 -13.635 3.391 -13.700 404 HB3 ALA 71 3HB ALA 71 -14.122 1.749 -13.210 405 H LEU 72 H LEU 72 -16.859 1.935 -13.409 406 HA LEU 72 HA LEU 72 -18.196 4.617 -13.641 407 HB2 LEU 72 2HB LEU 72 -19.213 1.942 -14.275 408 HB3 LEU 72 3HB LEU 72 -20.093 2.581 -12.905 409 HG LEU 72 HG LEU 72 -20.767 4.542 -14.146 410 HD11 LEU 72 1HD1 LEU 72 -18.933 5.000 -15.602 411 HD12 LEU 72 2HD1 LEU 72 -20.297 4.603 -16.659 412 HD13 LEU 72 3HD1 LEU 72 -19.035 3.394 -16.380 413 HD21 LEU 72 1HD2 LEU 72 -22.216 3.405 -15.795 414 HD22 LEU 72 2HD2 LEU 72 -22.117 2.471 -14.293 415 HD23 LEU 72 3HD2 LEU 72 -21.197 1.960 -15.718 416 H LEU 73 H LEU 73 -19.039 5.484 -11.736 417 HA LEU 73 HA LEU 73 -17.763 4.734 -9.312 418 HB2 LEU 73 2HB LEU 73 -18.599 6.986 -9.975 419 HB3 LEU 73 3HB LEU 73 -20.225 6.465 -9.616 420 HG LEU 73 HG LEU 73 -19.037 7.873 -7.880 421 HD11 LEU 73 1HD1 LEU 73 -21.027 6.536 -7.284 422 HD12 LEU 73 2HD1 LEU 73 -19.905 6.760 -5.933 423 HD13 LEU 73 3HD1 LEU 73 -19.972 5.202 -6.777 424 HD21 LEU 73 1HD2 LEU 73 -17.504 5.347 -7.150 425 HD22 LEU 73 2HD2 LEU 73 -17.387 6.947 -6.410 426 HD23 LEU 73 3HD2 LEU 73 -16.802 6.706 -8.058 427 H GLY 74 H GLY 74 -17.943 2.981 -8.256 428 HA2 GLY 74 HA2 GLY 74 -20.542 1.621 -7.784 429 HA3 GLY 74 HA3 GLY 74 -18.911 1.020 -7.370 430 H SER 75 H SER 75 -17.778 3.127 -5.973 431 HA SER 75 HA SER 75 -19.580 4.047 -3.848 432 HB2 SER 75 2HB SER 75 -17.447 1.955 -3.316 433 HB3 SER 75 3HB SER 75 -18.082 3.022 -2.060 434 HG SER 75 HG SER 75 -19.149 0.988 -2.126 435 H LEU 76 H LEU 76 -18.604 5.634 -2.480 436 HA LEU 76 HA LEU 76 -15.863 6.533 -3.198 437 HB2 LEU 76 2HB LEU 76 -17.661 7.850 -4.344 438 HB3 LEU 76 3HB LEU 76 -18.279 8.359 -2.789 439 HG LEU 76 HG LEU 76 -15.332 8.810 -3.312 440 HD11 LEU 76 1HD1 LEU 76 -15.865 10.922 -4.573 441 HD12 LEU 76 2HD1 LEU 76 -17.550 10.335 -4.723 442 HD13 LEU 76 3HD1 LEU 76 -16.228 9.427 -5.459 443 HD21 LEU 76 1HD2 LEU 76 -16.384 9.563 -1.180 444 HD22 LEU 76 2HD2 LEU 76 -17.489 10.593 -2.092 445 HD23 LEU 76 3HD2 LEU 76 -15.743 10.913 -2.117 446 H THR 77 H THR 77 -14.631 6.922 -1.544 447 HA THR 77 HA THR 77 -15.678 6.896 1.283 448 HB THR 77 HB THR 77 -13.045 5.913 0.090 449 HG1 THR 77 HG1 THR 77 -15.046 4.652 -0.122 450 HG21 THR 77 1HG2 THR 77 -12.613 4.976 2.357 451 HG22 THR 77 2HG2 THR 77 -13.998 5.894 2.987 452 HG23 THR 77 3HG2 THR 77 -12.591 6.759 2.322 453 H VAL 78 H VAL 78 -15.228 8.814 2.383 454 HA VAL 78 HA VAL 78 -13.160 10.656 1.262 455 HB VAL 78 HB VAL 78 -13.870 12.299 2.902 456 HG11 VAL 78 1HG1 VAL 78 -16.159 11.270 1.161 457 HG12 VAL 78 2HG1 VAL 78 -15.982 12.919 1.790 458 HG13 VAL 78 3HG1 VAL 78 -14.824 12.300 0.612 459 HG21 VAL 78 1HG2 VAL 78 -16.001 12.091 4.107 460 HG22 VAL 78 2HG2 VAL 78 -16.148 10.397 3.584 461 HG23 VAL 78 3HG2 VAL 78 -14.837 10.903 4.679 462 H LEU 79 H LEU 79 -11.175 11.001 2.283 463 HA LEU 79 HA LEU 79 -10.649 9.257 4.674 464 HB2 LEU 79 2HB LEU 79 -8.725 10.363 2.600 465 HB3 LEU 79 3HB LEU 79 -8.296 9.347 3.960 466 HG LEU 79 HG LEU 79 -10.116 8.515 1.650 467 HD11 LEU 79 1HD1 LEU 79 -7.838 8.921 0.869 468 HD12 LEU 79 2HD1 LEU 79 -8.168 7.176 0.901 469 HD13 LEU 79 3HD1 LEU 79 -7.181 7.907 2.175 470 HD21 LEU 79 1HD2 LEU 79 -10.576 7.230 3.712 471 HD22 LEU 79 2HD2 LEU 79 -8.844 6.863 3.888 472 HD23 LEU 79 3HD2 LEU 79 -9.760 6.223 2.511 473 H ASP 80 H ASP 80 -9.852 12.470 3.272 474 HA ASP 80 HA ASP 80 -10.628 13.884 5.606 475 HB2 ASP 80 2HB ASP 80 -8.260 12.872 6.274 476 HB3 ASP 80 3HB ASP 80 -7.660 14.112 5.181 477 H GLY 81 H GLY 81 -10.020 16.259 5.431 478 HA2 GLY 81 HA2 GLY 81 -8.644 17.660 3.621 479 HA3 GLY 81 HA3 GLY 81 -10.031 17.240 2.625 480 H ASP 82 H ASP 82 -9.878 19.677 2.630 481 HA ASP 82 HA ASP 82 -11.497 20.927 4.793 482 HB2 ASP 82 2HB ASP 82 -9.621 22.211 3.989 483 HB3 ASP 82 3HB ASP 82 -10.105 22.008 2.327 484 H SER 83 H SER 83 -13.561 20.542 4.690 485 HA SER 83 HA SER 83 -14.628 18.707 3.066 486 HB2 SER 83 2HB SER 83 -16.285 20.772 4.545 487 HB3 SER 83 3HB SER 83 -16.729 19.097 4.165 488 HG SER 83 HG SER 83 -15.980 19.335 6.332 489 H ARG 84 H ARG 84 -14.649 22.072 2.208 490 HA ARG 84 HA ARG 84 -16.807 22.236 0.382 491 HB2 ARG 84 2HB ARG 84 -14.052 23.529 0.273 492 HB3 ARG 84 3HB ARG 84 -15.430 24.007 -0.721 493 HG2 ARG 84 2HG ARG 84 -16.717 24.621 1.300 494 HG3 ARG 84 3HG ARG 84 -15.363 24.139 2.331 495 HD2 ARG 84 2HD ARG 84 -15.226 26.330 0.219 496 HD3 ARG 84 3HD ARG 84 -15.491 26.607 1.939 497 HE ARG 84 HE ARG 84 -13.191 25.063 1.885 498 HH11 ARG 84 1HH1 ARG 84 -11.221 25.761 2.044 499 HH12 ARG 84 2HH1 ARG 84 -10.724 27.349 1.483 500 HH21 ARG 84 1HH2 ARG 84 -13.912 28.165 0.293 501 HH22 ARG 84 2HH2 ARG 84 -12.285 28.728 0.549 502 H LEU 85 H LEU 85 -13.669 20.553 -0.012 503 HA LEU 85 HA LEU 85 -14.248 20.136 -2.902 504 HB2 LEU 85 2HB LEU 85 -11.987 20.665 -2.333 505 HB3 LEU 85 3HB LEU 85 -11.900 19.345 -1.157 506 HG LEU 85 HG LEU 85 -11.946 17.678 -2.864 507 HD11 LEU 85 1HD1 LEU 85 -12.342 19.873 -4.971 508 HD12 LEU 85 2HD1 LEU 85 -13.540 18.633 -4.541 509 HD13 LEU 85 3HD1 LEU 85 -12.021 18.160 -5.299 510 HD21 LEU 85 1HD2 LEU 85 -10.145 19.924 -3.898 511 HD22 LEU 85 2HD2 LEU 85 -9.881 18.164 -4.007 512 HD23 LEU 85 3HD2 LEU 85 -9.810 18.991 -2.440 513 H CYS 86 H CYS 86 -13.846 17.950 0.011 514 HA CYS 86 HA CYS 86 -14.807 15.616 -0.949 515 HB2 CYS 86 2HB CYS 86 -15.744 16.863 1.678 516 HB3 CYS 86 3HB CYS 86 -15.643 15.145 1.281 517 HG CYS 86 HG CYS 86 -13.714 15.746 2.963 518 H ALA 87 H ALA 87 -17.000 18.274 0.112 519 HA ALA 87 HA ALA 87 -19.431 16.895 -0.465 520 HB1 ALA 87 1HB ALA 87 -20.417 19.152 -0.163 521 HB2 ALA 87 2HB ALA 87 -19.189 18.813 1.080 522 HB3 ALA 87 3HB ALA 87 -18.803 19.879 -0.288 523 H ALA 88 H ALA 88 -17.315 18.761 -2.591 524 HA ALA 88 HA ALA 88 -19.295 19.039 -4.721 525 HB1 ALA 88 1HB ALA 88 -17.709 20.834 -4.144 526 HB2 ALA 88 2HB ALA 88 -16.330 19.782 -4.515 527 HB3 ALA 88 3HB ALA 88 -17.443 20.278 -5.806 528 H THR 89 H THR 89 -16.130 17.347 -4.343 529 HA THR 89 HA THR 89 -16.146 15.987 -6.849 530 HB THR 89 HB THR 89 -14.165 16.252 -5.392 531 HG1 THR 89 HG1 THR 89 -13.385 14.205 -5.971 532 HG21 THR 89 1HG2 THR 89 -15.318 15.426 -3.237 533 HG22 THR 89 2HG2 THR 89 -13.685 14.816 -3.571 534 HG23 THR 89 3HG2 THR 89 -15.104 13.790 -3.876 535 H LYS 90 H LYS 90 -17.394 14.919 -3.699 536 HA LYS 90 HA LYS 90 -18.185 12.304 -4.255 537 HB2 LYS 90 2HB LYS 90 -18.163 13.353 -2.077 538 HB3 LYS 90 3HB LYS 90 -19.373 14.538 -2.583 539 HG2 LYS 90 2HG LYS 90 -20.896 12.364 -2.902 540 HG3 LYS 90 3HG LYS 90 -19.694 11.637 -1.817 541 HD2 LYS 90 2HD LYS 90 -21.205 14.227 -1.298 542 HD3 LYS 90 3HD LYS 90 -21.712 12.650 -0.682 543 HE2 LYS 90 2HE LYS 90 -19.468 12.448 0.480 544 HE3 LYS 90 3HE LYS 90 -19.096 14.101 -0.027 545 HZ1 LYS 90 HZ1 LYS 90 -20.013 14.032 2.224 546 HZ2 LYS 90 HZ2 LYS 90 -21.374 13.298 1.705 547 HZ3 LYS 90 HZ3 LYS 90 -21.053 14.839 1.252 548 H ARG 91 H ARG 91 -20.010 15.296 -4.770 549 HA ARG 91 HA ARG 91 -22.288 14.004 -5.991 550 HB2 ARG 91 2HB ARG 91 -21.358 16.895 -5.919 551 HB3 ARG 91 3HB ARG 91 -22.873 16.401 -6.696 552 HG2 ARG 91 2HG ARG 91 -23.727 15.478 -4.604 553 HG3 ARG 91 3HG ARG 91 -22.217 15.873 -3.761 554 HD2 ARG 91 2HD ARG 91 -22.583 18.266 -4.097 555 HD3 ARG 91 3HD ARG 91 -23.976 17.953 -5.128 556 HE ARG 91 HE ARG 91 -25.315 17.566 -3.320 557 HH11 ARG 91 1HH1 ARG 91 -21.995 17.627 -2.091 558 HH12 ARG 91 2HH1 ARG 91 -22.533 17.707 -0.429 559 HH21 ARG 91 1HH2 ARG 91 -25.915 17.685 -1.168 560 HH22 ARG 91 2HH2 ARG 91 -24.707 17.694 0.077 561 H ALA 92 H ALA 92 -19.473 15.712 -7.446 562 HA ALA 92 HA ALA 92 -20.251 15.476 -10.173 563 HB1 ALA 92 1HB ALA 92 -18.472 16.941 -9.418 564 HB2 ALA 92 2HB ALA 92 -17.470 15.564 -8.908 565 HB3 ALA 92 3HB ALA 92 -17.838 15.813 -10.620 566 H VAL 93 H VAL 93 -18.210 13.268 -8.223 567 HA VAL 93 HA VAL 93 -17.838 11.346 -10.267 568 HB VAL 93 HB VAL 93 -17.918 10.513 -7.368 569 HG11 VAL 93 1HG1 VAL 93 -17.409 8.861 -9.232 570 HG12 VAL 93 2HG1 VAL 93 -15.958 9.806 -9.582 571 HG13 VAL 93 3HG1 VAL 93 -16.162 9.033 -7.998 572 HG21 VAL 93 1HG2 VAL 93 -16.359 11.984 -6.756 573 HG22 VAL 93 2HG2 VAL 93 -15.247 11.368 -7.992 574 HG23 VAL 93 3HG2 VAL 93 -16.300 12.700 -8.371 575 H ALA 94 H ALA 94 -20.571 11.910 -8.228 576 HA ALA 94 HA ALA 94 -21.836 9.282 -8.665 577 HB1 ALA 94 1HB ALA 94 -22.122 10.475 -6.523 578 HB2 ALA 94 2HB ALA 94 -22.908 11.831 -7.362 579 HB3 ALA 94 3HB ALA 94 -23.674 10.229 -7.329 580 H GLN 95 H GLN 95 -21.390 12.007 -10.604 581 HA GLN 95 HA GLN 95 -23.808 11.351 -12.245 582 HB2 GLN 95 2HB GLN 95 -24.274 13.685 -12.573 583 HB3 GLN 95 3HB GLN 95 -24.260 13.285 -10.857 584 HG2 GLN 95 2HG GLN 95 -23.051 15.308 -10.854 585 HG3 GLN 95 3HG GLN 95 -21.834 14.139 -10.850 586 HE21 GLN 95 1HE2 GLN 95 -20.265 14.304 -12.489 587 HE22 GLN 95 2HE2 GLN 95 -20.460 15.431 -13.854 588 H VAL 96 H VAL 96 -20.376 11.846 -12.296 589 HA VAL 96 HA VAL 96 -19.984 12.538 -15.019 590 HB VAL 96 HB VAL 96 -17.867 11.209 -14.866 591 HG11 VAL 96 1HG1 VAL 96 -16.715 12.715 -13.471 592 HG12 VAL 96 2HG1 VAL 96 -18.078 13.613 -14.166 593 HG13 VAL 96 3HG1 VAL 96 -18.122 13.045 -12.478 594 HG21 VAL 96 1HG2 VAL 96 -18.293 9.429 -13.364 595 HG22 VAL 96 2HG2 VAL 96 -17.225 10.565 -12.486 596 HG23 VAL 96 3HG2 VAL 96 -18.940 10.512 -12.124 597 H ASN 97 H ASN 97 -19.625 11.355 -16.912 598 HA ASN 97 HA ASN 97 -21.500 9.255 -17.338 599 HB2 ASN 97 2HB ASN 97 -19.302 10.365 -19.136 600 HB3 ASN 97 3HB ASN 97 -20.597 9.295 -19.663 601 HD21 ASN 97 1HD2 ASN 97 -22.899 10.087 -19.425 602 HD22 ASN 97 2HD2 ASN 97 -23.163 11.822 -19.527 603 H SER 98 H SER 98 -17.919 9.124 -17.316 604 HA SER 98 HA SER 98 -17.497 6.532 -16.384 605 HB2 SER 98 2HB SER 98 -16.860 5.322 -18.505 606 HB3 SER 98 3HB SER 98 -18.592 5.473 -18.238 607 HG SER 98 HG SER 98 -18.070 5.981 -20.402 608 H PHE 99 H PHE 99 -15.357 6.011 -16.213 609 HA PHE 99 HA PHE 99 -13.463 8.168 -16.920 610 HB2 PHE 99 2HB PHE 99 -13.011 5.797 -15.096 611 HB3 PHE 99 3HB PHE 99 -12.125 7.308 -15.161 612 HD1 PHE 99 HD1 PHE 99 -14.902 5.495 -13.685 613 HD2 PHE 99 HD2 PHE 99 -13.366 9.467 -14.437 614 HE1 PHE 99 HE1 PHE 99 -16.433 6.419 -11.987 615 HE2 PHE 99 HE2 PHE 99 -14.906 10.372 -12.736 616 HZ PHE 99 HZ PHE 99 -16.411 8.819 -11.472 617 HA PRO 100 HA PRO 100 -12.208 5.126 -20.059 618 HB2 PRO 100 2HB PRO 100 -10.690 6.703 -21.697 619 HB3 PRO 100 3HB PRO 100 -12.477 6.786 -21.643 620 HG2 PRO 100 2HG PRO 100 -10.492 8.584 -20.223 621 HG3 PRO 100 3HG PRO 100 -11.940 9.054 -21.178 622 HD2 PRO 100 2HD PRO 100 -11.963 8.865 -18.449 623 HD3 PRO 100 3HD PRO 100 -13.389 8.438 -19.442 624 H LEU 101 H LEU 101 -10.578 3.670 -19.942 625 HA LEU 101 HA LEU 101 -8.468 4.015 -18.043 626 HB2 LEU 101 2HB LEU 101 -9.057 1.767 -20.031 627 HB3 LEU 101 3HB LEU 101 -7.840 1.714 -18.780 628 HG LEU 101 HG LEU 101 -9.634 1.982 -17.040 629 HD11 LEU 101 1HD1 LEU 101 -11.939 1.188 -17.714 630 HD12 LEU 101 2HD1 LEU 101 -11.494 1.485 -19.407 631 HD13 LEU 101 3HD1 LEU 101 -11.544 2.822 -18.231 632 HD21 LEU 101 1HD2 LEU 101 -8.580 -0.208 -17.662 633 HD22 LEU 101 2HD2 LEU 101 -9.844 -0.446 -18.882 634 HD23 LEU 101 3HD2 LEU 101 -10.263 -0.401 -17.159 635 HA PRO 102 HA PRO 102 -5.167 5.180 -20.907 636 HB2 PRO 102 2HB PRO 102 -2.963 4.777 -19.339 637 HB3 PRO 102 3HB PRO 102 -4.107 6.125 -19.081 638 HG2 PRO 102 2HG PRO 102 -3.980 3.468 -17.621 639 HG3 PRO 102 3HG PRO 102 -4.198 5.106 -16.928 640 HD2 PRO 102 2HD PRO 102 -6.277 3.382 -17.431 641 HD3 PRO 102 3HD PRO 102 -6.448 5.160 -17.521 642 H LYS 103 H LYS 103 -4.709 2.135 -19.028 643 HA LYS 103 HA LYS 103 -4.181 0.646 -21.539 644 HB2 LYS 103 2HB LYS 103 -2.677 0.529 -18.904 645 HB3 LYS 103 3HB LYS 103 -2.836 -0.887 -19.912 646 HG2 LYS 103 2HG LYS 103 -0.846 -0.142 -20.712 647 HG3 LYS 103 3HG LYS 103 -1.927 0.646 -21.847 648 HD2 LYS 103 2HD LYS 103 -0.251 2.202 -21.199 649 HD3 LYS 103 3HD LYS 103 -1.754 2.743 -20.429 650 HE2 LYS 103 2HE LYS 103 -1.064 1.774 -18.296 651 HE3 LYS 103 3HE LYS 103 0.350 1.023 -19.039 652 HZ1 LYS 103 HZ1 LYS 103 -0.055 3.951 -18.774 653 HZ2 LYS 103 HZ2 LYS 103 1.242 3.224 -19.466 654 HZ3 LYS 103 HZ3 LYS 103 0.955 3.034 -17.867 655 H ASP 104 H ASP 104 -4.902 -1.539 -21.513 656 HA ASP 104 HA ASP 104 -7.443 -1.759 -20.003 657 HB2 ASP 104 2HB ASP 104 -7.364 -1.074 -22.423 658 HB3 ASP 104 3HB ASP 104 -6.679 -2.649 -22.814 659 H GLN 105 H GLN 105 -4.694 -3.279 -19.424 660 HA GLN 105 HA GLN 105 -5.404 -6.028 -20.111 661 HB2 GLN 105 2HB GLN 105 -3.027 -4.918 -18.589 662 HB3 GLN 105 3HB GLN 105 -3.336 -6.624 -18.816 663 HG2 GLN 105 2HG GLN 105 -1.768 -5.962 -20.504 664 HG3 GLN 105 3HG GLN 105 -3.296 -6.402 -21.275 665 HE21 GLN 105 1HE2 GLN 105 -1.941 -3.420 -19.777 666 HE22 GLN 105 2HE2 GLN 105 -2.293 -2.387 -21.153 667 HA PRO 106 HA PRO 106 -7.692 -6.752 -16.390 668 HB2 PRO 106 2HB PRO 106 -7.403 -9.466 -16.006 669 HB3 PRO 106 3HB PRO 106 -8.381 -8.745 -17.311 670 HG2 PRO 106 2HG PRO 106 -5.525 -9.729 -17.466 671 HG3 PRO 106 3HG PRO 106 -6.892 -10.119 -18.568 672 HD2 PRO 106 2HD PRO 106 -5.103 -8.192 -19.188 673 HD3 PRO 106 3HD PRO 106 -6.837 -7.945 -19.524 674 H ASP 107 H ASP 107 -4.317 -6.794 -16.351 675 HA ASP 107 HA ASP 107 -4.111 -7.348 -13.430 676 HB2 ASP 107 2HB ASP 107 -2.293 -8.071 -14.996 677 HB3 ASP 107 3HB ASP 107 -1.974 -6.381 -15.366 678 H VAL 108 H VAL 108 -3.937 -4.627 -15.760 679 HA VAL 108 HA VAL 108 -3.462 -2.690 -13.596 680 HB VAL 108 HB VAL 108 -3.208 -1.015 -15.252 681 HG11 VAL 108 1HG1 VAL 108 -1.675 -3.505 -16.134 682 HG12 VAL 108 2HG1 VAL 108 -1.190 -1.818 -16.373 683 HG13 VAL 108 3HG1 VAL 108 -1.275 -2.488 -14.735 684 HG21 VAL 108 1HG2 VAL 108 -3.918 -3.054 -17.375 685 HG22 VAL 108 2HG2 VAL 108 -4.878 -1.634 -16.897 686 HG23 VAL 108 3HG2 VAL 108 -3.290 -1.423 -17.654 687 H VAL 109 H VAL 109 -6.150 -3.766 -15.590 688 HA VAL 109 HA VAL 109 -8.058 -1.724 -15.073 689 HB VAL 109 HB VAL 109 -8.309 -4.742 -15.300 690 HG11 VAL 109 1HG1 VAL 109 -10.311 -4.095 -14.092 691 HG12 VAL 109 2HG1 VAL 109 -10.586 -2.723 -15.191 692 HG13 VAL 109 3HG1 VAL 109 -10.754 -4.389 -15.776 693 HG21 VAL 109 1HG2 VAL 109 -7.580 -3.299 -17.331 694 HG22 VAL 109 2HG2 VAL 109 -8.996 -4.347 -17.562 695 HG23 VAL 109 3HG2 VAL 109 -9.200 -2.613 -17.279 696 H GLU 110 H GLU 110 -6.561 -4.055 -12.911 697 HA GLU 110 HA GLU 110 -8.528 -3.694 -10.765 698 HB2 GLU 110 2HB GLU 110 -5.912 -5.195 -10.756 699 HB3 GLU 110 3HB GLU 110 -7.147 -5.218 -9.491 700 HG2 GLU 110 2HG GLU 110 -8.797 -6.099 -11.187 701 HG3 GLU 110 3HG GLU 110 -7.470 -6.288 -12.322 702 H LYS 111 H LYS 111 -5.981 -1.740 -11.845 703 HA LYS 111 HA LYS 111 -5.209 -0.886 -9.098 704 HB2 LYS 111 2HB LYS 111 -3.944 -0.501 -11.815 705 HB3 LYS 111 3HB LYS 111 -3.652 0.676 -10.543 706 HG2 LYS 111 2HG LYS 111 -1.889 -1.005 -10.625 707 HG3 LYS 111 3HG LYS 111 -2.711 -0.999 -9.063 708 HD2 LYS 111 2HD LYS 111 -3.914 -3.035 -9.583 709 HD3 LYS 111 3HD LYS 111 -3.441 -2.903 -11.293 710 HE2 LYS 111 2HE LYS 111 -1.018 -3.106 -10.492 711 HE3 LYS 111 3HE LYS 111 -1.660 -3.485 -8.883 712 HZ1 LYS 111 HZ1 LYS 111 -2.842 -5.377 -10.006 713 HZ2 LYS 111 HZ2 LYS 111 -1.204 -5.514 -10.076 714 HZ3 LYS 111 HZ3 LYS 111 -2.026 -5.045 -11.391 715 H LEU 112 H LEU 112 -6.303 0.464 -12.149 716 HA LEU 112 HA LEU 112 -6.879 3.079 -11.174 717 HB2 LEU 112 2HB LEU 112 -7.965 3.408 -13.398 718 HB3 LEU 112 3HB LEU 112 -6.346 2.801 -13.390 719 HG LEU 112 HG LEU 112 -7.308 0.524 -13.609 720 HD11 LEU 112 1HD1 LEU 112 -9.594 0.847 -13.167 721 HD12 LEU 112 2HD1 LEU 112 -9.389 0.179 -14.775 722 HD13 LEU 112 3HD1 LEU 112 -9.768 1.902 -14.587 723 HD21 LEU 112 1HD2 LEU 112 -6.024 1.658 -15.371 724 HD22 LEU 112 2HD2 LEU 112 -7.563 2.289 -16.016 725 HD23 LEU 112 3HD2 LEU 112 -7.224 0.539 -16.001 726 H LYS 113 H LYS 113 -8.879 0.158 -10.987 727 HA LYS 113 HA LYS 113 -11.343 1.545 -10.603 728 HB2 LYS 113 2HB LYS 113 -12.097 -0.601 -9.772 729 HB3 LYS 113 3HB LYS 113 -11.192 -0.804 -11.270 730 HG2 LYS 113 2HG LYS 113 -9.193 -1.535 -10.062 731 HG3 LYS 113 3HG LYS 113 -9.937 -1.189 -8.506 732 HD2 LYS 113 2HD LYS 113 -10.792 -3.344 -10.449 733 HD3 LYS 113 3HD LYS 113 -9.906 -3.532 -8.908 734 HE2 LYS 113 2HE LYS 113 -11.787 -2.399 -7.740 735 HE3 LYS 113 3HE LYS 113 -12.708 -2.414 -9.253 736 HZ1 LYS 113 HZ1 LYS 113 -12.599 -4.864 -9.225 737 HZ2 LYS 113 HZ2 LYS 113 -13.317 -4.315 -7.860 738 HZ3 LYS 113 HZ3 LYS 113 -11.766 -4.840 -7.812 739 H ASN 114 H ASN 114 -8.710 0.915 -8.411 740 HA ASN 114 HA ASN 114 -10.235 2.188 -6.181 741 HB2 ASN 114 2HB ASN 114 -8.122 0.036 -5.916 742 HB3 ASN 114 3HB ASN 114 -8.988 0.844 -4.604 743 HD21 ASN 114 1HD2 ASN 114 -11.622 0.781 -5.340 744 HD22 ASN 114 2HD2 ASN 114 -12.142 -0.881 -5.567 745 H ILE 115 H ILE 115 -9.486 4.237 -6.820 746 HA ILE 115 HA ILE 115 -6.576 4.781 -6.412 747 HB ILE 115 HB ILE 115 -6.840 6.837 -7.617 748 HG12 ILE 115 2HG1 ILE 115 -9.289 7.164 -7.197 749 HG13 ILE 115 3HG1 ILE 115 -8.709 7.560 -8.775 750 HG21 ILE 115 1HG2 ILE 115 -5.919 4.986 -8.781 751 HG22 ILE 115 2HG2 ILE 115 -7.510 4.321 -9.153 752 HG23 ILE 115 3HG2 ILE 115 -6.991 5.848 -9.898 753 HD11 ILE 115 1HD1 ILE 115 -9.575 5.443 -9.679 754 HD12 ILE 115 2HD1 ILE 115 -10.280 5.069 -8.098 755 HD13 ILE 115 3HD1 ILE 115 -10.815 6.495 -9.009 756 H ASN 116 H ASN 116 -5.939 6.625 -5.268 757 HA ASN 116 HA ASN 116 -8.062 7.957 -3.661 758 HB2 ASN 116 2HB ASN 116 -5.112 8.572 -3.450 759 HB3 ASN 116 3HB ASN 116 -6.445 9.004 -2.381 760 HD21 ASN 116 1HD2 ASN 116 -7.515 6.096 -2.376 761 HD22 ASN 116 2HD2 ASN 116 -6.393 5.301 -1.308 762 H LEU 117 H LEU 117 -8.704 9.939 -4.193 763 HA LEU 117 HA LEU 117 -7.217 11.590 -6.214 764 HB2 LEU 117 2HB LEU 117 -9.812 12.241 -4.762 765 HB3 LEU 117 3HB LEU 117 -9.042 13.174 -6.047 766 HG LEU 117 HG LEU 117 -10.333 10.404 -6.303 767 HD11 LEU 117 1HD1 LEU 117 -12.074 11.594 -7.597 768 HD12 LEU 117 2HD1 LEU 117 -11.260 13.140 -7.298 769 HD13 LEU 117 3HD1 LEU 117 -11.965 12.225 -5.947 770 HD21 LEU 117 1HD2 LEU 117 -8.507 10.627 -7.940 771 HD22 LEU 117 2HD2 LEU 117 -9.179 12.191 -8.461 772 HD23 LEU 117 3HD2 LEU 117 -10.086 10.696 -8.732 773 H THR 118 H THR 118 -5.595 12.674 -5.262 774 HA THR 118 HA THR 118 -5.926 13.759 -2.512 775 HB THR 118 HB THR 118 -3.454 12.296 -3.506 776 HG1 THR 118 HG1 THR 118 -4.086 10.801 -1.926 777 HG21 THR 118 1HG2 THR 118 -2.811 12.540 -1.050 778 HG22 THR 118 2HG2 THR 118 -4.155 13.687 -0.890 779 HG23 THR 118 3HG2 THR 118 -2.794 14.047 -1.973 780 H VAL 119 H VAL 119 -5.472 15.790 -2.358 781 HA VAL 119 HA VAL 119 -3.828 17.181 -4.419 782 HB VAL 119 HB VAL 119 -5.452 18.848 -4.702 783 HG11 VAL 119 1HG1 VAL 119 -7.043 16.264 -4.785 784 HG12 VAL 119 2HG1 VAL 119 -7.339 17.720 -5.743 785 HG13 VAL 119 3HG1 VAL 119 -5.866 16.769 -6.025 786 HG21 VAL 119 1HG2 VAL 119 -6.366 19.090 -2.431 787 HG22 VAL 119 2HG2 VAL 119 -7.634 18.965 -3.641 788 HG23 VAL 119 3HG2 VAL 119 -7.242 17.551 -2.628 789 H ALA 120 H ALA 120 -3.153 19.340 -3.776 790 HA ALA 120 HA ALA 120 -3.213 20.220 -1.015 791 HB1 ALA 120 1HB ALA 120 -0.660 18.989 -2.159 792 HB2 ALA 120 2HB ALA 120 -0.779 19.835 -0.602 793 HB3 ALA 120 3HB ALA 120 -1.637 18.322 -0.827 794 HA PRO 121 HA PRO 121 -2.453 23.964 -3.060 795 HB2 PRO 121 2HB PRO 121 -1.555 25.676 -1.167 796 HB3 PRO 121 3HB PRO 121 -3.125 24.842 -1.010 797 HG2 PRO 121 2HG PRO 121 -0.475 24.080 0.240 798 HG3 PRO 121 3HG PRO 121 -2.080 24.195 1.035 799 HD2 PRO 121 2HD PRO 121 -1.001 21.844 0.101 800 HD3 PRO 121 3HD PRO 121 -2.757 22.133 0.172 801 H GLU 122 H GLU 122 0.442 22.374 -2.009 802 HA GLU 122 HA GLU 122 2.370 24.323 -2.956 803 HB2 GLU 122 2HB GLU 122 2.594 21.356 -2.307 804 HB3 GLU 122 3HB GLU 122 3.957 22.373 -2.764 805 HG2 GLU 122 2HG GLU 122 2.199 22.809 -0.311 806 HG3 GLU 122 3HG GLU 122 3.773 22.029 -0.317 Start of MODEL 20 1 H1 ALA 22 H ALA 22 9.037 2.887 -23.898 2 HA ALA 22 HA ALA 22 7.165 3.982 -21.943 3 HB1 ALA 22 1HB ALA 22 5.786 2.145 -22.846 4 HB2 ALA 22 2HB ALA 22 7.108 0.998 -22.567 5 HB3 ALA 22 3HB ALA 22 6.306 1.783 -21.196 6 H ALA 23 H ALA 23 9.626 1.514 -22.608 7 HA ALA 23 HA ALA 23 11.681 1.098 -21.771 8 HB1 ALA 23 1HB ALA 23 11.770 3.564 -21.341 9 HB2 ALA 23 2HB ALA 23 11.249 3.259 -19.663 10 HB3 ALA 23 3HB ALA 23 12.775 2.576 -20.253 11 H ARG 24 H ARG 24 9.494 1.800 -19.066 12 HA ARG 24 HA ARG 24 8.437 0.560 -17.588 13 HB2 ARG 24 2HB ARG 24 9.283 -1.881 -19.186 14 HB3 ARG 24 3HB ARG 24 7.954 -1.781 -18.028 15 HG2 ARG 24 2HG ARG 24 6.891 -0.008 -19.466 16 HG3 ARG 24 3HG ARG 24 8.155 -0.286 -20.672 17 HD2 ARG 24 2HD ARG 24 7.506 -2.655 -20.839 18 HD3 ARG 24 3HD ARG 24 6.194 -2.380 -19.683 19 HE ARG 24 HE ARG 24 6.169 -1.855 -22.502 20 HH11 ARG 24 1HH1 ARG 24 4.813 -0.448 -19.543 21 HH12 ARG 24 2HH1 ARG 24 3.510 0.290 -20.424 22 HH21 ARG 24 1HH2 ARG 24 4.550 -0.903 -23.527 23 HH22 ARG 24 2HH2 ARG 24 3.374 0.082 -22.671 24 H GLN 25 H GLN 25 11.540 0.875 -17.407 25 HA GLN 25 HA GLN 25 12.141 -1.190 -15.373 26 HB2 GLN 25 2HB GLN 25 13.949 1.039 -16.308 27 HB3 GLN 25 3HB GLN 25 14.401 -0.439 -15.471 28 HG2 GLN 25 2HG GLN 25 13.442 -0.174 -18.348 29 HG3 GLN 25 3HG GLN 25 15.053 -0.593 -17.810 30 HE21 GLN 25 1HE2 GLN 25 12.118 -1.901 -18.921 31 HE22 GLN 25 2HE2 GLN 25 12.389 -3.550 -18.367 32 H GLN 26 H GLN 26 11.116 2.084 -15.550 33 HA GLN 26 HA GLN 26 11.430 2.555 -12.621 34 HB2 GLN 26 2HB GLN 26 12.461 4.651 -13.009 35 HB3 GLN 26 3HB GLN 26 13.404 3.418 -13.848 36 HG2 GLN 26 2HG GLN 26 11.413 5.327 -15.139 37 HG3 GLN 26 3HG GLN 26 13.172 5.493 -15.167 38 HE21 GLN 26 1HE2 GLN 26 14.443 3.818 -16.401 39 HE22 GLN 26 2HE2 GLN 26 13.623 2.983 -17.712 40 H PHE 27 H PHE 27 9.672 3.207 -15.586 41 HA PHE 27 HA PHE 27 8.342 5.514 -15.011 42 HB2 PHE 27 2HB PHE 27 7.270 5.168 -16.925 43 HB3 PHE 27 3HB PHE 27 8.608 4.044 -17.162 44 HD1 PHE 27 HD1 PHE 27 7.683 1.683 -15.596 45 HD2 PHE 27 HD2 PHE 27 5.461 4.395 -18.080 46 HE1 PHE 27 HE1 PHE 27 5.939 -0.055 -15.921 47 HE2 PHE 27 HE2 PHE 27 3.749 2.639 -18.473 48 HZ PHE 27 HZ PHE 27 3.961 0.419 -17.367 49 H VAL 28 H VAL 28 7.689 2.807 -13.148 50 HA VAL 28 HA VAL 28 4.834 2.664 -13.082 51 HB VAL 28 HB VAL 28 5.139 1.695 -10.774 52 HG11 VAL 28 1HG1 VAL 28 6.143 -0.405 -11.632 53 HG12 VAL 28 2HG1 VAL 28 5.026 0.305 -12.816 54 HG13 VAL 28 3HG1 VAL 28 6.793 0.461 -13.038 55 HG21 VAL 28 1HG2 VAL 28 8.124 1.903 -11.351 56 HG22 VAL 28 2HG2 VAL 28 7.241 2.801 -10.088 57 HG23 VAL 28 3HG2 VAL 28 7.362 1.040 -10.011 58 H THR 29 H THR 29 7.052 4.821 -11.440 59 HA THR 29 HA THR 29 5.126 6.126 -9.731 60 HB THR 29 HB THR 29 7.455 6.182 -9.281 61 HG1 THR 29 HG1 THR 29 7.557 8.400 -8.852 62 HG21 THR 29 1HG2 THR 29 7.895 8.057 -11.648 63 HG22 THR 29 2HG2 THR 29 8.282 6.328 -11.724 64 HG23 THR 29 3HG2 THR 29 9.102 7.362 -10.547 65 H SER 30 H SER 30 6.398 6.952 -12.975 66 HA SER 30 HA SER 30 4.869 9.270 -13.437 67 HB2 SER 30 2HB SER 30 5.691 7.235 -15.544 68 HB3 SER 30 3HB SER 30 5.526 8.978 -15.738 69 HG SER 30 HG SER 30 7.383 9.261 -14.456 70 H GLU 31 H GLU 31 3.960 5.854 -13.821 71 HA GLU 31 HA GLU 31 1.426 6.373 -15.071 72 HB2 GLU 31 2HB GLU 31 2.248 4.044 -13.293 73 HB3 GLU 31 3HB GLU 31 0.811 4.101 -14.294 74 HG2 GLU 31 2HG GLU 31 3.654 4.229 -15.332 75 HG3 GLU 31 3HG GLU 31 2.619 2.809 -15.337 76 H VAL 32 H VAL 32 2.386 6.741 -11.641 77 HA VAL 32 HA VAL 32 -0.359 6.753 -10.651 78 HB VAL 32 HB VAL 32 2.056 8.162 -9.445 79 HG11 VAL 32 1HG1 VAL 32 -0.023 8.976 -8.466 80 HG12 VAL 32 2HG1 VAL 32 -0.594 7.308 -8.218 81 HG13 VAL 32 3HG1 VAL 32 0.806 7.928 -7.315 82 HG21 VAL 32 1HG2 VAL 32 2.234 6.161 -7.973 83 HG22 VAL 32 2HG2 VAL 32 0.994 5.344 -8.946 84 HG23 VAL 32 3HG2 VAL 32 2.566 5.767 -9.654 85 H GLY 33 H GLY 33 1.700 9.009 -12.342 86 HA2 GLY 33 HA2 GLY 33 0.090 11.402 -11.965 87 HA3 GLY 33 HA3 GLY 33 1.391 11.145 -13.163 88 H ARG 34 H ARG 34 -0.291 8.586 -13.999 89 HA ARG 34 HA ARG 34 -2.306 10.050 -15.664 90 HB2 ARG 34 2HB ARG 34 -1.139 7.272 -16.073 91 HB3 ARG 34 3HB ARG 34 -2.235 8.165 -17.136 92 HG2 ARG 34 2HG ARG 34 -0.374 10.013 -17.102 93 HG3 ARG 34 3HG ARG 34 0.690 8.729 -16.506 94 HD2 ARG 34 2HD ARG 34 -0.952 8.604 -19.060 95 HD3 ARG 34 3HD ARG 34 0.744 9.103 -18.975 96 HE ARG 34 HE ARG 34 0.991 6.683 -17.874 97 HH11 ARG 34 1HH1 ARG 34 -0.612 7.609 -20.920 98 HH12 ARG 34 2HH1 ARG 34 -0.232 6.068 -21.638 99 HH21 ARG 34 1HH2 ARG 34 1.361 4.825 -18.809 100 HH22 ARG 34 2HH2 ARG 34 1.079 4.623 -20.549 101 H TYR 35 H TYR 35 -1.977 6.942 -13.936 102 HA TYR 35 HA TYR 35 -4.502 5.908 -14.337 103 HB2 TYR 35 2HB TYR 35 -2.374 5.479 -12.234 104 HB3 TYR 35 3HB TYR 35 -3.929 4.713 -12.030 105 HD1 TYR 35 HD1 TYR 35 -1.497 5.232 -14.895 106 HD2 TYR 35 HD2 TYR 35 -4.110 2.553 -12.773 107 HE1 TYR 35 HE1 TYR 35 -1.177 3.537 -16.670 108 HE2 TYR 35 HE2 TYR 35 -3.843 0.860 -14.548 109 HH TYR 35 HH TYR 35 -2.829 0.352 -16.557 110 H GLY 36 H GLY 36 -3.596 7.901 -11.579 111 HA2 GLY 36 HA2 GLY 36 -6.361 8.078 -10.572 112 HA3 GLY 36 HA3 GLY 36 -4.929 8.854 -9.897 113 H ALA 37 H ALA 37 -4.483 9.840 -12.925 114 HA ALA 37 HA ALA 37 -5.752 12.387 -12.440 115 HB1 ALA 37 1HB ALA 37 -4.468 13.157 -14.361 116 HB2 ALA 37 2HB ALA 37 -3.433 12.270 -13.228 117 HB3 ALA 37 3HB ALA 37 -3.987 11.496 -14.743 118 H ILE 38 H ILE 38 -6.274 9.583 -14.570 119 HA ILE 38 HA ILE 38 -8.132 10.822 -16.367 120 HB ILE 38 HB ILE 38 -8.818 8.601 -16.942 121 HG12 ILE 38 2HG1 ILE 38 -7.763 7.784 -14.225 122 HG13 ILE 38 3HG1 ILE 38 -9.409 7.650 -14.836 123 HG21 ILE 38 1HG2 ILE 38 -5.927 8.128 -16.139 124 HG22 ILE 38 2HG2 ILE 38 -6.789 7.606 -17.588 125 HG23 ILE 38 3HG2 ILE 38 -6.358 9.307 -17.406 126 HD11 ILE 38 1HD1 ILE 38 -8.422 5.474 -14.755 127 HD12 ILE 38 2HD1 ILE 38 -8.691 5.914 -16.439 128 HD13 ILE 38 3HD1 ILE 38 -7.041 5.978 -15.730 129 H TYR 39 H TYR 39 -8.501 9.807 -13.089 130 HA TYR 39 HA TYR 39 -11.421 10.078 -13.067 131 HB2 TYR 39 2HB TYR 39 -9.462 9.779 -10.759 132 HB3 TYR 39 3HB TYR 39 -11.208 9.681 -10.657 133 HD1 TYR 39 HD1 TYR 39 -8.161 7.839 -11.586 134 HD2 TYR 39 HD2 TYR 39 -12.456 7.820 -11.639 135 HE1 TYR 39 HE1 TYR 39 -8.117 5.409 -12.304 136 HE2 TYR 39 HE2 TYR 39 -12.403 5.485 -12.533 137 HH TYR 39 HH TYR 39 -11.172 3.750 -13.221 138 H THR 40 H THR 40 -8.689 11.855 -11.559 139 HA THR 40 HA THR 40 -10.243 13.917 -10.391 140 HB THR 40 HB THR 40 -7.806 13.139 -9.961 141 HG1 THR 40 HG1 THR 40 -7.447 15.195 -9.030 142 HG21 THR 40 1HG2 THR 40 -7.066 15.529 -11.667 143 HG22 THR 40 2HG2 THR 40 -7.058 13.885 -12.320 144 HG23 THR 40 3HG2 THR 40 -6.019 14.266 -10.948 145 H GLN 41 H GLN 41 -8.816 13.740 -13.631 146 HA GLN 41 HA GLN 41 -9.348 16.488 -14.362 147 HB2 GLN 41 2HB GLN 41 -8.756 13.947 -15.935 148 HB3 GLN 41 3HB GLN 41 -8.982 15.519 -16.697 149 HG2 GLN 41 2HG GLN 41 -6.807 14.854 -14.664 150 HG3 GLN 41 3HG GLN 41 -6.585 14.985 -16.403 151 HE21 GLN 41 1HE2 GLN 41 -5.260 16.553 -14.230 152 HE22 GLN 41 2HE2 GLN 41 -5.703 18.222 -14.544 153 H LEU 42 H LEU 42 -11.132 13.366 -14.790 154 HA LEU 42 HA LEU 42 -13.233 14.628 -16.326 155 HB2 LEU 42 2HB LEU 42 -12.695 12.174 -16.329 156 HB3 LEU 42 3HB LEU 42 -13.343 12.105 -14.677 157 HG LEU 42 HG LEU 42 -15.569 12.753 -15.490 158 HD11 LEU 42 1HD1 LEU 42 -16.046 12.808 -17.954 159 HD12 LEU 42 2HD1 LEU 42 -14.297 12.783 -18.269 160 HD13 LEU 42 3HD1 LEU 42 -15.041 14.162 -17.434 161 HD21 LEU 42 1HD2 LEU 42 -14.327 10.444 -17.009 162 HD22 LEU 42 2HD2 LEU 42 -16.080 10.734 -16.818 163 HD23 LEU 42 3HD2 LEU 42 -15.086 10.404 -15.396 164 H ILE 43 H ILE 43 -12.731 14.145 -12.839 165 HA ILE 43 HA ILE 43 -15.324 15.062 -12.020 166 HB ILE 43 HB ILE 43 -12.632 14.631 -10.722 167 HG12 ILE 43 2HG1 ILE 43 -14.117 13.330 -9.175 168 HG13 ILE 43 3HG1 ILE 43 -15.524 13.858 -10.123 169 HG21 ILE 43 1HG2 ILE 43 -13.298 16.788 -9.706 170 HG22 ILE 43 2HG2 ILE 43 -14.919 16.108 -9.366 171 HG23 ILE 43 3HG2 ILE 43 -13.453 15.452 -8.577 172 HD11 ILE 43 1HD1 ILE 43 -14.986 11.597 -10.728 173 HD12 ILE 43 2HD1 ILE 43 -14.522 12.618 -12.096 174 HD13 ILE 43 3HD1 ILE 43 -13.280 11.988 -10.977 175 H ARG 44 H ARG 44 -12.242 16.847 -12.283 176 HA ARG 44 HA ARG 44 -13.455 19.334 -11.527 177 HB2 ARG 44 2HB ARG 44 -11.375 20.355 -11.857 178 HB3 ARG 44 3HB ARG 44 -11.112 18.721 -11.253 179 HG2 ARG 44 2HG ARG 44 -9.447 18.870 -12.819 180 HG3 ARG 44 3HG ARG 44 -10.731 18.083 -13.713 181 HD2 ARG 44 2HD ARG 44 -11.358 20.466 -14.551 182 HD3 ARG 44 3HD ARG 44 -9.784 20.957 -13.914 183 HE ARG 44 HE ARG 44 -8.858 19.050 -15.390 184 HH11 ARG 44 1HH1 ARG 44 -11.614 21.012 -16.470 185 HH12 ARG 44 2HH1 ARG 44 -11.612 20.242 -18.040 186 HH21 ARG 44 1HH2 ARG 44 -8.764 18.336 -17.405 187 HH22 ARG 44 2HH2 ARG 44 -9.911 18.892 -18.624 188 H GLN 45 H GLN 45 -13.388 17.737 -14.572 189 HA GLN 45 HA GLN 45 -14.050 19.912 -16.380 190 HB2 GLN 45 2HB GLN 45 -15.083 17.060 -16.195 191 HB3 GLN 45 3HB GLN 45 -15.526 18.143 -17.501 192 HG2 GLN 45 2HG GLN 45 -12.620 17.806 -16.979 193 HG3 GLN 45 3HG GLN 45 -13.483 16.406 -17.616 194 HE21 GLN 45 1HE2 GLN 45 -14.663 16.711 -19.732 195 HE22 GLN 45 2HE2 GLN 45 -14.023 17.911 -20.843 196 H ASN 46 H ASN 46 -15.940 18.272 -13.818 197 HA ASN 46 HA ASN 46 -18.461 19.486 -14.767 198 HB2 ASN 46 2HB ASN 46 -17.786 18.078 -12.155 199 HB3 ASN 46 3HB ASN 46 -19.414 18.508 -12.713 200 HD21 ASN 46 1HD2 ASN 46 -17.007 16.122 -12.713 201 HD22 ASN 46 2HD2 ASN 46 -17.839 15.052 -13.840 202 H LEU 47 H LEU 47 -15.994 20.187 -12.355 203 HA LEU 47 HA LEU 47 -17.310 22.733 -11.630 204 HB2 LEU 47 2HB LEU 47 -16.098 21.683 -9.287 205 HB3 LEU 47 3HB LEU 47 -17.744 22.188 -9.565 206 HG LEU 47 HG LEU 47 -17.930 19.655 -10.507 207 HD11 LEU 47 1HD1 LEU 47 -15.465 19.251 -10.122 208 HD12 LEU 47 2HD1 LEU 47 -16.498 18.147 -9.179 209 HD13 LEU 47 3HD1 LEU 47 -15.727 19.518 -8.382 210 HD21 LEU 47 1HD2 LEU 47 -18.609 18.970 -8.219 211 HD22 LEU 47 2HD2 LEU 47 -19.340 20.482 -8.789 212 HD23 LEU 47 3HD2 LEU 47 -18.002 20.537 -7.619 213 H LEU 48 H LEU 48 -15.834 23.615 -13.137 214 HA LEU 48 HA LEU 48 -12.974 23.534 -12.656 215 HB2 LEU 48 2HB LEU 48 -12.833 25.118 -14.480 216 HB3 LEU 48 3HB LEU 48 -13.826 23.745 -14.896 217 HG LEU 48 HG LEU 48 -15.364 26.016 -13.885 218 HD11 LEU 48 1HD1 LEU 48 -15.255 27.280 -16.029 219 HD12 LEU 48 2HD1 LEU 48 -13.948 26.207 -16.567 220 HD13 LEU 48 3HD1 LEU 48 -13.710 27.276 -15.168 221 HD21 LEU 48 1HD2 LEU 48 -15.644 24.274 -16.365 222 HD22 LEU 48 2HD2 LEU 48 -16.864 25.428 -15.745 223 HD23 LEU 48 3HD2 LEU 48 -16.450 23.986 -14.806 224 H VAL 49 H VAL 49 -13.973 24.142 -10.275 225 HA VAL 49 HA VAL 49 -14.462 26.965 -9.855 226 HB VAL 49 HB VAL 49 -14.185 24.742 -7.813 227 HG11 VAL 49 1HG1 VAL 49 -13.828 26.898 -6.690 228 HG12 VAL 49 2HG1 VAL 49 -15.257 27.583 -7.482 229 HG13 VAL 49 3HG1 VAL 49 -15.422 26.272 -6.286 230 HG21 VAL 49 1HG2 VAL 49 -16.674 26.026 -9.030 231 HG22 VAL 49 2HG2 VAL 49 -16.088 24.381 -9.360 232 HG23 VAL 49 3HG2 VAL 49 -16.650 24.807 -7.736 233 H GLU 50 H GLU 50 -11.950 24.829 -8.534 234 HA GLU 50 HA GLU 50 -9.783 25.062 -8.013 235 HB2 GLU 50 2HB GLU 50 -9.762 27.803 -9.337 236 HB3 GLU 50 3HB GLU 50 -8.395 26.780 -8.935 237 HG2 GLU 50 2HG GLU 50 -9.311 25.028 -10.510 238 HG3 GLU 50 3HG GLU 50 -10.544 26.194 -11.010 239 H ASP 51 H ASP 51 -11.428 28.208 -7.397 240 HA ASP 51 HA ASP 51 -9.703 29.107 -5.380 241 HB2 ASP 51 2HB ASP 51 -11.324 30.469 -6.679 242 HB3 ASP 51 3HB ASP 51 -12.655 29.710 -5.801 243 H SER 52 H SER 52 -12.510 26.997 -5.060 244 HA SER 52 HA SER 52 -12.261 26.889 -2.083 245 HB2 SER 52 2HB SER 52 -14.253 25.657 -4.016 246 HB3 SER 52 3HB SER 52 -14.224 25.326 -2.280 247 HG SER 52 HG SER 52 -14.548 27.895 -3.470 248 H PHE 53 H PHE 53 -10.586 25.462 -4.545 249 HA PHE 53 HA PHE 53 -10.259 22.824 -3.180 250 HB2 PHE 53 2HB PHE 53 -9.682 23.630 -6.038 251 HB3 PHE 53 3HB PHE 53 -9.546 22.021 -5.342 252 HD1 PHE 53 HD1 PHE 53 -11.156 22.801 -7.830 253 HD2 PHE 53 HD2 PHE 53 -12.327 22.379 -3.690 254 HE1 PHE 53 HE1 PHE 53 -13.425 22.129 -8.505 255 HE2 PHE 53 HE2 PHE 53 -14.605 21.817 -4.380 256 HZ PHE 53 HZ PHE 53 -15.172 21.655 -6.813 257 H ARG 54 H ARG 54 -8.625 25.749 -4.166 258 HA ARG 54 HA ARG 54 -5.924 24.733 -3.678 259 HB2 ARG 54 2HB ARG 54 -5.180 26.813 -4.572 260 HB3 ARG 54 3HB ARG 54 -6.484 26.190 -5.567 261 HG2 ARG 54 2HG ARG 54 -6.959 28.436 -5.514 262 HG3 ARG 54 3HG ARG 54 -8.048 27.781 -4.301 263 HD2 ARG 54 2HD ARG 54 -7.098 29.928 -3.636 264 HD3 ARG 54 3HD ARG 54 -6.656 28.647 -2.503 265 HE ARG 54 HE ARG 54 -4.660 29.030 -4.578 266 HH11 ARG 54 1HH1 ARG 54 -5.752 30.467 -1.535 267 HH12 ARG 54 2HH1 ARG 54 -4.183 31.134 -1.188 268 HH21 ARG 54 1HH2 ARG 54 -2.663 29.905 -4.057 269 HH22 ARG 54 2HH2 ARG 54 -2.461 30.825 -2.601 270 H GLY 55 H GLY 55 -4.424 25.901 -2.310 271 HA2 GLY 55 HA2 GLY 55 -3.675 27.019 -0.425 272 HA3 GLY 55 HA3 GLY 55 -5.320 27.637 -0.155 273 H LYS 56 H LYS 56 -6.013 24.539 -0.255 274 HA LYS 56 HA LYS 56 -5.184 23.756 2.497 275 HB2 LYS 56 2HB LYS 56 -7.518 22.903 2.820 276 HB3 LYS 56 3HB LYS 56 -7.365 24.645 2.726 277 HG2 LYS 56 2HG LYS 56 -9.329 24.019 1.577 278 HG3 LYS 56 3HG LYS 56 -8.209 24.639 0.403 279 HD2 LYS 56 2HD LYS 56 -7.718 22.455 -0.458 280 HD3 LYS 56 3HD LYS 56 -8.570 21.634 0.873 281 HE2 LYS 56 2HE LYS 56 -9.770 23.397 -1.282 282 HE3 LYS 56 3HE LYS 56 -9.787 21.623 -1.281 283 HZ1 LYS 56 HZ1 LYS 56 -11.308 21.657 0.562 284 HZ2 LYS 56 HZ2 LYS 56 -11.845 22.782 -0.536 285 HZ3 LYS 56 HZ3 LYS 56 -11.113 23.265 0.818 286 H GLN 57 H GLN 57 -6.273 21.244 2.632 287 HA GLN 57 HA GLN 57 -5.297 19.798 0.214 288 HB2 GLN 57 2HB GLN 57 -3.776 18.576 1.392 289 HB3 GLN 57 3HB GLN 57 -3.716 20.020 2.315 290 HG2 GLN 57 2HG GLN 57 -3.936 18.599 4.044 291 HG3 GLN 57 3HG GLN 57 -5.653 18.831 3.736 292 HE21 GLN 57 1HE2 GLN 57 -4.177 16.792 1.373 293 HE22 GLN 57 2HE2 GLN 57 -4.819 15.313 2.077 294 H CYS 58 H CYS 58 -6.184 17.584 0.016 295 HA CYS 58 HA CYS 58 -8.200 16.700 1.897 296 HB2 CYS 58 2HB CYS 58 -9.536 18.255 0.478 297 HB3 CYS 58 3HB CYS 58 -8.981 17.385 -0.961 298 HG CYS 58 HG CYS 58 -10.515 15.867 1.560 299 H ARG 59 H ARG 59 -8.482 14.516 1.818 300 HA ARG 59 HA ARG 59 -7.400 12.994 -0.462 301 HB2 ARG 59 2HB ARG 59 -6.593 11.232 0.954 302 HB3 ARG 59 3HB ARG 59 -5.694 12.706 1.198 303 HG2 ARG 59 2HG ARG 59 -7.899 12.236 3.150 304 HG3 ARG 59 3HG ARG 59 -6.591 11.069 3.163 305 HD2 ARG 59 2HD ARG 59 -5.068 13.216 3.337 306 HD3 ARG 59 3HD ARG 59 -6.606 14.009 3.785 307 HE ARG 59 HE ARG 59 -6.085 11.536 5.232 308 HH11 ARG 59 1HH1 ARG 59 -5.410 15.017 5.378 309 HH12 ARG 59 2HH1 ARG 59 -5.036 14.943 7.084 310 HH21 ARG 59 1HH2 ARG 59 -5.623 11.542 7.413 311 HH22 ARG 59 2HH2 ARG 59 -5.193 13.020 8.211 312 H VAL 60 H VAL 60 -8.876 11.675 -1.321 313 HA VAL 60 HA VAL 60 -10.878 10.343 0.407 314 HB VAL 60 HB VAL 60 -12.757 10.819 -1.031 315 HG11 VAL 60 1HG1 VAL 60 -12.277 12.416 0.847 316 HG12 VAL 60 2HG1 VAL 60 -11.457 13.469 -0.293 317 HG13 VAL 60 3HG1 VAL 60 -13.186 13.147 -0.499 318 HG21 VAL 60 1HG2 VAL 60 -10.973 12.673 -2.653 319 HG22 VAL 60 2HG2 VAL 60 -11.601 11.099 -3.205 320 HG23 VAL 60 3HG2 VAL 60 -12.721 12.437 -2.856 321 H ASN 61 H ASN 61 -11.985 8.547 -0.985 322 HA ASN 61 HA ASN 61 -10.064 7.541 -2.988 323 HB2 ASN 61 2HB ASN 61 -9.455 6.578 -0.878 324 HB3 ASN 61 3HB ASN 61 -11.121 6.159 -0.500 325 HD21 ASN 61 1HD2 ASN 61 -12.183 4.527 -1.959 326 HD22 ASN 61 2HD2 ASN 61 -11.158 3.308 -2.707 327 H LEU 62 H LEU 62 -10.856 6.632 -4.728 328 HA LEU 62 HA LEU 62 -13.844 6.350 -4.972 329 HB2 LEU 62 2HB LEU 62 -11.612 7.095 -6.844 330 HB3 LEU 62 3HB LEU 62 -12.995 6.254 -7.506 331 HG LEU 62 HG LEU 62 -14.501 8.020 -6.743 332 HD11 LEU 62 1HD1 LEU 62 -13.543 10.207 -5.918 333 HD12 LEU 62 2HD1 LEU 62 -11.987 9.378 -5.671 334 HD13 LEU 62 3HD1 LEU 62 -13.410 8.899 -4.742 335 HD21 LEU 62 1HD2 LEU 62 -13.639 9.790 -8.309 336 HD22 LEU 62 2HD2 LEU 62 -13.462 8.161 -8.972 337 HD23 LEU 62 3HD2 LEU 62 -12.051 9.006 -8.282 338 H LYS 63 H LYS 63 -14.717 4.469 -5.255 339 HA LYS 63 HA LYS 63 -13.043 2.099 -6.012 340 HB2 LYS 63 2HB LYS 63 -15.593 2.160 -4.341 341 HB3 LYS 63 3HB LYS 63 -14.601 0.745 -4.708 342 HG2 LYS 63 2HG LYS 63 -12.703 1.801 -3.439 343 HG3 LYS 63 3HG LYS 63 -13.786 3.146 -3.012 344 HD2 LYS 63 2HD LYS 63 -15.338 1.510 -1.920 345 HD3 LYS 63 3HD LYS 63 -14.152 0.227 -2.250 346 HE2 LYS 63 2HE LYS 63 -12.468 1.419 -0.899 347 HE3 LYS 63 3HE LYS 63 -13.576 2.772 -0.651 348 HZ1 LYS 63 HZ1 LYS 63 -15.038 1.287 0.575 349 HZ2 LYS 63 HZ2 LYS 63 -13.554 1.282 1.251 350 HZ3 LYS 63 HZ3 LYS 63 -14.042 0.008 0.342 351 H LEU 64 H LEU 64 -13.344 1.969 -8.222 352 HA LEU 64 HA LEU 64 -16.080 2.355 -9.276 353 HB2 LEU 64 2HB LEU 64 -13.495 2.045 -10.819 354 HB3 LEU 64 3HB LEU 64 -15.063 2.544 -11.424 355 HG LEU 64 HG LEU 64 -13.970 4.483 -11.461 356 HD11 LEU 64 1HD1 LEU 64 -15.978 4.884 -10.265 357 HD12 LEU 64 2HD1 LEU 64 -14.732 6.007 -9.752 358 HD13 LEU 64 3HD1 LEU 64 -15.182 4.656 -8.692 359 HD21 LEU 64 1HD2 LEU 64 -11.902 3.799 -10.441 360 HD22 LEU 64 2HD2 LEU 64 -12.603 3.978 -8.802 361 HD23 LEU 64 3HD2 LEU 64 -12.429 5.383 -9.856 362 H ILE 65 H ILE 65 -16.866 0.992 -10.870 363 HA ILE 65 HA ILE 65 -16.027 -1.892 -10.780 364 HB ILE 65 HB ILE 65 -18.301 -2.270 -11.839 365 HG12 ILE 65 2HG1 ILE 65 -19.071 0.427 -10.657 366 HG13 ILE 65 3HG1 ILE 65 -18.613 0.279 -12.354 367 HG21 ILE 65 1HG2 ILE 65 -19.444 -2.280 -9.651 368 HG22 ILE 65 2HG2 ILE 65 -17.776 -2.829 -9.497 369 HG23 ILE 65 3HG2 ILE 65 -18.219 -1.179 -8.991 370 HD11 ILE 65 1HD1 ILE 65 -20.921 -1.160 -11.043 371 HD12 ILE 65 2HD1 ILE 65 -20.991 0.231 -12.148 372 HD13 ILE 65 3HD1 ILE 65 -20.390 -1.338 -12.744 373 HA PRO 66 HA PRO 66 -14.745 -1.145 -15.018 374 HB2 PRO 66 2HB PRO 66 -14.562 -3.664 -16.036 375 HB3 PRO 66 3HB PRO 66 -13.419 -3.019 -14.811 376 HG2 PRO 66 2HG PRO 66 -15.840 -4.786 -14.352 377 HG3 PRO 66 3HG PRO 66 -14.195 -4.983 -13.690 378 HD2 PRO 66 2HD PRO 66 -16.241 -3.797 -12.289 379 HD3 PRO 66 3HD PRO 66 -14.540 -3.272 -12.107 380 H THR 67 H THR 67 -15.893 -0.495 -16.749 381 HA THR 67 HA THR 67 -18.536 -1.760 -17.360 382 HB THR 67 HB THR 67 -18.206 0.753 -16.604 383 HG1 THR 67 HG1 THR 67 -19.927 -0.167 -18.657 384 HG21 THR 67 1HG2 THR 67 -16.793 1.432 -18.514 385 HG22 THR 67 2HG2 THR 67 -18.321 2.322 -18.419 386 HG23 THR 67 3HG2 THR 67 -18.128 1.028 -19.621 387 H GLY 68 H GLY 68 -15.432 -1.794 -18.428 388 HA2 GLY 68 HA2 GLY 68 -14.693 -3.066 -20.283 389 HA3 GLY 68 HA3 GLY 68 -16.191 -2.681 -21.172 390 H THR 69 H THR 69 -16.386 -0.057 -21.277 391 HA THR 69 HA THR 69 -14.089 0.915 -22.838 392 HB THR 69 HB THR 69 -15.549 2.959 -23.091 393 HG1 THR 69 HG1 THR 69 -17.681 2.738 -22.326 394 HG21 THR 69 1HG2 THR 69 -16.953 0.324 -23.753 395 HG22 THR 69 2HG2 THR 69 -15.656 1.063 -24.714 396 HG23 THR 69 3HG2 THR 69 -17.202 1.898 -24.547 397 H GLY 70 H GLY 70 -15.246 1.278 -19.576 398 HA2 GLY 70 HA2 GLY 70 -12.847 2.742 -18.748 399 HA3 GLY 70 HA3 GLY 70 -14.339 3.655 -18.638 400 H ALA 71 H ALA 71 -13.820 3.650 -16.285 401 HA ALA 71 HA ALA 71 -15.122 1.308 -14.994 402 HB1 ALA 71 1HB ALA 71 -13.464 3.385 -13.548 403 HB2 ALA 71 2HB ALA 71 -13.909 1.728 -13.050 404 HB3 ALA 71 3HB ALA 71 -12.722 1.970 -14.325 405 H LEU 72 H LEU 72 -16.676 1.897 -13.251 406 HA LEU 72 HA LEU 72 -18.037 4.550 -13.544 407 HB2 LEU 72 2HB LEU 72 -18.969 1.910 -14.312 408 HB3 LEU 72 3HB LEU 72 -19.852 2.364 -12.864 409 HG LEU 72 HG LEU 72 -20.617 4.453 -13.946 410 HD11 LEU 72 1HD1 LEU 72 -18.952 3.405 -16.272 411 HD12 LEU 72 2HD1 LEU 72 -18.856 4.986 -15.467 412 HD13 LEU 72 3HD1 LEU 72 -20.257 4.589 -16.478 413 HD21 LEU 72 1HD2 LEU 72 -22.143 3.380 -15.568 414 HD22 LEU 72 2HD2 LEU 72 -21.967 2.382 -14.119 415 HD23 LEU 72 3HD2 LEU 72 -21.113 1.930 -15.612 416 H LEU 73 H LEU 73 -18.889 5.434 -11.624 417 HA LEU 73 HA LEU 73 -17.684 4.694 -9.185 418 HB2 LEU 73 2HB LEU 73 -18.575 6.921 -9.880 419 HB3 LEU 73 3HB LEU 73 -20.196 6.362 -9.503 420 HG LEU 73 HG LEU 73 -19.024 7.839 -7.805 421 HD11 LEU 73 1HD1 LEU 73 -19.907 5.151 -6.688 422 HD12 LEU 73 2HD1 LEU 73 -20.983 6.474 -7.167 423 HD13 LEU 73 3HD1 LEU 73 -19.833 6.699 -5.832 424 HD21 LEU 73 1HD2 LEU 73 -17.440 5.350 -7.049 425 HD22 LEU 73 2HD2 LEU 73 -17.334 6.971 -6.344 426 HD23 LEU 73 3HD2 LEU 73 -16.770 6.697 -7.994 427 H GLY 74 H GLY 74 -17.838 2.948 -8.094 428 HA2 GLY 74 HA2 GLY 74 -20.428 1.546 -7.655 429 HA3 GLY 74 HA3 GLY 74 -18.789 0.947 -7.282 430 H SER 75 H SER 75 -17.768 3.241 -5.912 431 HA SER 75 HA SER 75 -19.568 4.123 -3.818 432 HB2 SER 75 2HB SER 75 -17.625 1.871 -3.257 433 HB3 SER 75 3HB SER 75 -17.937 3.088 -2.009 434 HG SER 75 HG SER 75 -19.985 1.624 -3.325 435 H LEU 76 H LEU 76 -18.608 5.700 -2.435 436 HA LEU 76 HA LEU 76 -15.840 6.558 -3.098 437 HB2 LEU 76 2HB LEU 76 -17.626 7.883 -4.300 438 HB3 LEU 76 3HB LEU 76 -18.184 8.480 -2.747 439 HG LEU 76 HG LEU 76 -15.249 8.749 -3.419 440 HD11 LEU 76 1HD1 LEU 76 -16.248 9.450 -5.486 441 HD12 LEU 76 2HD1 LEU 76 -15.795 10.921 -4.602 442 HD13 LEU 76 3HD1 LEU 76 -17.489 10.383 -4.637 443 HD21 LEU 76 1HD2 LEU 76 -16.056 9.550 -1.198 444 HD22 LEU 76 2HD2 LEU 76 -17.214 10.608 -2.002 445 HD23 LEU 76 3HD2 LEU 76 -15.470 10.884 -2.194 446 H THR 77 H THR 77 -14.646 6.769 -1.418 447 HA THR 77 HA THR 77 -15.778 6.794 1.371 448 HB THR 77 HB THR 77 -13.133 5.784 0.226 449 HG1 THR 77 HG1 THR 77 -15.398 4.453 1.314 450 HG21 THR 77 1HG2 THR 77 -12.773 4.815 2.481 451 HG22 THR 77 2HG2 THR 77 -14.185 5.716 3.082 452 HG23 THR 77 3HG2 THR 77 -12.748 6.577 2.484 453 H VAL 78 H VAL 78 -15.548 8.794 2.331 454 HA VAL 78 HA VAL 78 -13.399 10.624 1.397 455 HB VAL 78 HB VAL 78 -14.262 12.284 2.929 456 HG11 VAL 78 1HG1 VAL 78 -15.047 12.175 0.570 457 HG12 VAL 78 2HG1 VAL 78 -16.425 11.184 1.080 458 HG13 VAL 78 3HG1 VAL 78 -16.266 12.853 1.656 459 HG21 VAL 78 1HG2 VAL 78 -16.511 10.319 3.520 460 HG22 VAL 78 2HG2 VAL 78 -15.307 10.925 4.678 461 HG23 VAL 78 3HG2 VAL 78 -16.485 12.032 3.985 462 H LEU 79 H LEU 79 -11.503 11.005 2.537 463 HA LEU 79 HA LEU 79 -11.091 9.325 4.989 464 HB2 LEU 79 2HB LEU 79 -9.075 10.358 2.967 465 HB3 LEU 79 3HB LEU 79 -8.713 9.363 4.365 466 HG LEU 79 HG LEU 79 -10.470 8.500 2.012 467 HD11 LEU 79 1HD1 LEU 79 -7.550 7.911 2.604 468 HD12 LEU 79 2HD1 LEU 79 -8.184 8.871 1.259 469 HD13 LEU 79 3HD1 LEU 79 -8.525 7.141 1.328 470 HD21 LEU 79 1HD2 LEU 79 -10.984 7.252 4.091 471 HD22 LEU 79 2HD2 LEU 79 -9.263 6.899 4.310 472 HD23 LEU 79 3HD2 LEU 79 -10.151 6.219 2.923 473 H ASP 80 H ASP 80 -10.207 12.510 3.548 474 HA ASP 80 HA ASP 80 -11.055 13.956 5.826 475 HB2 ASP 80 2HB ASP 80 -8.606 12.870 6.445 476 HB3 ASP 80 3HB ASP 80 -8.100 14.341 5.644 477 H GLY 81 H GLY 81 -10.506 16.329 5.627 478 HA2 GLY 81 HA2 GLY 81 -8.911 17.650 3.924 479 HA3 GLY 81 HA3 GLY 81 -10.258 17.285 2.855 480 H ASP 82 H ASP 82 -9.954 19.748 2.880 481 HA ASP 82 HA ASP 82 -11.625 21.077 4.945 482 HB2 ASP 82 2HB ASP 82 -9.714 22.318 4.155 483 HB3 ASP 82 3HB ASP 82 -10.155 22.057 2.488 484 H SER 83 H SER 83 -13.701 20.914 4.812 485 HA SER 83 HA SER 83 -14.786 18.953 3.425 486 HB2 SER 83 2HB SER 83 -16.414 21.282 4.482 487 HB3 SER 83 3HB SER 83 -16.929 19.598 4.339 488 HG SER 83 HG SER 83 -16.253 20.122 6.483 489 H ARG 84 H ARG 84 -14.782 22.213 2.177 490 HA ARG 84 HA ARG 84 -16.841 22.181 0.268 491 HB2 ARG 84 2HB ARG 84 -14.064 23.428 0.105 492 HB3 ARG 84 3HB ARG 84 -15.419 23.812 -0.963 493 HG2 ARG 84 2HG ARG 84 -16.754 24.639 0.902 494 HG3 ARG 84 3HG ARG 84 -15.489 24.217 2.059 495 HD2 ARG 84 2HD ARG 84 -15.145 26.205 -0.226 496 HD3 ARG 84 3HD ARG 84 -15.542 26.648 1.445 497 HE ARG 84 HE ARG 84 -13.264 25.092 1.713 498 HH11 ARG 84 1HH1 ARG 84 -13.920 28.072 -0.115 499 HH12 ARG 84 2HH1 ARG 84 -12.288 28.634 0.096 500 HH21 ARG 84 1HH2 ARG 84 -11.277 25.806 1.893 501 HH22 ARG 84 2HH2 ARG 84 -10.758 27.324 1.200 502 H LEU 85 H LEU 85 -13.602 20.583 0.040 503 HA LEU 85 HA LEU 85 -14.050 20.034 -2.811 504 HB2 LEU 85 2HB LEU 85 -11.847 20.618 -2.097 505 HB3 LEU 85 3HB LEU 85 -11.814 19.296 -0.923 506 HG LEU 85 HG LEU 85 -11.656 17.641 -2.602 507 HD11 LEU 85 1HD1 LEU 85 -13.192 18.502 -4.397 508 HD12 LEU 85 2HD1 LEU 85 -11.615 18.031 -5.029 509 HD13 LEU 85 3HD1 LEU 85 -12.000 19.745 -4.791 510 HD21 LEU 85 1HD2 LEU 85 -9.612 19.100 -2.080 511 HD22 LEU 85 2HD2 LEU 85 -9.912 19.941 -3.598 512 HD23 LEU 85 3HD2 LEU 85 -9.551 18.197 -3.612 513 H CYS 86 H CYS 86 -13.788 17.830 0.124 514 HA CYS 86 HA CYS 86 -14.561 15.547 -1.341 515 HB2 CYS 86 2HB CYS 86 -15.105 14.568 0.834 516 HB3 CYS 86 3HB CYS 86 -13.504 15.327 0.789 517 HG CYS 86 HG CYS 86 -16.373 16.523 2.029 518 H ALA 87 H ALA 87 -16.662 18.046 0.029 519 HA ALA 87 HA ALA 87 -19.140 16.644 -0.543 520 HB1 ALA 87 1HB ALA 87 -18.976 18.552 1.040 521 HB2 ALA 87 2HB ALA 87 -18.547 19.636 -0.304 522 HB3 ALA 87 3HB ALA 87 -20.147 18.884 -0.255 523 H ALA 88 H ALA 88 -17.197 18.989 -2.448 524 HA ALA 88 HA ALA 88 -19.033 19.131 -4.655 525 HB1 ALA 88 1HB ALA 88 -17.451 20.927 -4.094 526 HB2 ALA 88 2HB ALA 88 -16.062 19.844 -4.349 527 HB3 ALA 88 3HB ALA 88 -17.068 20.324 -5.713 528 H THR 89 H THR 89 -15.871 17.435 -4.416 529 HA THR 89 HA THR 89 -15.919 16.266 -6.998 530 HB THR 89 HB THR 89 -13.930 16.317 -5.533 531 HG1 THR 89 HG1 THR 89 -13.247 14.243 -6.170 532 HG21 THR 89 1HG2 THR 89 -14.914 13.817 -4.116 533 HG22 THR 89 2HG2 THR 89 -15.230 15.406 -3.429 534 HG23 THR 89 3HG2 THR 89 -13.564 14.892 -3.704 535 H LYS 90 H LYS 90 -17.165 14.943 -3.940 536 HA LYS 90 HA LYS 90 -17.972 12.416 -4.745 537 HB2 LYS 90 2HB LYS 90 -17.864 13.216 -2.463 538 HB3 LYS 90 3HB LYS 90 -19.077 14.454 -2.773 539 HG2 LYS 90 2HG LYS 90 -20.611 12.278 -3.256 540 HG3 LYS 90 3HG LYS 90 -19.378 11.511 -2.244 541 HD2 LYS 90 2HD LYS 90 -20.930 14.040 -1.553 542 HD3 LYS 90 3HD LYS 90 -21.378 12.397 -1.005 543 HE2 LYS 90 2HE LYS 90 -19.137 12.189 0.111 544 HE3 LYS 90 3HE LYS 90 -18.778 13.863 -0.326 545 HZ1 LYS 90 HZ1 LYS 90 -21.015 12.969 1.415 546 HZ2 LYS 90 HZ2 LYS 90 -20.734 14.527 1.009 547 HZ3 LYS 90 HZ3 LYS 90 -19.662 13.717 1.936 548 H ARG 91 H ARG 91 -19.866 15.429 -4.941 549 HA ARG 91 HA ARG 91 -22.208 14.243 -6.118 550 HB2 ARG 91 2HB ARG 91 -21.138 17.080 -6.229 551 HB3 ARG 91 3HB ARG 91 -22.724 16.605 -6.838 552 HG2 ARG 91 2HG ARG 91 -23.449 15.875 -4.620 553 HG3 ARG 91 3HG ARG 91 -21.856 16.185 -3.943 554 HD2 ARG 91 2HD ARG 91 -23.221 18.036 -3.327 555 HD3 ARG 91 3HD ARG 91 -22.088 18.612 -4.541 556 HE ARG 91 HE ARG 91 -25.010 17.999 -4.942 557 HH11 ARG 91 1HH1 ARG 91 -22.165 19.759 -6.128 558 HH12 ARG 91 2HH1 ARG 91 -23.095 20.588 -7.342 559 HH21 ARG 91 1HH2 ARG 91 -26.130 19.111 -6.507 560 HH22 ARG 91 2HH2 ARG 91 -25.302 20.220 -7.555 561 H ALA 92 H ALA 92 -19.323 15.734 -7.627 562 HA ALA 92 HA ALA 92 -20.113 15.404 -10.363 563 HB1 ALA 92 1HB ALA 92 -18.387 16.926 -9.770 564 HB2 ALA 92 2HB ALA 92 -17.371 15.657 -9.066 565 HB3 ALA 92 3HB ALA 92 -17.678 15.687 -10.807 566 H VAL 93 H VAL 93 -18.045 13.272 -8.314 567 HA VAL 93 HA VAL 93 -17.754 11.245 -10.245 568 HB VAL 93 HB VAL 93 -17.909 10.416 -7.349 569 HG11 VAL 93 1HG1 VAL 93 -17.347 8.808 -9.241 570 HG12 VAL 93 2HG1 VAL 93 -15.897 9.778 -9.538 571 HG13 VAL 93 3HG1 VAL 93 -16.104 8.948 -7.988 572 HG21 VAL 93 1HG2 VAL 93 -16.583 12.173 -6.845 573 HG22 VAL 93 2HG2 VAL 93 -15.298 11.156 -7.494 574 HG23 VAL 93 3HG2 VAL 93 -16.023 12.404 -8.521 575 H ALA 94 H ALA 94 -20.481 11.937 -8.251 576 HA ALA 94 HA ALA 94 -21.818 9.340 -8.594 577 HB1 ALA 94 1HB ALA 94 -23.674 10.414 -7.408 578 HB2 ALA 94 2HB ALA 94 -22.150 10.703 -6.545 579 HB3 ALA 94 3HB ALA 94 -22.875 11.992 -7.535 580 H GLN 95 H GLN 95 -21.292 11.986 -10.662 581 HA GLN 95 HA GLN 95 -23.685 11.304 -12.320 582 HB2 GLN 95 2HB GLN 95 -24.121 13.640 -12.715 583 HB3 GLN 95 3HB GLN 95 -24.103 13.302 -10.991 584 HG2 GLN 95 2HG GLN 95 -22.857 15.307 -11.096 585 HG3 GLN 95 3HG GLN 95 -21.683 14.095 -10.995 586 HE21 GLN 95 1HE2 GLN 95 -20.051 14.211 -12.579 587 HE22 GLN 95 2HE2 GLN 95 -20.200 15.250 -14.005 588 H VAL 96 H VAL 96 -20.253 11.749 -12.338 589 HA VAL 96 HA VAL 96 -19.798 12.387 -15.051 590 HB VAL 96 HB VAL 96 -17.701 11.003 -14.809 591 HG11 VAL 96 1HG1 VAL 96 -18.076 13.010 -12.583 592 HG12 VAL 96 2HG1 VAL 96 -16.583 12.540 -13.380 593 HG13 VAL 96 3HG1 VAL 96 -17.811 13.425 -14.299 594 HG21 VAL 96 1HG2 VAL 96 -18.203 9.307 -13.244 595 HG22 VAL 96 2HG2 VAL 96 -17.127 10.447 -12.401 596 HG23 VAL 96 3HG2 VAL 96 -18.832 10.466 -12.064 597 H ASN 97 H ASN 97 -19.485 11.221 -16.928 598 HA ASN 97 HA ASN 97 -21.353 9.128 -17.366 599 HB2 ASN 97 2HB ASN 97 -20.486 9.132 -19.681 600 HB3 ASN 97 3HB ASN 97 -20.911 10.730 -19.070 601 HD21 ASN 97 1HD2 ASN 97 -18.098 8.604 -19.887 602 HD22 ASN 97 2HD2 ASN 97 -16.982 9.946 -20.021 603 H SER 98 H SER 98 -17.810 8.930 -17.161 604 HA SER 98 HA SER 98 -17.373 6.327 -16.317 605 HB2 SER 98 2HB SER 98 -16.712 5.228 -18.545 606 HB3 SER 98 3HB SER 98 -18.435 5.282 -18.193 607 HG SER 98 HG SER 98 -17.951 5.910 -20.361 608 H PHE 99 H PHE 99 -15.230 5.913 -16.073 609 HA PHE 99 HA PHE 99 -13.449 8.186 -16.699 610 HB2 PHE 99 2HB PHE 99 -12.872 5.737 -15.022 611 HB3 PHE 99 3HB PHE 99 -11.998 7.267 -15.044 612 HD1 PHE 99 HD1 PHE 99 -14.777 5.402 -13.617 613 HD2 PHE 99 HD2 PHE 99 -13.223 9.387 -14.238 614 HE1 PHE 99 HE1 PHE 99 -16.373 6.298 -11.962 615 HE2 PHE 99 HE2 PHE 99 -14.793 10.257 -12.535 616 HZ PHE 99 HZ PHE 99 -16.370 8.670 -11.392 617 HA PRO 100 HA PRO 100 -12.065 5.593 -20.105 618 HB2 PRO 100 2HB PRO 100 -10.552 7.365 -21.525 619 HB3 PRO 100 3HB PRO 100 -12.344 7.420 -21.479 620 HG2 PRO 100 2HG PRO 100 -10.397 9.079 -19.837 621 HG3 PRO 100 3HG PRO 100 -11.849 9.635 -20.718 622 HD2 PRO 100 2HD PRO 100 -11.867 9.096 -18.033 623 HD3 PRO 100 3HD PRO 100 -13.290 8.803 -19.082 624 H LEU 101 H LEU 101 -10.562 4.108 -19.776 625 HA LEU 101 HA LEU 101 -8.152 4.715 -18.211 626 HB2 LEU 101 2HB LEU 101 -8.010 2.209 -17.977 627 HB3 LEU 101 3HB LEU 101 -9.308 3.097 -17.189 628 HG LEU 101 HG LEU 101 -10.707 2.320 -19.329 629 HD11 LEU 101 1HD1 LEU 101 -8.769 1.192 -20.443 630 HD12 LEU 101 2HD1 LEU 101 -10.138 0.122 -20.115 631 HD13 LEU 101 3HD1 LEU 101 -8.700 0.068 -19.068 632 HD21 LEU 101 1HD2 LEU 101 -10.010 0.483 -17.000 633 HD22 LEU 101 2HD2 LEU 101 -11.472 0.380 -18.008 634 HD23 LEU 101 3HD2 LEU 101 -11.226 1.786 -16.972 635 HA PRO 102 HA PRO 102 -5.641 4.839 -21.702 636 HB2 PRO 102 2HB PRO 102 -3.123 4.739 -20.668 637 HB3 PRO 102 3HB PRO 102 -4.268 6.065 -20.310 638 HG2 PRO 102 2HG PRO 102 -3.699 3.609 -18.601 639 HG3 PRO 102 3HG PRO 102 -3.734 5.331 -18.090 640 HD2 PRO 102 2HD PRO 102 -5.899 3.696 -17.775 641 HD3 PRO 102 3HD PRO 102 -6.075 5.418 -18.209 642 H LYS 103 H LYS 103 -5.128 1.965 -19.676 643 HA LYS 103 HA LYS 103 -4.318 0.369 -22.069 644 HB2 LYS 103 2HB LYS 103 -3.122 0.398 -19.275 645 HB3 LYS 103 3HB LYS 103 -3.121 -1.064 -20.228 646 HG2 LYS 103 2HG LYS 103 -1.033 -0.218 -20.653 647 HG3 LYS 103 3HG LYS 103 -1.948 0.193 -22.088 648 HD2 LYS 103 2HD LYS 103 -0.518 2.040 -21.476 649 HD3 LYS 103 3HD LYS 103 -2.199 2.517 -21.302 650 HE2 LYS 103 2HE LYS 103 -0.896 3.421 -19.485 651 HE3 LYS 103 3HE LYS 103 -2.044 2.251 -18.836 652 HZ1 LYS 103 HZ1 LYS 103 0.752 1.509 -19.462 653 HZ2 LYS 103 HZ2 LYS 103 -0.302 0.732 -18.459 654 HZ3 LYS 103 HZ3 LYS 103 0.356 2.183 -18.039 655 H ASP 104 H ASP 104 -5.145 -1.729 -22.133 656 HA ASP 104 HA ASP 104 -7.776 -1.880 -20.813 657 HB2 ASP 104 2HB ASP 104 -8.493 -3.023 -22.759 658 HB3 ASP 104 3HB ASP 104 -7.554 -1.625 -23.274 659 H GLN 105 H GLN 105 -5.041 -3.256 -19.797 660 HA GLN 105 HA GLN 105 -5.643 -6.052 -20.232 661 HB2 GLN 105 2HB GLN 105 -3.431 -4.793 -18.544 662 HB3 GLN 105 3HB GLN 105 -3.641 -6.502 -18.858 663 HG2 GLN 105 2HG GLN 105 -2.066 -5.989 -20.431 664 HG3 GLN 105 3HG GLN 105 -3.525 -5.839 -21.403 665 HE21 GLN 105 1HE2 GLN 105 -3.958 -3.749 -22.325 666 HE22 GLN 105 2HE2 GLN 105 -2.831 -2.416 -22.091 667 HA PRO 106 HA PRO 106 -8.175 -6.358 -16.551 668 HB2 PRO 106 2HB PRO 106 -8.085 -9.061 -16.047 669 HB3 PRO 106 3HB PRO 106 -9.012 -8.324 -17.394 670 HG2 PRO 106 2HG PRO 106 -6.235 -9.534 -17.478 671 HG3 PRO 106 3HG PRO 106 -7.619 -9.855 -18.587 672 HD2 PRO 106 2HD PRO 106 -5.674 -8.109 -19.262 673 HD3 PRO 106 3HD PRO 106 -7.384 -7.756 -19.641 674 H ASP 107 H ASP 107 -4.813 -6.751 -16.577 675 HA ASP 107 HA ASP 107 -4.563 -7.280 -13.658 676 HB2 ASP 107 2HB ASP 107 -2.904 -8.257 -15.212 677 HB3 ASP 107 3HB ASP 107 -2.433 -6.618 -15.715 678 H VAL 108 H VAL 108 -4.382 -4.600 -16.004 679 HA VAL 108 HA VAL 108 -3.544 -2.691 -13.881 680 HB VAL 108 HB VAL 108 -3.196 -1.069 -15.531 681 HG11 VAL 108 1HG1 VAL 108 -2.111 -3.681 -16.668 682 HG12 VAL 108 2HG1 VAL 108 -1.425 -2.066 -16.876 683 HG13 VAL 108 3HG1 VAL 108 -1.424 -2.815 -15.273 684 HG21 VAL 108 1HG2 VAL 108 -5.040 -1.324 -17.045 685 HG22 VAL 108 2HG2 VAL 108 -3.520 -1.397 -17.940 686 HG23 VAL 108 3HG2 VAL 108 -4.411 -2.887 -17.616 687 H VAL 109 H VAL 109 -6.417 -3.467 -15.830 688 HA VAL 109 HA VAL 109 -8.043 -1.249 -15.116 689 HB VAL 109 HB VAL 109 -8.705 -4.180 -15.588 690 HG11 VAL 109 1HG1 VAL 109 -10.611 -3.288 -14.334 691 HG12 VAL 109 2HG1 VAL 109 -10.668 -1.841 -15.382 692 HG13 VAL 109 3HG1 VAL 109 -11.056 -3.448 -16.032 693 HG21 VAL 109 1HG2 VAL 109 -7.757 -2.842 -17.545 694 HG22 VAL 109 2HG2 VAL 109 -9.411 -3.406 -17.813 695 HG23 VAL 109 3HG2 VAL 109 -9.110 -1.714 -17.354 696 H GLU 110 H GLU 110 -6.868 -3.921 -13.197 697 HA GLU 110 HA GLU 110 -8.710 -3.564 -10.984 698 HB2 GLU 110 2HB GLU 110 -6.321 -5.285 -11.388 699 HB3 GLU 110 3HB GLU 110 -7.249 -5.287 -9.889 700 HG2 GLU 110 2HG GLU 110 -8.550 -5.793 -12.601 701 HG3 GLU 110 3HG GLU 110 -7.852 -7.052 -11.600 702 H LYS 111 H LYS 111 -6.013 -1.806 -11.925 703 HA LYS 111 HA LYS 111 -5.276 -1.072 -9.136 704 HB2 LYS 111 2HB LYS 111 -3.937 -0.607 -11.801 705 HB3 LYS 111 3HB LYS 111 -3.624 0.499 -10.469 706 HG2 LYS 111 2HG LYS 111 -1.935 -1.248 -10.599 707 HG3 LYS 111 3HG LYS 111 -2.806 -1.298 -9.051 708 HD2 LYS 111 2HD LYS 111 -4.043 -3.248 -9.692 709 HD3 LYS 111 3HD LYS 111 -3.619 -3.029 -11.390 710 HE2 LYS 111 2HE LYS 111 -1.213 -3.427 -10.773 711 HE3 LYS 111 3HE LYS 111 -1.742 -3.798 -9.129 712 HZ1 LYS 111 HZ1 LYS 111 -1.461 -5.789 -10.607 713 HZ2 LYS 111 HZ2 LYS 111 -2.688 -5.245 -11.542 714 HZ3 LYS 111 HZ3 LYS 111 -2.980 -5.673 -9.993 715 H LEU 112 H LEU 112 -6.205 0.491 -12.137 716 HA LEU 112 HA LEU 112 -6.685 3.044 -11.044 717 HB2 LEU 112 2HB LEU 112 -7.738 3.513 -13.273 718 HB3 LEU 112 3HB LEU 112 -6.176 2.784 -13.303 719 HG LEU 112 HG LEU 112 -7.361 0.597 -13.556 720 HD11 LEU 112 1HD1 LEU 112 -9.624 1.300 -13.094 721 HD12 LEU 112 2HD1 LEU 112 -9.459 0.428 -14.607 722 HD13 LEU 112 3HD1 LEU 112 -9.637 2.203 -14.643 723 HD21 LEU 112 1HD2 LEU 112 -7.248 2.620 -15.787 724 HD22 LEU 112 2HD2 LEU 112 -7.489 0.870 -16.060 725 HD23 LEU 112 3HD2 LEU 112 -5.996 1.433 -15.320 726 H LYS 113 H LYS 113 -8.879 0.226 -11.005 727 HA LYS 113 HA LYS 113 -11.241 1.716 -10.525 728 HB2 LYS 113 2HB LYS 113 -12.102 -0.417 -9.789 729 HB3 LYS 113 3HB LYS 113 -11.173 -0.608 -11.283 730 HG2 LYS 113 2HG LYS 113 -9.192 -1.381 -9.960 731 HG3 LYS 113 3HG LYS 113 -10.133 -1.203 -8.459 732 HD2 LYS 113 2HD LYS 113 -10.659 -3.066 -10.761 733 HD3 LYS 113 3HD LYS 113 -10.038 -3.484 -9.129 734 HE2 LYS 113 2HE LYS 113 -12.261 -2.629 -8.258 735 HE3 LYS 113 3HE LYS 113 -12.748 -2.435 -9.960 736 HZ1 LYS 113 HZ1 LYS 113 -12.087 -4.975 -8.565 737 HZ2 LYS 113 HZ2 LYS 113 -12.132 -4.887 -10.189 738 HZ3 LYS 113 HZ3 LYS 113 -13.503 -4.598 -9.304 739 H ASN 114 H ASN 114 -8.621 0.940 -8.380 740 HA ASN 114 HA ASN 114 -10.134 2.173 -6.097 741 HB2 ASN 114 2HB ASN 114 -7.987 0.062 -5.872 742 HB3 ASN 114 3HB ASN 114 -8.879 0.836 -4.540 743 HD21 ASN 114 1HD2 ASN 114 -11.515 0.729 -5.279 744 HD22 ASN 114 2HD2 ASN 114 -11.989 -0.936 -5.565 745 H ILE 115 H ILE 115 -9.402 4.263 -6.694 746 HA ILE 115 HA ILE 115 -6.508 4.801 -6.223 747 HB ILE 115 HB ILE 115 -6.779 6.924 -7.347 748 HG12 ILE 115 2HG1 ILE 115 -9.249 7.162 -6.993 749 HG13 ILE 115 3HG1 ILE 115 -8.617 7.638 -8.519 750 HG21 ILE 115 1HG2 ILE 115 -7.325 4.444 -8.990 751 HG22 ILE 115 2HG2 ILE 115 -6.860 6.014 -9.670 752 HG23 ILE 115 3HG2 ILE 115 -5.772 5.161 -8.557 753 HD11 ILE 115 1HD1 ILE 115 -9.398 5.549 -9.552 754 HD12 ILE 115 2HD1 ILE 115 -10.165 5.091 -8.023 755 HD13 ILE 115 3HD1 ILE 115 -10.694 6.545 -8.885 756 H ASN 116 H ASN 116 -5.879 6.476 -4.893 757 HA ASN 116 HA ASN 116 -8.018 7.786 -3.293 758 HB2 ASN 116 2HB ASN 116 -5.105 8.413 -2.916 759 HB3 ASN 116 3HB ASN 116 -6.487 8.600 -1.822 760 HD21 ASN 116 1HD2 ASN 116 -7.483 5.802 -1.931 761 HD22 ASN 116 2HD2 ASN 116 -6.249 4.888 -1.108 762 H LEU 117 H LEU 117 -8.685 9.756 -3.923 763 HA LEU 117 HA LEU 117 -7.006 11.443 -5.764 764 HB2 LEU 117 2HB LEU 117 -9.770 11.978 -4.611 765 HB3 LEU 117 3HB LEU 117 -8.844 13.053 -5.647 766 HG LEU 117 HG LEU 117 -9.953 10.297 -6.418 767 HD11 LEU 117 1HD1 LEU 117 -11.662 12.067 -6.144 768 HD12 LEU 117 2HD1 LEU 117 -11.491 11.573 -7.838 769 HD13 LEU 117 3HD1 LEU 117 -10.773 13.104 -7.281 770 HD21 LEU 117 1HD2 LEU 117 -9.308 11.006 -8.760 771 HD22 LEU 117 2HD2 LEU 117 -7.935 10.640 -7.714 772 HD23 LEU 117 3HD2 LEU 117 -8.371 12.336 -8.029 773 H THR 118 H THR 118 -5.432 12.374 -4.671 774 HA THR 118 HA THR 118 -5.943 13.547 -1.973 775 HB THR 118 HB THR 118 -3.472 11.975 -2.784 776 HG1 THR 118 HG1 THR 118 -4.256 10.590 -1.158 777 HG21 THR 118 1HG2 THR 118 -4.236 13.537 -0.273 778 HG22 THR 118 2HG2 THR 118 -2.800 13.777 -1.294 779 HG23 THR 118 3HG2 THR 118 -2.949 12.317 -0.304 780 H VAL 119 H VAL 119 -5.485 15.593 -1.904 781 HA VAL 119 HA VAL 119 -3.643 16.855 -3.889 782 HB VAL 119 HB VAL 119 -5.166 18.562 -4.336 783 HG11 VAL 119 1HG1 VAL 119 -5.564 16.466 -5.605 784 HG12 VAL 119 2HG1 VAL 119 -6.851 16.031 -4.451 785 HG13 VAL 119 3HG1 VAL 119 -7.020 17.470 -5.465 786 HG21 VAL 119 1HG2 VAL 119 -7.189 17.438 -2.378 787 HG22 VAL 119 2HG2 VAL 119 -6.220 18.912 -2.121 788 HG23 VAL 119 3HG2 VAL 119 -7.374 18.854 -3.438 789 H ALA 120 H ALA 120 -2.703 18.814 -3.255 790 HA ALA 120 HA ALA 120 -3.031 20.030 -0.665 791 HB1 ALA 120 1HB ALA 120 -0.526 18.350 -1.203 792 HB2 ALA 120 2HB ALA 120 -0.803 19.377 0.220 793 HB3 ALA 120 3HB ALA 120 -1.796 17.947 -0.039 794 HA PRO 121 HA PRO 121 -1.231 23.461 -2.749 795 HB2 PRO 121 2HB PRO 121 0.734 23.862 -0.505 796 HB3 PRO 121 3HB PRO 121 -0.374 25.049 -1.262 797 HG2 PRO 121 2HG PRO 121 -1.009 23.977 1.130 798 HG3 PRO 121 3HG PRO 121 -2.277 24.117 -0.144 799 HD2 PRO 121 2HD PRO 121 -0.604 21.689 0.597 800 HD3 PRO 121 3HD PRO 121 -2.365 21.805 0.351 801 H GLU 122 H GLU 122 1.279 21.261 -1.442 802 HA GLU 122 HA GLU 122 3.091 21.874 -3.721 803 HB2 GLU 122 2HB GLU 122 4.752 20.575 -2.554 804 HB3 GLU 122 3HB GLU 122 4.124 21.850 -1.519 805 HG2 GLU 122 2HG GLU 122 2.731 20.210 -0.298 806 HG3 GLU 122 3HG GLU 122 3.299 18.919 -1.363
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