NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
614357 | 5jyt | 30091 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 HT1 MET 1 -13.501 -6.891 -21.715 2 H2 MET 1 HT2 MET 1 -13.127 -8.480 -21.273 3 H3 MET 1 HT3 MET 1 -12.025 -7.233 -20.961 4 HA MET 1 HA MET 1 -13.161 -6.427 -19.190 5 HB2 MET 1 HB2 MET 1 -15.605 -7.661 -20.466 6 HB3 MET 1 HB1 MET 1 -15.618 -6.946 -18.859 7 HG2 MET 1 HG2 MET 1 -15.029 -4.793 -19.766 8 HG3 MET 1 HG1 MET 1 -14.854 -5.484 -21.377 9 HE1 MET 1 HE1 MET 1 -17.943 -6.048 -18.675 10 HE2 MET 1 HE2 MET 1 -18.699 -4.517 -19.116 11 HE3 MET 1 HE3 MET 1 -17.049 -4.539 -18.491 12 H ALA 2 HN ALA 2 -11.894 -9.049 -19.813 13 HA ALA 2 HA ALA 2 -13.159 -10.987 -18.112 14 HB1 ALA 2 HB1 ALA 2 -11.362 -12.427 -18.653 15 HB2 ALA 2 HB2 ALA 2 -10.323 -11.079 -19.111 16 HB3 ALA 2 HB3 ALA 2 -11.706 -11.507 -20.118 17 HA PRO 3 HA PRO 3 -11.588 -9.265 -14.281 18 HB2 PRO 3 HB2 PRO 3 -12.286 -11.988 -13.305 19 HB3 PRO 3 HB1 PRO 3 -12.771 -10.410 -12.674 20 HG2 PRO 3 HG2 PRO 3 -14.512 -11.886 -14.022 21 HG3 PRO 3 HG1 PRO 3 -14.433 -10.133 -14.286 22 HD2 PRO 3 HD2 PRO 3 -13.318 -12.353 -15.970 23 HD3 PRO 3 HD1 PRO 3 -14.169 -10.875 -16.472 24 H LEU 4 HN LEU 4 -9.679 -9.336 -13.228 25 HA LEU 4 HA LEU 4 -7.850 -11.521 -13.941 26 HB2 LEU 4 HB2 LEU 4 -7.163 -8.729 -13.014 27 HB3 LEU 4 HB1 LEU 4 -6.031 -9.953 -13.556 28 HG LEU 4 HG LEU 4 -8.106 -8.575 -15.262 29 HD11 LEU 4 HD11 LEU 4 -5.111 -8.331 -15.100 30 HD12 LEU 4 HD12 LEU 4 -6.316 -7.081 -14.789 31 HD13 LEU 4 HD13 LEU 4 -6.084 -7.693 -16.427 32 HD21 LEU 4 HD21 LEU 4 -6.669 -9.763 -17.082 33 HD22 LEU 4 HD22 LEU 4 -7.961 -10.639 -16.261 34 HD23 LEU 4 HD23 LEU 4 -6.282 -10.881 -15.774 35 H ARG 5 HN ARG 5 -6.662 -12.546 -12.357 36 HA ARG 5 HA ARG 5 -7.690 -12.211 -9.641 37 HB2 ARG 5 HB2 ARG 5 -6.352 -14.438 -11.122 38 HB3 ARG 5 HB1 ARG 5 -6.205 -14.387 -9.373 39 HG2 ARG 5 HG2 ARG 5 -8.034 -15.802 -9.886 40 HG3 ARG 5 HG1 ARG 5 -8.707 -14.298 -9.253 41 HD2 ARG 5 HD2 ARG 5 -9.327 -13.561 -11.422 42 HD3 ARG 5 HD1 ARG 5 -8.387 -14.835 -12.197 43 HE ARG 5 HE ARG 5 -10.286 -16.082 -10.605 44 HH11 ARG 5 HH11 ARG 5 -10.213 -13.967 -13.375 45 HH12 ARG 5 HH12 ARG 5 -11.689 -14.580 -14.045 46 HH21 ARG 5 HH21 ARG 5 -12.226 -16.901 -11.480 47 HH22 ARG 5 HH22 ARG 5 -12.838 -16.249 -12.962 48 H LYS 6 HN LYS 6 -6.455 -11.653 -7.931 49 HA LYS 6 HA LYS 6 -4.732 -10.872 -6.694 50 HB2 LYS 6 HB2 LYS 6 -3.314 -12.504 -8.696 51 HB3 LYS 6 HB1 LYS 6 -2.345 -11.274 -7.897 52 HG2 LYS 6 HG2 LYS 6 -3.995 -13.311 -6.419 53 HG3 LYS 6 HG1 LYS 6 -2.292 -13.532 -6.826 54 HD2 LYS 6 HD2 LYS 6 -2.759 -10.968 -5.564 55 HD3 LYS 6 HD1 LYS 6 -3.323 -12.299 -4.551 56 HE2 LYS 6 HE2 LYS 6 -0.577 -12.086 -5.785 57 HE3 LYS 6 HE1 LYS 6 -0.972 -11.695 -4.111 58 HZ1 LYS 6 HZ1 LYS 6 -0.264 -14.163 -5.134 59 HZ2 LYS 6 HZ2 LYS 6 -1.909 -14.285 -4.762 60 HZ3 LYS 6 HZ3 LYS 6 -0.804 -13.822 -3.568 61 H THR 7 HN THR 7 -3.474 -10.351 -9.963 62 HA THR 7 HA THR 7 -2.815 -7.634 -9.279 63 HB THR 7 HB THR 7 -2.375 -7.627 -11.906 64 HG1 THR 7 HG1 THR 7 -3.285 -9.803 -12.065 65 HG21 THR 7 HG21 THR 7 -0.137 -8.942 -11.168 66 HG22 THR 7 HG22 THR 7 -0.780 -8.503 -9.586 67 HG23 THR 7 HG23 THR 7 -0.451 -7.248 -10.785 68 H ALA 8 HN ALA 8 -3.981 -5.925 -9.537 69 HA ALA 8 HA ALA 8 -6.369 -6.036 -11.266 70 HB1 ALA 8 HB1 ALA 8 -6.062 -4.169 -8.941 71 HB2 ALA 8 HB2 ALA 8 -6.648 -5.819 -8.724 72 HB3 ALA 8 HB3 ALA 8 -7.535 -4.694 -9.756 73 H VAL 9 HN VAL 9 -6.979 -4.063 -12.336 74 HA VAL 9 HA VAL 9 -4.611 -2.439 -12.976 75 HB VAL 9 HB VAL 9 -7.045 -2.967 -14.683 76 HG11 VAL 9 HG11 VAL 9 -4.596 -1.266 -15.126 77 HG12 VAL 9 HG12 VAL 9 -6.293 -0.799 -15.250 78 HG13 VAL 9 HG13 VAL 9 -5.582 -1.867 -16.460 79 HG21 VAL 9 HG21 VAL 9 -5.911 -4.597 -15.754 80 HG22 VAL 9 HG22 VAL 9 -5.021 -4.693 -14.235 81 HG23 VAL 9 HG23 VAL 9 -4.360 -3.774 -15.587 82 H LEU 10 HN LEU 10 -4.655 -0.402 -12.397 83 HA LEU 10 HA LEU 10 -7.235 0.842 -11.679 84 HB2 LEU 10 HB2 LEU 10 -5.006 0.448 -10.091 85 HB3 LEU 10 HB1 LEU 10 -4.789 2.094 -10.640 86 HG LEU 10 HG LEU 10 -5.867 2.092 -8.482 87 HD11 LEU 10 HD11 LEU 10 -7.586 2.916 -10.786 88 HD12 LEU 10 HD12 LEU 10 -6.581 3.910 -9.731 89 HD13 LEU 10 HD13 LEU 10 -8.076 3.199 -9.116 90 HD21 LEU 10 HD21 LEU 10 -6.901 0.017 -8.265 91 HD22 LEU 10 HD22 LEU 10 -7.798 0.198 -9.771 92 HD23 LEU 10 HD23 LEU 10 -8.247 1.153 -8.358 93 H LYS 11 HN LYS 11 -7.773 2.723 -12.804 94 HA LYS 11 HA LYS 11 -5.658 3.753 -14.575 95 HB2 LYS 11 HB2 LYS 11 -8.615 3.484 -15.139 96 HB3 LYS 11 HB1 LYS 11 -7.535 4.477 -16.109 97 HG2 LYS 11 HG2 LYS 11 -6.220 2.482 -16.657 98 HG3 LYS 11 HG1 LYS 11 -7.346 1.497 -15.725 99 HD2 LYS 11 HD2 LYS 11 -9.166 2.143 -17.203 100 HD3 LYS 11 HD1 LYS 11 -8.077 3.194 -18.111 101 HE2 LYS 11 HE2 LYS 11 -6.744 1.254 -18.763 102 HE3 LYS 11 HE1 LYS 11 -7.822 0.201 -17.849 103 HZ1 LYS 11 HZ1 LYS 11 -8.173 1.378 -20.455 104 HZ2 LYS 11 HZ2 LYS 11 -9.531 1.522 -19.457 105 HZ3 LYS 11 HZ3 LYS 11 -8.883 -0.006 -19.788 106 H LEU 12 HN LEU 12 -5.241 5.850 -14.489 107 HA LEU 12 HA LEU 12 -7.027 7.490 -12.825 108 HB2 LEU 12 HB2 LEU 12 -4.294 7.066 -12.569 109 HB3 LEU 12 HB1 LEU 12 -4.390 8.633 -13.350 110 HG LEU 12 HG LEU 12 -5.537 7.843 -10.675 111 HD11 LEU 12 HD11 LEU 12 -3.051 8.646 -11.213 112 HD12 LEU 12 HD12 LEU 12 -3.899 9.081 -9.730 113 HD13 LEU 12 HD13 LEU 12 -3.830 10.222 -11.072 114 HD21 LEU 12 HD21 LEU 12 -6.186 10.324 -10.614 115 HD22 LEU 12 HD22 LEU 12 -7.223 9.221 -11.519 116 HD23 LEU 12 HD23 LEU 12 -6.079 10.256 -12.373 117 H TYR 13 HN TYR 13 -8.066 9.184 -13.851 118 HA TYR 13 HA TYR 13 -7.248 9.774 -16.608 119 HB2 TYR 13 HB2 TYR 13 -9.783 10.404 -15.074 120 HB3 TYR 13 HB1 TYR 13 -9.478 10.844 -16.751 121 HD1 TYR 13 HD1 TYR 13 -10.309 8.120 -14.458 122 HD2 TYR 13 HD2 TYR 13 -9.444 9.128 -18.501 123 HE1 TYR 13 HE1 TYR 13 -11.190 5.943 -15.185 124 HE2 TYR 13 HE2 TYR 13 -10.324 6.954 -19.237 125 HH TYR 13 HH TYR 13 -11.355 5.073 -18.623 126 H VAL 14 HN VAL 14 -6.026 11.564 -16.874 127 HA VAL 14 HA VAL 14 -6.341 13.752 -14.921 128 HB VAL 14 HB VAL 14 -3.924 14.245 -15.203 129 HG11 VAL 14 HG11 VAL 14 -4.699 13.093 -13.212 130 HG12 VAL 14 HG12 VAL 14 -3.135 12.436 -13.710 131 HG13 VAL 14 HG13 VAL 14 -4.619 11.541 -14.051 132 HG21 VAL 14 HG21 VAL 14 -3.425 13.145 -17.268 133 HG22 VAL 14 HG22 VAL 14 -3.926 11.584 -16.618 134 HG23 VAL 14 HG23 VAL 14 -2.474 12.371 -15.999 135 H ALA 15 HN ALA 15 -5.632 15.856 -15.727 136 HA ALA 15 HA ALA 15 -6.047 16.097 -18.630 137 HB1 ALA 15 HB1 ALA 15 -7.598 17.708 -18.366 138 HB2 ALA 15 HB2 ALA 15 -6.730 18.456 -17.027 139 HB3 ALA 15 HB3 ALA 15 -7.763 17.057 -16.735 140 H GLY 16 HN GLY 16 -4.038 16.378 -19.383 141 HA2 GLY 16 HA2 GLY 16 -2.031 17.398 -19.810 142 HA3 GLY 16 HA1 GLY 16 -2.709 18.831 -19.054 143 H ASN 17 HN ASN 17 -1.200 19.551 -17.686 144 HA ASN 17 HA ASN 17 -0.177 17.650 -15.689 145 HB2 ASN 17 HB2 ASN 17 1.450 19.836 -17.019 146 HB3 ASN 17 HB1 ASN 17 2.013 18.780 -15.730 147 HD21 ASN 17 HD21 ASN 17 1.533 16.348 -16.338 148 HD22 ASN 17 HD22 ASN 17 2.113 15.893 -17.900 149 H THR 18 HN THR 18 -2.384 19.149 -15.191 150 HA THR 18 HA THR 18 -1.760 21.633 -13.915 151 HB THR 18 HB THR 18 -4.015 21.524 -12.968 152 HG1 THR 18 HG1 THR 18 -3.899 18.841 -13.891 153 HG21 THR 18 HG21 THR 18 -3.492 21.950 -15.510 154 HG22 THR 18 HG22 THR 18 -5.155 21.850 -14.930 155 HG23 THR 18 HG23 THR 18 -4.411 20.460 -15.722 156 HA PRO 19 HA PRO 19 -0.153 20.378 -10.028 157 HB2 PRO 19 HB2 PRO 19 -2.301 22.042 -8.760 158 HB3 PRO 19 HB1 PRO 19 -0.557 22.051 -8.473 159 HG2 PRO 19 HG2 PRO 19 -1.636 23.973 -9.923 160 HG3 PRO 19 HG1 PRO 19 -0.113 23.228 -10.448 161 HD2 PRO 19 HD2 PRO 19 -2.893 22.773 -11.469 162 HD3 PRO 19 HD1 PRO 19 -1.371 22.923 -12.373 163 H ASN 20 HN ASN 20 -3.692 20.318 -10.244 164 HA ASN 20 HA ASN 20 -4.097 18.531 -8.080 165 HB2 ASN 20 HB2 ASN 20 -5.851 19.025 -10.516 166 HB3 ASN 20 HB1 ASN 20 -6.319 18.059 -9.124 167 HD21 ASN 20 HD21 ASN 20 -5.977 19.241 -6.972 168 HD22 ASN 20 HD22 ASN 20 -6.548 20.871 -6.925 169 H SER 21 HN SER 21 -3.763 18.004 -11.599 170 HA SER 21 HA SER 21 -3.975 15.151 -11.454 171 HB2 SER 21 HB2 SER 21 -3.190 15.203 -13.778 172 HB3 SER 21 HB1 SER 21 -4.504 16.347 -13.518 173 HG SER 21 HG SER 21 -2.221 17.620 -13.058 174 H VAL 22 HN VAL 22 -1.202 17.372 -11.499 175 HA VAL 22 HA VAL 22 0.711 15.308 -11.654 176 HB VAL 22 HB VAL 22 0.918 18.121 -10.549 177 HG11 VAL 22 HG11 VAL 22 3.065 16.034 -10.831 178 HG12 VAL 22 HG12 VAL 22 2.596 16.935 -9.387 179 HG13 VAL 22 HG13 VAL 22 3.409 17.761 -10.720 180 HG21 VAL 22 HG21 VAL 22 2.394 18.328 -12.643 181 HG22 VAL 22 HG22 VAL 22 0.645 18.256 -12.859 182 HG23 VAL 22 HG23 VAL 22 1.630 16.823 -13.156 183 H ARG 23 HN ARG 23 -0.770 16.974 -8.934 184 HA ARG 23 HA ARG 23 0.658 15.755 -6.849 185 HB2 ARG 23 HB2 ARG 23 -1.124 17.711 -6.956 186 HB3 ARG 23 HB1 ARG 23 -2.242 16.404 -6.568 187 HG2 ARG 23 HG2 ARG 23 -1.786 16.914 -4.454 188 HG3 ARG 23 HG1 ARG 23 -0.282 16.027 -4.717 189 HD2 ARG 23 HD2 ARG 23 0.851 18.092 -5.313 190 HD3 ARG 23 HD1 ARG 23 -0.658 18.988 -5.131 191 HE ARG 23 HE ARG 23 -0.145 17.677 -2.722 192 HH11 ARG 23 HH11 ARG 23 1.236 20.201 -4.684 193 HH12 ARG 23 HH12 ARG 23 1.930 21.047 -3.342 194 HH21 ARG 23 HH21 ARG 23 0.763 18.776 -0.945 195 HH22 ARG 23 HH22 ARG 23 1.661 20.233 -1.208 196 H ALA 24 HN ALA 24 -2.426 14.933 -8.394 197 HA ALA 24 HA ALA 24 -3.023 12.697 -6.806 198 HB1 ALA 24 HB1 ALA 24 -4.428 14.044 -8.592 199 HB2 ALA 24 HB2 ALA 24 -4.824 12.381 -8.159 200 HB3 ALA 24 HB3 ALA 24 -3.917 12.717 -9.635 201 H LEU 25 HN LEU 25 -1.367 12.925 -9.948 202 HA LEU 25 HA LEU 25 -1.009 10.156 -10.314 203 HB2 LEU 25 HB2 LEU 25 0.456 12.537 -11.406 204 HB3 LEU 25 HB1 LEU 25 0.917 10.899 -11.826 205 HG LEU 25 HG LEU 25 -1.833 12.034 -12.288 206 HD11 LEU 25 HD11 LEU 25 0.664 12.281 -13.817 207 HD12 LEU 25 HD12 LEU 25 -0.799 13.265 -13.863 208 HD13 LEU 25 HD13 LEU 25 -0.734 11.741 -14.747 209 HD21 LEU 25 HD21 LEU 25 -0.987 9.870 -13.983 210 HD22 LEU 25 HD22 LEU 25 -2.390 9.977 -12.920 211 HD23 LEU 25 HD23 LEU 25 -0.842 9.417 -12.282 212 H LYS 26 HN LYS 26 1.124 12.567 -8.793 213 HA LYS 26 HA LYS 26 3.257 10.777 -8.328 214 HB2 LYS 26 HB2 LYS 26 2.438 13.259 -6.802 215 HB3 LYS 26 HB1 LYS 26 3.960 12.411 -6.573 216 HG2 LYS 26 HG2 LYS 26 3.062 13.689 -9.149 217 HG3 LYS 26 HG1 LYS 26 4.172 14.413 -7.984 218 HD2 LYS 26 HD2 LYS 26 5.721 12.531 -8.317 219 HD3 LYS 26 HD1 LYS 26 4.615 11.851 -9.514 220 HE2 LYS 26 HE2 LYS 26 4.859 13.868 -10.881 221 HE3 LYS 26 HE1 LYS 26 5.970 14.540 -9.689 222 HZ1 LYS 26 HZ1 LYS 26 7.479 12.691 -10.116 223 HZ2 LYS 26 HZ2 LYS 26 7.168 13.562 -11.533 224 HZ3 LYS 26 HZ3 LYS 26 6.415 12.069 -11.277 225 H THR 27 HN THR 27 0.413 11.641 -6.424 226 HA THR 27 HA THR 27 1.084 10.217 -4.082 227 HB THR 27 HB THR 27 -1.615 11.027 -5.171 228 HG1 THR 27 HG1 THR 27 -0.476 12.868 -4.807 229 HG21 THR 27 HG21 THR 27 -2.357 9.708 -3.498 230 HG22 THR 27 HG22 THR 27 -1.872 11.065 -2.481 231 HG23 THR 27 HG23 THR 27 -0.793 9.682 -2.684 232 H LEU 28 HN LEU 28 -1.024 9.315 -6.844 233 HA LEU 28 HA LEU 28 -1.683 6.786 -5.746 234 HB2 LEU 28 HB2 LEU 28 -3.089 7.899 -7.399 235 HB3 LEU 28 HB1 LEU 28 -1.830 7.731 -8.607 236 HG LEU 28 HG LEU 28 -2.066 5.257 -8.465 237 HD11 LEU 28 HD11 LEU 28 -4.139 4.392 -7.374 238 HD12 LEU 28 HD12 LEU 28 -4.303 5.961 -6.584 239 HD13 LEU 28 HD13 LEU 28 -2.893 4.953 -6.259 240 HD21 LEU 28 HD21 LEU 28 -4.073 5.115 -9.734 241 HD22 LEU 28 HD22 LEU 28 -3.289 6.647 -10.126 242 HD23 LEU 28 HD23 LEU 28 -4.680 6.619 -9.042 243 H ALA 29 HN ALA 29 0.686 7.760 -8.253 244 HA ALA 29 HA ALA 29 1.517 5.169 -8.941 245 HB1 ALA 29 HB1 ALA 29 3.706 6.841 -9.354 246 HB2 ALA 29 HB2 ALA 29 2.287 7.869 -9.557 247 HB3 ALA 29 HB3 ALA 29 2.457 6.402 -10.520 248 H ASN 30 HN ASN 30 2.808 7.450 -6.538 249 HA ASN 30 HA ASN 30 5.077 5.841 -5.876 250 HB2 ASN 30 HB2 ASN 30 4.441 8.389 -5.301 251 HB3 ASN 30 HB1 ASN 30 3.912 7.633 -3.803 252 HD21 ASN 30 HD21 ASN 30 5.834 5.614 -3.603 253 HD22 ASN 30 HD22 ASN 30 7.370 6.352 -3.313 254 H ILE 31 HN ILE 31 1.841 6.081 -4.507 255 HA ILE 31 HA ILE 31 2.331 4.329 -2.374 256 HB ILE 31 HB ILE 31 -0.217 5.163 -3.712 257 HG12 ILE 31 HG12 ILE 31 0.877 5.633 -0.940 258 HG13 ILE 31 HG11 ILE 31 1.144 6.721 -2.298 259 HG21 ILE 31 HG21 ILE 31 -0.281 3.674 -1.136 260 HG22 ILE 31 HG22 ILE 31 -0.192 2.759 -2.641 261 HG23 ILE 31 HG23 ILE 31 -1.535 3.870 -2.361 262 HD11 ILE 31 HD11 ILE 31 -1.621 5.972 -1.507 263 HD12 ILE 31 HD12 ILE 31 -1.040 7.416 -2.335 264 HD13 ILE 31 HD13 ILE 31 -0.741 7.206 -0.610 265 H LEU 32 HN LEU 32 1.068 3.756 -5.643 266 HA LEU 32 HA LEU 32 0.719 0.968 -5.293 267 HB2 LEU 32 HB2 LEU 32 0.975 2.671 -7.756 268 HB3 LEU 32 HB1 LEU 32 0.709 0.936 -7.825 269 HG LEU 32 HG LEU 32 -1.151 2.863 -6.419 270 HD11 LEU 32 HD11 LEU 32 -0.982 3.212 -8.902 271 HD12 LEU 32 HD12 LEU 32 -2.582 2.757 -8.314 272 HD13 LEU 32 HD13 LEU 32 -1.559 1.558 -9.103 273 HD21 LEU 32 HD21 LEU 32 -0.921 -0.001 -6.506 274 HD22 LEU 32 HD22 LEU 32 -2.458 0.522 -7.192 275 HD23 LEU 32 HD23 LEU 32 -2.009 1.011 -5.559 276 H GLU 33 HN GLU 33 3.469 2.890 -6.369 277 HA GLU 33 HA GLU 33 5.015 0.698 -7.311 278 HB2 GLU 33 HB2 GLU 33 5.790 3.494 -6.502 279 HB3 GLU 33 HB1 GLU 33 6.949 2.318 -7.109 280 HG2 GLU 33 HG2 GLU 33 5.759 2.181 -9.208 281 HG3 GLU 33 HG1 GLU 33 4.511 3.266 -8.594 282 H LYS 34 HN LYS 34 4.568 2.034 -4.099 283 HA LYS 34 HA LYS 34 6.715 0.231 -3.177 284 HB2 LYS 34 HB2 LYS 34 5.670 2.707 -1.795 285 HB3 LYS 34 HB1 LYS 34 6.962 1.668 -1.211 286 HG2 LYS 34 HG2 LYS 34 7.036 3.270 -3.763 287 HG3 LYS 34 HG1 LYS 34 7.805 3.728 -2.241 288 HD2 LYS 34 HD2 LYS 34 9.173 1.683 -2.341 289 HD3 LYS 34 HD1 LYS 34 8.425 1.273 -3.887 290 HE2 LYS 34 HE2 LYS 34 9.304 3.346 -4.853 291 HE3 LYS 34 HE1 LYS 34 10.059 3.743 -3.310 292 HZ1 LYS 34 HZ1 LYS 34 11.491 1.867 -3.501 293 HZ2 LYS 34 HZ2 LYS 34 11.579 2.720 -4.959 294 HZ3 LYS 34 HZ3 LYS 34 10.675 1.294 -4.869 295 H GLU 35 HN GLU 35 3.645 1.636 -2.033 296 HA GLU 35 HA GLU 35 3.289 -0.220 0.065 297 HB2 GLU 35 HB2 GLU 35 1.393 1.662 -1.340 298 HB3 GLU 35 HB1 GLU 35 0.898 0.652 0.018 299 HG2 GLU 35 HG2 GLU 35 3.066 2.744 0.062 300 HG3 GLU 35 HG1 GLU 35 1.447 2.910 0.737 301 H PHE 36 HN PHE 36 2.032 -0.187 -3.270 302 HA PHE 36 HA PHE 36 1.045 -2.922 -2.761 303 HB2 PHE 36 HB2 PHE 36 -0.169 -0.830 -4.567 304 HB3 PHE 36 HB1 PHE 36 -0.700 -2.504 -4.485 305 HD1 PHE 36 HD1 PHE 36 -0.777 0.745 -2.899 306 HD2 PHE 36 HD2 PHE 36 -1.758 -3.367 -2.434 307 HE1 PHE 36 HE1 PHE 36 -2.261 1.317 -1.023 308 HE2 PHE 36 HE2 PHE 36 -3.245 -2.803 -0.557 309 HZ PHE 36 HZ PHE 36 -3.496 -0.459 0.150 310 H LYS 37 HN LYS 37 3.677 -2.112 -3.801 311 HA LYS 37 HA LYS 37 3.902 -2.418 -6.556 312 HB2 LYS 37 HB2 LYS 37 5.702 -1.823 -4.791 313 HB3 LYS 37 HB1 LYS 37 5.940 -3.560 -4.665 314 HG2 LYS 37 HG2 LYS 37 5.983 -2.391 -7.386 315 HG3 LYS 37 HG1 LYS 37 7.341 -2.022 -6.323 316 HD2 LYS 37 HD2 LYS 37 7.673 -4.438 -5.951 317 HD3 LYS 37 HD1 LYS 37 6.351 -4.774 -7.073 318 HE2 LYS 37 HE2 LYS 37 7.589 -3.661 -8.863 319 HE3 LYS 37 HE1 LYS 37 8.903 -3.310 -7.744 320 HZ1 LYS 37 HZ1 LYS 37 9.739 -5.329 -8.042 321 HZ2 LYS 37 HZ2 LYS 37 8.638 -5.548 -9.307 322 HZ3 LYS 37 HZ3 LYS 37 8.253 -6.081 -7.748 323 H GLY 38 HN GLY 38 3.576 -4.046 -7.902 324 HA2 GLY 38 HA2 GLY 38 3.737 -6.247 -8.684 325 HA3 GLY 38 HA1 GLY 38 4.029 -6.786 -7.040 326 H VAL 39 HN VAL 39 1.441 -4.874 -6.636 327 HA VAL 39 HA VAL 39 -0.355 -7.154 -7.057 328 HB VAL 39 HB VAL 39 -0.747 -4.840 -5.140 329 HG11 VAL 39 HG11 VAL 39 -2.761 -6.190 -6.132 330 HG12 VAL 39 HG12 VAL 39 -2.701 -5.811 -4.410 331 HG13 VAL 39 HG13 VAL 39 -2.243 -7.417 -4.975 332 HG21 VAL 39 HG21 VAL 39 -0.094 -6.277 -3.370 333 HG22 VAL 39 HG22 VAL 39 1.153 -6.410 -4.609 334 HG23 VAL 39 HG23 VAL 39 -0.055 -7.683 -4.433 335 H TYR 40 HN TYR 40 -0.165 -3.618 -7.492 336 HA TYR 40 HA TYR 40 -2.488 -3.946 -9.249 337 HB2 TYR 40 HB2 TYR 40 -1.687 -1.636 -7.504 338 HB3 TYR 40 HB1 TYR 40 -2.668 -1.339 -8.926 339 HD1 TYR 40 HD1 TYR 40 -2.581 -3.103 -5.672 340 HD2 TYR 40 HD2 TYR 40 -4.973 -1.726 -8.906 341 HE1 TYR 40 HE1 TYR 40 -4.609 -3.530 -4.350 342 HE2 TYR 40 HE2 TYR 40 -7.004 -2.157 -7.598 343 HH TYR 40 HH TYR 40 -6.898 -2.880 -4.245 344 H ALA 41 HN ALA 41 -2.517 -3.056 -11.258 345 HA ALA 41 HA ALA 41 0.055 -2.054 -12.274 346 HB1 ALA 41 HB1 ALA 41 -0.524 -2.881 -14.380 347 HB2 ALA 41 HB2 ALA 41 -2.248 -2.888 -14.011 348 HB3 ALA 41 HB3 ALA 41 -1.187 -4.100 -13.289 349 H LEU 42 HN LEU 42 0.186 0.097 -12.761 350 HA LEU 42 HA LEU 42 -2.293 1.620 -12.613 351 HB2 LEU 42 HB2 LEU 42 -0.519 2.344 -11.140 352 HB3 LEU 42 HB1 LEU 42 0.578 2.526 -12.496 353 HG LEU 42 HG LEU 42 -0.823 4.357 -13.377 354 HD11 LEU 42 HD11 LEU 42 -2.500 5.339 -11.738 355 HD12 LEU 42 HD12 LEU 42 -2.449 3.779 -10.918 356 HD13 LEU 42 HD13 LEU 42 -2.987 3.877 -12.594 357 HD21 LEU 42 HD21 LEU 42 0.377 5.810 -12.191 358 HD22 LEU 42 HD22 LEU 42 0.944 4.426 -11.257 359 HD23 LEU 42 HD23 LEU 42 -0.431 5.371 -10.686 360 H LYS 43 HN LYS 43 -3.204 2.645 -14.187 361 HA LYS 43 HA LYS 43 -1.790 3.063 -16.725 362 HB2 LYS 43 HB2 LYS 43 -4.231 1.542 -16.209 363 HB3 LYS 43 HB1 LYS 43 -4.495 2.848 -17.354 364 HG2 LYS 43 HG2 LYS 43 -3.976 0.925 -18.611 365 HG3 LYS 43 HG1 LYS 43 -2.558 1.971 -18.666 366 HD2 LYS 43 HD2 LYS 43 -1.442 0.628 -17.004 367 HD3 LYS 43 HD1 LYS 43 -2.891 -0.354 -16.773 368 HE2 LYS 43 HE2 LYS 43 -2.737 -1.134 -19.082 369 HE3 LYS 43 HE1 LYS 43 -1.296 -0.146 -19.324 370 HZ1 LYS 43 HZ1 LYS 43 -0.494 -2.272 -18.879 371 HZ2 LYS 43 HZ2 LYS 43 -1.610 -2.554 -17.640 372 HZ3 LYS 43 HZ3 LYS 43 -0.333 -1.473 -17.397 373 H VAL 44 HN VAL 44 -1.969 5.050 -17.512 374 HA VAL 44 HA VAL 44 -3.816 6.936 -16.167 375 HB VAL 44 HB VAL 44 -1.003 7.414 -17.150 376 HG11 VAL 44 HG11 VAL 44 -2.469 9.361 -17.531 377 HG12 VAL 44 HG12 VAL 44 -1.237 9.686 -16.310 378 HG13 VAL 44 HG13 VAL 44 -2.899 9.351 -15.820 379 HG21 VAL 44 HG21 VAL 44 -1.450 6.183 -14.926 380 HG22 VAL 44 HG22 VAL 44 -1.935 7.771 -14.335 381 HG23 VAL 44 HG23 VAL 44 -0.301 7.521 -14.947 382 H ILE 45 HN ILE 45 -5.135 8.034 -17.351 383 HA ILE 45 HA ILE 45 -4.866 7.855 -20.275 384 HB ILE 45 HB ILE 45 -7.336 8.305 -18.602 385 HG12 ILE 45 HG12 ILE 45 -6.452 6.095 -18.134 386 HG13 ILE 45 HG11 ILE 45 -7.929 5.961 -19.075 387 HG21 ILE 45 HG21 ILE 45 -8.614 7.858 -20.602 388 HG22 ILE 45 HG22 ILE 45 -7.137 7.509 -21.506 389 HG23 ILE 45 HG23 ILE 45 -7.451 9.147 -20.932 390 HD11 ILE 45 HD11 ILE 45 -5.150 5.741 -20.198 391 HD12 ILE 45 HD12 ILE 45 -6.666 5.460 -21.056 392 HD13 ILE 45 HD13 ILE 45 -6.176 4.379 -19.750 393 H ASP 46 HN ASP 46 -4.154 9.790 -21.092 394 HA ASP 46 HA ASP 46 -4.646 12.257 -19.655 395 HB2 ASP 46 HB2 ASP 46 -2.476 11.756 -20.816 396 HB3 ASP 46 HB1 ASP 46 -3.328 11.872 -22.352 397 H VAL 47 HN VAL 47 -6.747 12.873 -19.805 398 HA VAL 47 HA VAL 47 -8.418 12.358 -22.008 399 HB VAL 47 HB VAL 47 -10.054 13.811 -20.955 400 HG11 VAL 47 HG11 VAL 47 -8.681 11.631 -19.645 401 HG12 VAL 47 HG12 VAL 47 -10.408 11.985 -19.727 402 HG13 VAL 47 HG13 VAL 47 -9.415 12.722 -18.470 403 HG21 VAL 47 HG21 VAL 47 -9.577 15.100 -18.975 404 HG22 VAL 47 HG22 VAL 47 -8.494 15.610 -20.270 405 HG23 VAL 47 HG23 VAL 47 -7.897 14.560 -18.984 406 H LEU 48 HN LEU 48 -6.430 15.207 -21.300 407 HA LEU 48 HA LEU 48 -7.635 16.822 -23.315 408 HB2 LEU 48 HB2 LEU 48 -5.012 17.076 -21.864 409 HB3 LEU 48 HB1 LEU 48 -5.547 18.228 -23.071 410 HG LEU 48 HG LEU 48 -7.041 17.597 -20.523 411 HD11 LEU 48 HD11 LEU 48 -4.955 18.707 -20.012 412 HD12 LEU 48 HD12 LEU 48 -6.297 19.830 -19.800 413 HD13 LEU 48 HD13 LEU 48 -5.276 19.935 -21.236 414 HD21 LEU 48 HD21 LEU 48 -8.706 18.419 -21.830 415 HD22 LEU 48 HD22 LEU 48 -7.598 19.290 -22.891 416 HD23 LEU 48 HD23 LEU 48 -8.007 19.950 -21.307 417 H LYS 49 HN LYS 49 -4.822 14.701 -23.248 418 HA LYS 49 HA LYS 49 -3.889 15.396 -25.851 419 HB2 LYS 49 HB2 LYS 49 -2.428 14.392 -24.144 420 HB3 LYS 49 HB1 LYS 49 -3.365 12.905 -24.231 421 HG2 LYS 49 HG2 LYS 49 -2.689 12.588 -26.542 422 HG3 LYS 49 HG1 LYS 49 -1.789 14.108 -26.498 423 HD2 LYS 49 HD2 LYS 49 -0.356 13.210 -24.741 424 HD3 LYS 49 HD1 LYS 49 -1.255 11.691 -24.777 425 HE2 LYS 49 HE2 LYS 49 -0.583 11.348 -27.102 426 HE3 LYS 49 HE1 LYS 49 0.308 12.869 -27.073 427 HZ1 LYS 49 HZ1 LYS 49 1.648 11.893 -25.229 428 HZ2 LYS 49 HZ2 LYS 49 1.854 11.130 -26.725 429 HZ3 LYS 49 HZ3 LYS 49 0.899 10.406 -25.532 430 H ASN 50 HN ASN 50 -5.947 12.833 -24.563 431 HA ASN 50 HA ASN 50 -6.800 12.251 -27.325 432 HB2 ASN 50 HB2 ASN 50 -6.409 10.237 -25.098 433 HB3 ASN 50 HB1 ASN 50 -7.094 9.880 -26.677 434 HD21 ASN 50 HD21 ASN 50 -5.580 10.771 -28.513 435 HD22 ASN 50 HD22 ASN 50 -3.927 10.302 -28.354 436 HA PRO 51 HA PRO 51 -10.375 13.542 -24.650 437 HB2 PRO 51 HB2 PRO 51 -11.585 14.909 -26.721 438 HB3 PRO 51 HB1 PRO 51 -10.503 15.636 -25.531 439 HG2 PRO 51 HG2 PRO 51 -9.906 14.707 -28.307 440 HG3 PRO 51 HG1 PRO 51 -9.321 16.145 -27.451 441 HD2 PRO 51 HD2 PRO 51 -7.800 13.965 -27.775 442 HD3 PRO 51 HD1 PRO 51 -7.713 14.964 -26.308 443 H GLN 52 HN GLN 52 -10.040 12.000 -27.758 444 HA GLN 52 HA GLN 52 -12.713 11.156 -28.136 445 HB2 GLN 52 HB2 GLN 52 -10.094 9.898 -28.993 446 HB3 GLN 52 HB1 GLN 52 -11.671 9.336 -29.527 447 HG2 GLN 52 HG2 GLN 52 -11.213 10.673 -31.279 448 HG3 GLN 52 HG1 GLN 52 -11.888 11.907 -30.217 449 HE21 GLN 52 HE21 GLN 52 -10.080 12.385 -32.336 450 HE22 GLN 52 HE22 GLN 52 -8.622 13.014 -31.657 451 H LEU 53 HN LEU 53 -9.980 9.795 -26.392 452 HA LEU 53 HA LEU 53 -11.341 7.393 -25.691 453 HB2 LEU 53 HB2 LEU 53 -8.852 8.681 -24.567 454 HB3 LEU 53 HB1 LEU 53 -9.456 7.122 -24.037 455 HG LEU 53 HG LEU 53 -8.626 7.760 -26.868 456 HD11 LEU 53 HD11 LEU 53 -6.771 7.782 -25.175 457 HD12 LEU 53 HD12 LEU 53 -6.607 6.583 -26.459 458 HD13 LEU 53 HD13 LEU 53 -7.143 6.088 -24.852 459 HD21 LEU 53 HD21 LEU 53 -8.551 5.097 -26.707 460 HD22 LEU 53 HD22 LEU 53 -9.989 5.989 -27.206 461 HD23 LEU 53 HD23 LEU 53 -9.840 5.410 -25.545 462 H ALA 54 HN ALA 54 -10.891 10.558 -24.249 463 HA ALA 54 HA ALA 54 -11.897 9.999 -21.670 464 HB1 ALA 54 HB1 ALA 54 -12.096 12.373 -21.417 465 HB2 ALA 54 HB2 ALA 54 -12.035 12.611 -23.163 466 HB3 ALA 54 HB3 ALA 54 -10.609 12.031 -22.300 467 H GLU 55 HN GLU 55 -13.377 11.094 -24.681 468 HA GLU 55 HA GLU 55 -16.016 11.399 -23.663 469 HB2 GLU 55 HB2 GLU 55 -15.248 12.452 -25.770 470 HB3 GLU 55 HB1 GLU 55 -15.133 10.860 -26.507 471 HG2 GLU 55 HG2 GLU 55 -17.531 10.542 -26.239 472 HG3 GLU 55 HG1 GLU 55 -17.663 12.114 -25.457 473 H GLU 56 HN GLU 56 -14.272 8.725 -25.142 474 HA GLU 56 HA GLU 56 -16.440 6.973 -25.466 475 HB2 GLU 56 HB2 GLU 56 -13.503 6.434 -24.980 476 HB3 GLU 56 HB1 GLU 56 -14.666 5.172 -25.361 477 HG2 GLU 56 HG2 GLU 56 -13.952 7.524 -27.120 478 HG3 GLU 56 HG1 GLU 56 -13.418 5.854 -27.335 479 H ASP 57 HN ASP 57 -14.280 7.528 -22.690 480 HA ASP 57 HA ASP 57 -15.936 5.700 -21.125 481 HB2 ASP 57 HB2 ASP 57 -13.275 7.039 -20.526 482 HB3 ASP 57 HB1 ASP 57 -14.188 6.172 -19.293 483 H LYS 58 HN LYS 58 -16.399 8.629 -22.053 484 HA LYS 58 HA LYS 58 -17.493 10.473 -21.335 485 HB2 LYS 58 HB2 LYS 58 -18.720 8.406 -19.518 486 HB3 LYS 58 HB1 LYS 58 -19.349 10.036 -19.717 487 HG2 LYS 58 HG2 LYS 58 -19.689 9.610 -22.109 488 HG3 LYS 58 HG1 LYS 58 -19.073 7.970 -21.894 489 HD2 LYS 58 HD2 LYS 58 -20.905 7.469 -20.359 490 HD3 LYS 58 HD1 LYS 58 -21.512 9.117 -20.530 491 HE2 LYS 58 HE2 LYS 58 -22.791 7.614 -21.930 492 HE3 LYS 58 HE1 LYS 58 -21.855 8.722 -22.932 493 HZ1 LYS 58 HZ1 LYS 58 -20.293 7.023 -23.413 494 HZ2 LYS 58 HZ2 LYS 58 -21.827 6.360 -23.672 495 HZ3 LYS 58 HZ3 LYS 58 -20.966 5.971 -22.269 496 H ILE 59 HN ILE 59 -15.056 10.663 -20.368 497 HA ILE 59 HA ILE 59 -15.132 11.100 -17.491 498 HB ILE 59 HB ILE 59 -12.904 11.618 -19.469 499 HG12 ILE 59 HG12 ILE 59 -13.518 9.253 -19.411 500 HG13 ILE 59 HG11 ILE 59 -11.951 9.501 -18.646 501 HG21 ILE 59 HG21 ILE 59 -12.500 12.920 -17.528 502 HG22 ILE 59 HG22 ILE 59 -11.481 11.487 -17.391 503 HG23 ILE 59 HG23 ILE 59 -12.974 11.600 -16.460 504 HD11 ILE 59 HD11 ILE 59 -12.869 8.130 -17.109 505 HD12 ILE 59 HD12 ILE 59 -14.519 8.627 -17.483 506 HD13 ILE 59 HD13 ILE 59 -13.493 9.656 -16.483 507 H LEU 60 HN LEU 60 -16.159 12.895 -16.851 508 HA LEU 60 HA LEU 60 -15.766 15.373 -18.385 509 HB2 LEU 60 HB2 LEU 60 -17.918 14.672 -16.387 510 HB3 LEU 60 HB1 LEU 60 -17.792 16.193 -17.251 511 HG LEU 60 HG LEU 60 -18.265 13.496 -18.532 512 HD11 LEU 60 HD11 LEU 60 -20.517 14.352 -18.973 513 HD12 LEU 60 HD12 LEU 60 -20.144 15.804 -18.045 514 HD13 LEU 60 HD13 LEU 60 -20.191 14.233 -17.244 515 HD21 LEU 60 HD21 LEU 60 -17.943 16.267 -19.632 516 HD22 LEU 60 HD22 LEU 60 -18.879 15.043 -20.491 517 HD23 LEU 60 HD23 LEU 60 -17.170 14.768 -20.150 518 H ALA 61 HN ALA 61 -14.417 13.909 -15.822 519 HA ALA 61 HA ALA 61 -13.720 16.467 -14.592 520 HB1 ALA 61 HB1 ALA 61 -15.623 15.206 -13.342 521 HB2 ALA 61 HB2 ALA 61 -14.287 15.899 -12.424 522 HB3 ALA 61 HB3 ALA 61 -14.313 14.170 -12.773 523 H THR 62 HN THR 62 -11.709 16.487 -13.548 524 HA THR 62 HA THR 62 -10.071 14.095 -13.558 525 HB THR 62 HB THR 62 -8.186 15.390 -14.664 526 HG1 THR 62 HG1 THR 62 -9.547 17.421 -14.484 527 HG21 THR 62 HG21 THR 62 -9.493 13.594 -15.810 528 HG22 THR 62 HG22 THR 62 -8.821 14.810 -16.900 529 HG23 THR 62 HG23 THR 62 -10.535 14.852 -16.477 530 HA PRO 63 HA PRO 63 -8.205 13.487 -13.023 531 HB2 PRO 63 HB2 PRO 63 -7.058 12.391 -10.866 532 HB3 PRO 63 HB1 PRO 63 -6.234 13.605 -11.850 533 HG2 PRO 63 HG2 PRO 63 -7.611 13.911 -9.220 534 HG3 PRO 63 HG1 PRO 63 -6.105 14.646 -9.799 535 HD2 PRO 63 HD2 PRO 63 -8.557 15.917 -9.760 536 HD3 PRO 63 HD1 PRO 63 -7.205 16.368 -10.816 537 H THR 64 HN THR 64 -9.042 11.416 -12.861 538 HA THR 64 HA THR 64 -11.096 10.969 -10.801 539 HB THR 64 HB THR 64 -11.352 10.183 -13.716 540 HG1 THR 64 HG1 THR 64 -12.082 12.212 -13.716 541 HG21 THR 64 HG21 THR 64 -12.294 8.549 -12.031 542 HG22 THR 64 HG22 THR 64 -13.457 9.212 -13.182 543 HG23 THR 64 HG23 THR 64 -13.398 9.832 -11.532 544 H LEU 65 HN LEU 65 -10.917 9.099 -9.758 545 HA LEU 65 HA LEU 65 -8.809 7.224 -10.597 546 HB2 LEU 65 HB2 LEU 65 -8.791 8.315 -8.319 547 HB3 LEU 65 HB1 LEU 65 -10.256 7.426 -7.957 548 HG LEU 65 HG LEU 65 -8.986 5.303 -8.328 549 HD11 LEU 65 HD11 LEU 65 -7.208 5.979 -9.717 550 HD12 LEU 65 HD12 LEU 65 -6.474 5.572 -8.167 551 HD13 LEU 65 HD13 LEU 65 -6.725 7.261 -8.608 552 HD21 LEU 65 HD21 LEU 65 -9.332 5.981 -6.080 553 HD22 LEU 65 HD22 LEU 65 -8.091 7.228 -6.193 554 HD23 LEU 65 HD23 LEU 65 -7.634 5.526 -6.212 555 H ALA 66 HN ALA 66 -9.448 5.374 -11.584 556 HA ALA 66 HA ALA 66 -11.916 4.088 -10.646 557 HB1 ALA 66 HB1 ALA 66 -11.657 3.924 -13.552 558 HB2 ALA 66 HB2 ALA 66 -11.959 5.568 -12.974 559 HB3 ALA 66 HB3 ALA 66 -13.073 4.265 -12.558 560 H LYS 67 HN LYS 67 -11.818 1.996 -10.496 561 HA LYS 67 HA LYS 67 -9.395 0.637 -11.409 562 HB2 LYS 67 HB2 LYS 67 -10.076 0.310 -9.047 563 HB3 LYS 67 HB1 LYS 67 -11.634 -0.290 -9.585 564 HG2 LYS 67 HG2 LYS 67 -10.672 -2.271 -10.473 565 HG3 LYS 67 HG1 LYS 67 -9.035 -1.637 -10.297 566 HD2 LYS 67 HD2 LYS 67 -9.085 -2.945 -8.442 567 HD3 LYS 67 HD1 LYS 67 -9.803 -1.495 -7.744 568 HE2 LYS 67 HE2 LYS 67 -12.003 -2.395 -7.948 569 HE3 LYS 67 HE1 LYS 67 -11.429 -3.736 -8.936 570 HZ1 LYS 67 HZ1 LYS 67 -11.609 -3.542 -6.120 571 HZ2 LYS 67 HZ2 LYS 67 -10.006 -3.843 -6.567 572 HZ3 LYS 67 HZ3 LYS 67 -11.234 -4.888 -7.073 573 H VAL 68 HN VAL 68 -9.640 0.054 -13.491 574 HA VAL 68 HA VAL 68 -12.225 -0.562 -14.557 575 HB VAL 68 HB VAL 68 -10.241 0.597 -15.723 576 HG11 VAL 68 HG11 VAL 68 -8.416 -0.591 -16.081 577 HG12 VAL 68 HG12 VAL 68 -9.339 -1.601 -17.194 578 HG13 VAL 68 HG13 VAL 68 -9.198 -2.058 -15.496 579 HG21 VAL 68 HG21 VAL 68 -12.189 0.386 -16.936 580 HG22 VAL 68 HG22 VAL 68 -12.119 -1.379 -16.944 581 HG23 VAL 68 HG23 VAL 68 -11.006 -0.447 -17.948 582 H LEU 69 HN LEU 69 -9.505 -2.395 -13.363 583 HA LEU 69 HA LEU 69 -11.092 -4.838 -13.787 584 HB2 LEU 69 HB2 LEU 69 -8.158 -4.565 -14.453 585 HB3 LEU 69 HB1 LEU 69 -9.017 -6.088 -14.380 586 HG LEU 69 HG LEU 69 -9.713 -3.862 -16.298 587 HD11 LEU 69 HD11 LEU 69 -7.706 -4.473 -17.180 588 HD12 LEU 69 HD12 LEU 69 -8.717 -5.725 -17.897 589 HD13 LEU 69 HD13 LEU 69 -7.755 -6.084 -16.465 590 HD21 LEU 69 HD21 LEU 69 -10.604 -6.723 -16.024 591 HD22 LEU 69 HD22 LEU 69 -10.869 -5.758 -17.476 592 HD23 LEU 69 HD23 LEU 69 -11.594 -5.265 -15.945 593 HA PRO 70 HA PRO 70 -11.107 -6.869 -13.248 594 HB2 PRO 70 HB2 PRO 70 -12.338 -8.347 -11.386 595 HB3 PRO 70 HB1 PRO 70 -10.639 -8.616 -11.793 596 HG2 PRO 70 HG2 PRO 70 -11.814 -7.105 -9.486 597 HG3 PRO 70 HG1 PRO 70 -10.477 -8.274 -9.491 598 HD2 PRO 70 HD2 PRO 70 -10.113 -5.564 -9.494 599 HD3 PRO 70 HD1 PRO 70 -8.953 -6.709 -10.196 600 HA PRO 71 HA PRO 71 -14.941 -4.588 -13.243 601 HB2 PRO 71 HB2 PRO 71 -16.160 -7.099 -14.257 602 HB3 PRO 71 HB1 PRO 71 -16.157 -5.483 -14.975 603 HG2 PRO 71 HG2 PRO 71 -14.629 -7.397 -15.995 604 HG3 PRO 71 HG1 PRO 71 -14.014 -5.736 -15.849 605 HD2 PRO 71 HD2 PRO 71 -13.480 -8.109 -14.093 606 HD3 PRO 71 HD1 PRO 71 -12.348 -6.892 -14.712 607 HA PRO 72 HA PRO 72 -17.333 -4.112 -13.230 608 HB2 PRO 72 HB2 PRO 72 -18.283 -2.830 -10.761 609 HB3 PRO 72 HB1 PRO 72 -19.188 -3.293 -12.206 610 HG2 PRO 72 HG2 PRO 72 -19.488 -4.616 -9.897 611 HG3 PRO 72 HG1 PRO 72 -19.533 -5.458 -11.458 612 HD2 PRO 72 HD2 PRO 72 -17.265 -5.233 -9.499 613 HD3 PRO 72 HD1 PRO 72 -17.865 -6.669 -10.359 614 H VAL 73 HN VAL 73 -16.853 -1.862 -13.473 615 HA VAL 73 HA VAL 73 -14.238 -1.146 -12.582 616 HB VAL 73 HB VAL 73 -16.324 0.514 -14.019 617 HG11 VAL 73 HG11 VAL 73 -14.130 1.700 -14.798 618 HG12 VAL 73 HG12 VAL 73 -13.478 1.042 -13.297 619 HG13 VAL 73 HG13 VAL 73 -14.870 2.124 -13.254 620 HG21 VAL 73 HG21 VAL 73 -15.913 -0.917 -15.692 621 HG22 VAL 73 HG22 VAL 73 -14.484 -1.578 -14.898 622 HG23 VAL 73 HG23 VAL 73 -14.363 -0.088 -15.834 623 H ARG 74 HN ARG 74 -13.679 -0.075 -10.780 624 HA ARG 74 HA ARG 74 -15.803 1.072 -9.107 625 HB2 ARG 74 HB2 ARG 74 -12.900 0.615 -8.411 626 HB3 ARG 74 HB1 ARG 74 -14.191 1.027 -7.299 627 HG2 ARG 74 HG2 ARG 74 -13.966 -1.543 -8.847 628 HG3 ARG 74 HG1 ARG 74 -13.554 -1.320 -7.147 629 HD2 ARG 74 HD2 ARG 74 -15.907 -0.656 -6.713 630 HD3 ARG 74 HD1 ARG 74 -16.285 -1.009 -8.398 631 HE ARG 74 HE ARG 74 -15.085 -3.263 -7.226 632 HH11 ARG 74 HH11 ARG 74 -18.043 -1.431 -7.120 633 HH12 ARG 74 HH12 ARG 74 -19.022 -2.784 -6.658 634 HH21 ARG 74 HH21 ARG 74 -16.355 -5.055 -6.619 635 HH22 ARG 74 HH22 ARG 74 -18.057 -4.852 -6.372 636 H ARG 75 HN ARG 75 -16.181 3.186 -9.376 637 HA ARG 75 HA ARG 75 -13.919 4.881 -10.137 638 HB2 ARG 75 HB2 ARG 75 -16.882 5.443 -10.193 639 HB3 ARG 75 HB1 ARG 75 -15.628 6.602 -10.619 640 HG2 ARG 75 HG2 ARG 75 -14.874 5.046 -12.398 641 HG3 ARG 75 HG1 ARG 75 -16.268 4.027 -12.034 642 HD2 ARG 75 HD2 ARG 75 -16.393 6.918 -12.868 643 HD3 ARG 75 HD1 ARG 75 -16.650 5.546 -13.943 644 HE ARG 75 HE ARG 75 -18.421 5.226 -11.849 645 HH11 ARG 75 HH11 ARG 75 -17.811 7.593 -14.329 646 HH12 ARG 75 HH12 ARG 75 -19.458 8.114 -14.424 647 HH21 ARG 75 HH21 ARG 75 -20.597 5.899 -11.962 648 HH22 ARG 75 HH22 ARG 75 -21.048 7.148 -13.073 649 H ILE 76 HN ILE 76 -12.940 6.004 -8.660 650 HA ILE 76 HA ILE 76 -14.323 6.524 -6.107 651 HB ILE 76 HB ILE 76 -11.355 6.367 -6.628 652 HG12 ILE 76 HG12 ILE 76 -13.230 4.385 -5.309 653 HG13 ILE 76 HG11 ILE 76 -12.486 4.196 -6.896 654 HG21 ILE 76 HG21 ILE 76 -11.544 7.731 -4.763 655 HG22 ILE 76 HG22 ILE 76 -11.433 6.128 -4.036 656 HG23 ILE 76 HG23 ILE 76 -13.000 6.919 -4.190 657 HD11 ILE 76 HD11 ILE 76 -11.430 2.926 -5.017 658 HD12 ILE 76 HD12 ILE 76 -10.896 4.483 -4.381 659 HD13 ILE 76 HD13 ILE 76 -10.350 3.945 -5.968 660 H ILE 77 HN ILE 77 -14.917 8.596 -5.829 661 HA ILE 77 HA ILE 77 -13.333 10.692 -7.160 662 HB ILE 77 HB ILE 77 -16.273 10.818 -6.506 663 HG12 ILE 77 HG12 ILE 77 -15.903 10.988 -9.278 664 HG13 ILE 77 HG11 ILE 77 -14.859 9.668 -8.759 665 HG21 ILE 77 HG21 ILE 77 -14.872 12.963 -6.579 666 HG22 ILE 77 HG22 ILE 77 -16.339 12.905 -7.558 667 HG23 ILE 77 HG23 ILE 77 -14.762 12.672 -8.315 668 HD11 ILE 77 HD11 ILE 77 -16.707 8.510 -7.785 669 HD12 ILE 77 HD12 ILE 77 -17.132 8.962 -9.435 670 HD13 ILE 77 HD13 ILE 77 -17.779 9.880 -8.075 671 H GLY 78 HN GLY 78 -12.393 12.150 -5.881 672 HA2 GLY 78 HA2 GLY 78 -13.441 13.422 -3.675 673 HA3 GLY 78 HA1 GLY 78 -12.639 11.989 -3.045 674 H ASP 79 HN ASP 79 -11.271 13.608 -1.935 675 HA ASP 79 HA ASP 79 -9.446 15.141 -3.575 676 HB2 ASP 79 HB2 ASP 79 -10.215 15.985 -1.365 677 HB3 ASP 79 HB1 ASP 79 -9.406 14.630 -0.586 678 H LEU 80 HN LEU 80 -8.133 13.844 -4.748 679 HA LEU 80 HA LEU 80 -6.951 11.483 -3.567 680 HB2 LEU 80 HB2 LEU 80 -6.584 12.706 -6.305 681 HB3 LEU 80 HB1 LEU 80 -5.937 11.159 -5.799 682 HG LEU 80 HG LEU 80 -8.876 11.832 -5.998 683 HD11 LEU 80 HD11 LEU 80 -7.496 11.642 -8.146 684 HD12 LEU 80 HD12 LEU 80 -8.939 10.639 -8.005 685 HD13 LEU 80 HD13 LEU 80 -7.345 9.932 -7.742 686 HD21 LEU 80 HD21 LEU 80 -8.641 10.184 -4.326 687 HD22 LEU 80 HD22 LEU 80 -7.392 9.330 -5.232 688 HD23 LEU 80 HD23 LEU 80 -9.062 9.309 -5.799 689 H SER 81 HN SER 81 -6.128 14.731 -3.609 690 HA SER 81 HA SER 81 -3.316 14.542 -3.965 691 HB2 SER 81 HB2 SER 81 -4.964 16.618 -2.493 692 HB3 SER 81 HB1 SER 81 -3.251 16.781 -2.876 693 HG SER 81 HG SER 81 -3.823 17.430 -4.778 694 H ASN 82 HN ASN 82 -5.433 13.797 -1.378 695 HA ASN 82 HA ASN 82 -3.380 13.799 0.659 696 HB2 ASN 82 HB2 ASN 82 -5.720 14.365 1.226 697 HB3 ASN 82 HB1 ASN 82 -6.208 12.750 0.744 698 HD21 ASN 82 HD21 ASN 82 -7.031 13.127 3.077 699 HD22 ASN 82 HD22 ASN 82 -6.010 12.502 4.325 700 H ARG 83 HN ARG 83 -1.959 12.226 0.808 701 HA ARG 83 HA ARG 83 -2.042 9.909 -0.724 702 HB2 ARG 83 HB2 ARG 83 -0.392 10.575 1.721 703 HB3 ARG 83 HB1 ARG 83 -0.165 9.092 0.805 704 HG2 ARG 83 HG2 ARG 83 0.254 10.521 -1.217 705 HG3 ARG 83 HG1 ARG 83 0.261 11.915 -0.137 706 HD2 ARG 83 HD2 ARG 83 2.074 9.520 0.124 707 HD3 ARG 83 HD1 ARG 83 2.528 11.048 -0.630 708 HE ARG 83 HE ARG 83 2.203 10.520 2.207 709 HH11 ARG 83 HH11 ARG 83 2.594 12.897 -0.311 710 HH12 ARG 83 HH12 ARG 83 3.161 14.133 0.762 711 HH21 ARG 83 HH21 ARG 83 2.947 12.136 3.630 712 HH22 ARG 83 HH22 ARG 83 3.362 13.698 3.009 713 H GLU 84 HN GLU 84 -3.153 10.443 2.573 714 HA GLU 84 HA GLU 84 -3.471 7.753 3.327 715 HB2 GLU 84 HB2 GLU 84 -4.903 10.256 4.168 716 HB3 GLU 84 HB1 GLU 84 -5.285 8.680 4.850 717 HG2 GLU 84 HG2 GLU 84 -3.106 8.447 5.746 718 HG3 GLU 84 HG1 GLU 84 -2.528 9.871 4.879 719 H LYS 85 HN LYS 85 -5.780 9.920 1.630 720 HA LYS 85 HA LYS 85 -7.833 7.964 1.623 721 HB2 LYS 85 HB2 LYS 85 -7.374 10.380 -0.141 722 HB3 LYS 85 HB1 LYS 85 -8.774 9.331 -0.326 723 HG2 LYS 85 HG2 LYS 85 -9.481 9.873 1.947 724 HG3 LYS 85 HG1 LYS 85 -8.079 10.928 2.132 725 HD2 LYS 85 HD2 LYS 85 -8.882 12.256 0.190 726 HD3 LYS 85 HD1 LYS 85 -10.317 11.236 0.132 727 HE2 LYS 85 HE2 LYS 85 -9.485 12.933 2.483 728 HE3 LYS 85 HE1 LYS 85 -10.733 13.356 1.310 729 HZ1 LYS 85 HZ1 LYS 85 -11.587 10.965 2.080 730 HZ2 LYS 85 HZ2 LYS 85 -12.054 12.400 2.842 731 HZ3 LYS 85 HZ3 LYS 85 -10.820 11.455 3.507 732 H VAL 86 HN VAL 86 -5.306 8.711 -0.727 733 HA VAL 86 HA VAL 86 -6.180 6.870 -2.675 734 HB VAL 86 HB VAL 86 -3.408 7.952 -2.108 735 HG11 VAL 86 HG11 VAL 86 -2.620 6.364 -3.461 736 HG12 VAL 86 HG12 VAL 86 -3.524 7.141 -4.761 737 HG13 VAL 86 HG13 VAL 86 -4.244 5.804 -3.863 738 HG21 VAL 86 HG21 VAL 86 -4.454 9.778 -2.923 739 HG22 VAL 86 HG22 VAL 86 -5.755 8.837 -3.653 740 HG23 VAL 86 HG23 VAL 86 -4.203 8.981 -4.477 741 H LEU 87 HN LEU 87 -3.893 6.515 0.031 742 HA LEU 87 HA LEU 87 -3.232 3.804 -0.480 743 HB2 LEU 87 HB2 LEU 87 -1.777 5.166 0.863 744 HB3 LEU 87 HB1 LEU 87 -3.071 5.538 1.984 745 HG LEU 87 HG LEU 87 -3.091 3.176 2.702 746 HD11 LEU 87 HD11 LEU 87 -0.699 2.116 2.004 747 HD12 LEU 87 HD12 LEU 87 -1.157 2.935 0.512 748 HD13 LEU 87 HD13 LEU 87 -2.232 1.728 1.221 749 HD21 LEU 87 HD21 LEU 87 -1.740 5.005 3.799 750 HD22 LEU 87 HD22 LEU 87 -0.336 4.351 2.952 751 HD23 LEU 87 HD23 LEU 87 -1.206 3.353 4.117 752 H ILE 88 HN ILE 88 -5.602 5.270 1.728 753 HA ILE 88 HA ILE 88 -6.471 2.848 2.862 754 HB ILE 88 HB ILE 88 -7.810 5.528 2.605 755 HG12 ILE 88 HG12 ILE 88 -6.759 4.078 5.038 756 HG13 ILE 88 HG11 ILE 88 -5.762 5.148 4.060 757 HG21 ILE 88 HG21 ILE 88 -8.840 3.039 3.956 758 HG22 ILE 88 HG22 ILE 88 -9.636 4.007 2.714 759 HG23 ILE 88 HG23 ILE 88 -9.417 4.662 4.338 760 HD11 ILE 88 HD11 ILE 88 -6.421 6.771 5.409 761 HD12 ILE 88 HD12 ILE 88 -7.700 5.773 6.106 762 HD13 ILE 88 HD13 ILE 88 -7.993 6.664 4.613 763 H ALA 89 HN ALA 89 -7.758 4.688 0.086 764 HA ALA 89 HA ALA 89 -9.911 2.937 -0.438 765 HB1 ALA 89 HB1 ALA 89 -8.825 4.221 -2.817 766 HB2 ALA 89 HB2 ALA 89 -9.051 5.339 -1.470 767 HB3 ALA 89 HB3 ALA 89 -10.412 4.388 -2.064 768 H LEU 90 HN LEU 90 -6.572 2.951 -1.647 769 HA LEU 90 HA LEU 90 -6.934 0.821 -3.486 770 HB2 LEU 90 HB2 LEU 90 -4.466 1.850 -2.091 771 HB3 LEU 90 HB1 LEU 90 -4.424 0.562 -3.278 772 HG LEU 90 HG LEU 90 -5.441 3.344 -3.845 773 HD11 LEU 90 HD11 LEU 90 -3.294 3.938 -3.810 774 HD12 LEU 90 HD12 LEU 90 -3.114 2.960 -5.265 775 HD13 LEU 90 HD13 LEU 90 -2.745 2.267 -3.684 776 HD21 LEU 90 HD21 LEU 90 -4.746 2.300 -6.220 777 HD22 LEU 90 HD22 LEU 90 -6.371 2.179 -5.548 778 HD23 LEU 90 HD23 LEU 90 -5.246 0.830 -5.385 779 H ARG 91 HN ARG 91 -6.096 0.925 -0.053 780 HA ARG 91 HA ARG 91 -5.358 -1.795 0.238 781 HB2 ARG 91 HB2 ARG 91 -4.810 -0.050 1.891 782 HB3 ARG 91 HB1 ARG 91 -6.517 0.126 2.269 783 HG2 ARG 91 HG2 ARG 91 -6.588 -2.148 3.119 784 HG3 ARG 91 HG1 ARG 91 -4.891 -2.376 2.688 785 HD2 ARG 91 HD2 ARG 91 -4.251 -0.608 4.244 786 HD3 ARG 91 HD1 ARG 91 -5.945 -0.347 4.658 787 HE ARG 91 HE ARG 91 -5.338 -3.035 5.122 788 HH11 ARG 91 HH11 ARG 91 -4.508 0.113 6.360 789 HH12 ARG 91 HH12 ARG 91 -4.200 -0.455 7.968 790 HH21 ARG 91 HH21 ARG 91 -4.938 -3.799 7.231 791 HH22 ARG 91 HH22 ARG 91 -4.444 -2.686 8.464 792 H LEU 92 HN LEU 92 -8.445 -0.090 0.741 793 HA LEU 92 HA LEU 92 -9.908 -2.349 1.562 794 HB2 LEU 92 HB2 LEU 92 -10.784 0.227 0.258 795 HB3 LEU 92 HB1 LEU 92 -11.913 -0.985 0.833 796 HG LEU 92 HG LEU 92 -9.898 0.408 2.598 797 HD11 LEU 92 HD11 LEU 92 -11.908 1.625 3.461 798 HD12 LEU 92 HD12 LEU 92 -12.797 1.019 2.063 799 HD13 LEU 92 HD13 LEU 92 -11.407 2.080 1.832 800 HD21 LEU 92 HD21 LEU 92 -11.674 -0.429 4.314 801 HD22 LEU 92 HD22 LEU 92 -10.439 -1.536 3.713 802 HD23 LEU 92 HD23 LEU 92 -12.071 -1.590 3.047 803 H LEU 93 HN LEU 93 -9.316 -0.993 -1.648 804 HA LEU 93 HA LEU 93 -11.091 -2.706 -3.045 805 HB2 LEU 93 HB2 LEU 93 -8.620 -1.229 -3.941 806 HB3 LEU 93 HB1 LEU 93 -9.637 -2.146 -5.033 807 HG LEU 93 HG LEU 93 -10.596 0.200 -3.393 808 HD11 LEU 93 HD11 LEU 93 -9.463 1.444 -4.854 809 HD12 LEU 93 HD12 LEU 93 -10.655 0.927 -6.045 810 HD13 LEU 93 HD13 LEU 93 -9.123 0.065 -5.899 811 HD21 LEU 93 HD21 LEU 93 -12.110 -0.389 -5.755 812 HD22 LEU 93 HD22 LEU 93 -12.642 -0.336 -4.075 813 HD23 LEU 93 HD23 LEU 93 -11.995 -1.831 -4.748 814 H ALA 94 HN ALA 94 -7.684 -2.949 -2.157 815 HA ALA 94 HA ALA 94 -7.077 -5.277 -3.619 816 HB1 ALA 94 HB1 ALA 94 -5.667 -4.774 -1.055 817 HB2 ALA 94 HB2 ALA 94 -5.551 -3.552 -2.322 818 HB3 ALA 94 HB3 ALA 94 -5.020 -5.204 -2.638 819 H GLU 95 HN GLU 95 -8.369 -4.832 -0.359 820 HA GLU 95 HA GLU 95 -8.143 -7.499 0.495 821 HB2 GLU 95 HB2 GLU 95 -10.061 -5.289 1.238 822 HB3 GLU 95 HB1 GLU 95 -10.050 -6.853 2.041 823 HG2 GLU 95 HG2 GLU 95 -7.828 -6.496 2.852 824 HG3 GLU 95 HG1 GLU 95 -7.662 -5.029 1.890 825 H GLU 96 HN GLU 96 -10.609 -5.788 -1.336 826 HA GLU 96 HA GLU 96 -12.567 -7.812 -1.403 827 HB2 GLU 96 HB2 GLU 96 -11.901 -5.561 -3.317 828 HB3 GLU 96 HB1 GLU 96 -13.301 -6.610 -3.518 829 HG2 GLU 96 HG2 GLU 96 -14.259 -5.843 -1.465 830 HG3 GLU 96 HG1 GLU 96 -12.794 -4.953 -1.058 831 H ILE 97 HN ILE 97 -9.819 -7.079 -3.469 832 HA ILE 97 HA ILE 97 -10.291 -9.008 -5.476 833 HB ILE 97 HB ILE 97 -7.742 -7.653 -4.581 834 HG12 ILE 97 HG12 ILE 97 -9.491 -7.117 -6.982 835 HG13 ILE 97 HG11 ILE 97 -9.681 -6.281 -5.441 836 HG21 ILE 97 HG21 ILE 97 -8.211 -9.086 -7.194 837 HG22 ILE 97 HG22 ILE 97 -7.356 -9.803 -5.828 838 HG23 ILE 97 HG23 ILE 97 -6.706 -8.363 -6.618 839 HD11 ILE 97 HD11 ILE 97 -7.894 -4.994 -5.767 840 HD12 ILE 97 HD12 ILE 97 -8.200 -5.369 -7.463 841 HD13 ILE 97 HD13 ILE 97 -6.976 -6.271 -6.568 842 H GLY 98 HN GLY 98 -8.277 -9.045 -2.549 843 HA2 GLY 98 HA2 GLY 98 -7.189 -11.624 -2.885 844 HA3 GLY 98 HA1 GLY 98 -7.334 -10.769 -1.356 845 H ASP 99 HN ASP 99 -10.188 -10.535 -1.423 846 HA ASP 99 HA ASP 99 -10.932 -12.926 -0.146 847 HB2 ASP 99 HB2 ASP 99 -12.005 -10.723 0.254 848 HB3 ASP 99 HB1 ASP 99 -12.756 -10.826 -1.335 849 H TYR 100 HN TYR 100 -11.451 -11.802 -3.457 850 HA TYR 100 HA TYR 100 -13.115 -14.044 -4.141 851 HB2 TYR 100 HB2 TYR 100 -13.435 -11.882 -5.257 852 HB3 TYR 100 HB1 TYR 100 -11.796 -11.957 -5.894 853 HD1 TYR 100 HD1 TYR 100 -15.091 -13.675 -6.005 854 HD2 TYR 100 HD2 TYR 100 -11.360 -13.019 -7.945 855 HE1 TYR 100 HE1 TYR 100 -15.927 -14.846 -7.999 856 HE2 TYR 100 HE2 TYR 100 -12.188 -14.188 -9.945 857 HH TYR 100 HH TYR 100 -14.858 -16.128 -9.964 858 H LYS 101 HN LYS 101 -12.307 -15.988 -4.367 859 HA LYS 101 HA LYS 101 -9.609 -16.305 -5.496 860 HB2 LYS 101 HB2 LYS 101 -11.175 -18.182 -3.711 861 HB3 LYS 101 HB1 LYS 101 -9.586 -18.520 -4.380 862 HG2 LYS 101 HG2 LYS 101 -8.630 -16.680 -3.126 863 HG3 LYS 101 HG1 LYS 101 -10.225 -16.245 -2.510 864 HD2 LYS 101 HD2 LYS 101 -9.134 -17.474 -0.790 865 HD3 LYS 101 HD1 LYS 101 -10.343 -18.547 -1.495 866 HE2 LYS 101 HE2 LYS 101 -8.311 -19.784 -1.166 867 HE3 LYS 101 HE1 LYS 101 -8.558 -19.555 -2.895 868 HZ1 LYS 101 HZ1 LYS 101 -7.048 -17.407 -1.898 869 HZ2 LYS 101 HZ2 LYS 101 -6.589 -18.584 -3.023 870 HZ3 LYS 101 HZ3 LYS 101 -6.334 -18.851 -1.372 871 H ASP 102 HN ASP 102 -9.285 -17.671 -7.219 872 HA ASP 102 HA ASP 102 -11.428 -18.107 -8.993 873 HB2 ASP 102 HB2 ASP 102 -9.090 -17.849 -9.740 874 HB3 ASP 102 HB1 ASP 102 -8.693 -19.405 -9.015 875 H ASP 103 HN ASP 103 -9.722 -20.302 -6.801 876 HA ASP 103 HA ASP 103 -12.010 -22.053 -6.715 877 HB2 ASP 103 HB2 ASP 103 -10.506 -22.722 -8.740 878 HB3 ASP 103 HB1 ASP 103 -9.418 -23.355 -7.511 879 H ASP 104 HN ASP 104 -11.841 -23.639 -5.010 880 HA ASP 104 HA ASP 104 -10.471 -22.651 -2.718 881 HB2 ASP 104 HB2 ASP 104 -12.678 -23.944 -2.783 882 HB3 ASP 104 HB1 ASP 104 -11.699 -25.396 -2.960 883 H ASP 105 HN ASP 105 -9.767 -25.098 -5.083 884 HA ASP 105 HA ASP 105 -7.986 -26.447 -5.489 885 HB2 ASP 105 HB2 ASP 105 -6.886 -24.128 -5.245 886 HB3 ASP 105 HB1 ASP 105 -6.341 -24.702 -3.672 887 H LYS 106 HN LYS 106 -9.633 -27.387 -3.478 888 HA LYS 106 HA LYS 106 -7.694 -28.775 -1.755 889 HB2 LYS 106 HB2 LYS 106 -10.459 -27.860 -0.926 890 HB3 LYS 106 HB1 LYS 106 -9.371 -28.830 0.054 891 HG2 LYS 106 HG2 LYS 106 -8.799 -26.027 -0.895 892 HG3 LYS 106 HG1 LYS 106 -9.409 -26.455 0.705 893 HD2 LYS 106 HD2 LYS 106 -7.383 -27.805 1.090 894 HD3 LYS 106 HD1 LYS 106 -6.773 -27.311 -0.493 895 HE2 LYS 106 HE2 LYS 106 -6.805 -24.972 0.232 896 HE3 LYS 106 HE1 LYS 106 -7.407 -25.470 1.812 897 HZ1 LYS 106 HZ1 LYS 106 -5.008 -25.079 1.808 898 HZ2 LYS 106 HZ2 LYS 106 -4.801 -26.288 0.645 899 HZ3 LYS 106 HZ3 LYS 106 -5.373 -26.688 2.186 Start of MODEL 2 1 H1 MET 1 HT1 MET 1 -14.221 -12.668 -18.649 2 H2 MET 1 HT2 MET 1 -15.785 -12.251 -19.133 3 H3 MET 1 HT3 MET 1 -15.555 -13.463 -17.978 4 HA MET 1 HA MET 1 -14.944 -10.582 -17.653 5 HB2 MET 1 HB2 MET 1 -17.020 -12.344 -16.332 6 HB3 MET 1 HB1 MET 1 -16.716 -10.659 -15.936 7 HG2 MET 1 HG2 MET 1 -17.408 -9.987 -18.163 8 HG3 MET 1 HG1 MET 1 -17.659 -11.674 -18.609 9 HE1 MET 1 HE1 MET 1 -21.330 -10.393 -18.460 10 HE2 MET 1 HE2 MET 1 -20.159 -11.342 -19.378 11 HE3 MET 1 HE3 MET 1 -19.896 -9.616 -19.131 12 H ALA 2 HN ALA 2 -13.806 -13.573 -17.052 13 HA ALA 2 HA ALA 2 -12.953 -12.989 -14.304 14 HB1 ALA 2 HB1 ALA 2 -14.011 -15.251 -15.126 15 HB2 ALA 2 HB2 ALA 2 -12.708 -15.240 -13.939 16 HB3 ALA 2 HB3 ALA 2 -12.355 -15.587 -15.632 17 HA PRO 3 HA PRO 3 -9.083 -11.594 -16.165 18 HB2 PRO 3 HB2 PRO 3 -8.332 -11.519 -13.288 19 HB3 PRO 3 HB1 PRO 3 -8.195 -10.258 -14.518 20 HG2 PRO 3 HG2 PRO 3 -10.079 -10.098 -12.662 21 HG3 PRO 3 HG1 PRO 3 -10.445 -9.665 -14.344 22 HD2 PRO 3 HD2 PRO 3 -11.094 -12.191 -12.855 23 HD3 PRO 3 HD1 PRO 3 -12.113 -11.242 -13.960 24 H LEU 4 HN LEU 4 -7.098 -12.508 -16.533 25 HA LEU 4 HA LEU 4 -6.777 -15.251 -15.583 26 HB2 LEU 4 HB2 LEU 4 -5.215 -13.755 -17.692 27 HB3 LEU 4 HB1 LEU 4 -5.144 -15.477 -17.371 28 HG LEU 4 HG LEU 4 -7.521 -13.970 -18.464 29 HD11 LEU 4 HD11 LEU 4 -5.259 -15.335 -19.692 30 HD12 LEU 4 HD12 LEU 4 -6.411 -14.192 -20.381 31 HD13 LEU 4 HD13 LEU 4 -6.826 -15.902 -20.270 32 HD21 LEU 4 HD21 LEU 4 -7.186 -16.917 -17.914 33 HD22 LEU 4 HD22 LEU 4 -8.552 -16.169 -18.744 34 HD23 LEU 4 HD23 LEU 4 -8.248 -15.804 -17.046 35 H ARG 5 HN ARG 5 -5.919 -12.356 -14.460 36 HA ARG 5 HA ARG 5 -3.442 -13.371 -13.285 37 HB2 ARG 5 HB2 ARG 5 -2.684 -10.878 -13.353 38 HB3 ARG 5 HB1 ARG 5 -2.480 -11.893 -14.775 39 HG2 ARG 5 HG2 ARG 5 -5.036 -10.472 -14.603 40 HG3 ARG 5 HG1 ARG 5 -3.611 -9.449 -14.801 41 HD2 ARG 5 HD2 ARG 5 -2.988 -10.569 -16.804 42 HD3 ARG 5 HD1 ARG 5 -4.176 -11.844 -16.533 43 HE ARG 5 HE ARG 5 -5.513 -9.385 -16.706 44 HH11 ARG 5 HH11 ARG 5 -3.711 -11.589 -18.713 45 HH12 ARG 5 HH12 ARG 5 -4.537 -11.147 -20.170 46 HH21 ARG 5 HH21 ARG 5 -6.607 -8.790 -18.616 47 HH22 ARG 5 HH22 ARG 5 -6.187 -9.550 -20.114 48 H LYS 6 HN LYS 6 -2.844 -12.246 -11.265 49 HA LYS 6 HA LYS 6 -5.233 -11.703 -9.688 50 HB2 LYS 6 HB2 LYS 6 -2.360 -12.079 -8.853 51 HB3 LYS 6 HB1 LYS 6 -3.713 -11.855 -7.750 52 HG2 LYS 6 HG2 LYS 6 -4.699 -13.925 -9.011 53 HG3 LYS 6 HG1 LYS 6 -3.010 -14.211 -9.435 54 HD2 LYS 6 HD2 LYS 6 -3.949 -13.768 -6.614 55 HD3 LYS 6 HD1 LYS 6 -3.847 -15.367 -7.349 56 HE2 LYS 6 HE2 LYS 6 -1.552 -13.434 -6.994 57 HE3 LYS 6 HE1 LYS 6 -1.862 -14.858 -6.007 58 HZ1 LYS 6 HZ1 LYS 6 -0.554 -15.912 -7.444 59 HZ2 LYS 6 HZ2 LYS 6 -0.623 -14.664 -8.584 60 HZ3 LYS 6 HZ3 LYS 6 -1.842 -15.835 -8.539 61 H THR 7 HN THR 7 -3.142 -9.888 -11.461 62 HA THR 7 HA THR 7 -2.910 -7.687 -9.590 63 HB THR 7 HB THR 7 -1.930 -6.533 -11.699 64 HG1 THR 7 HG1 THR 7 -2.723 -8.120 -13.182 65 HG21 THR 7 HG21 THR 7 -0.796 -8.527 -9.891 66 HG22 THR 7 HG22 THR 7 -0.173 -6.947 -10.375 67 HG23 THR 7 HG23 THR 7 0.105 -8.355 -11.400 68 H ALA 8 HN ALA 8 -4.270 -6.090 -9.417 69 HA ALA 8 HA ALA 8 -6.543 -5.881 -11.206 70 HB1 ALA 8 HB1 ALA 8 -7.485 -4.412 -9.599 71 HB2 ALA 8 HB2 ALA 8 -5.920 -4.145 -8.828 72 HB3 ALA 8 HB3 ALA 8 -6.710 -5.717 -8.698 73 H VAL 9 HN VAL 9 -7.151 -3.921 -12.266 74 HA VAL 9 HA VAL 9 -4.807 -2.271 -12.943 75 HB VAL 9 HB VAL 9 -7.195 -2.905 -14.674 76 HG11 VAL 9 HG11 VAL 9 -5.603 -1.822 -16.431 77 HG12 VAL 9 HG12 VAL 9 -4.866 -1.051 -15.027 78 HG13 VAL 9 HG13 VAL 9 -6.571 -0.784 -15.385 79 HG21 VAL 9 HG21 VAL 9 -4.435 -3.645 -15.451 80 HG22 VAL 9 HG22 VAL 9 -5.959 -4.481 -15.746 81 HG23 VAL 9 HG23 VAL 9 -5.186 -4.589 -14.164 82 H LEU 10 HN LEU 10 -4.922 -0.214 -12.431 83 HA LEU 10 HA LEU 10 -7.553 1.005 -11.850 84 HB2 LEU 10 HB2 LEU 10 -4.863 1.389 -10.599 85 HB3 LEU 10 HB1 LEU 10 -5.996 2.719 -10.618 86 HG LEU 10 HG LEU 10 -6.676 0.051 -9.392 87 HD11 LEU 10 HD11 LEU 10 -5.901 0.765 -7.318 88 HD12 LEU 10 HD12 LEU 10 -5.736 2.438 -7.851 89 HD13 LEU 10 HD13 LEU 10 -4.606 1.213 -8.428 90 HD21 LEU 10 HD21 LEU 10 -8.513 1.659 -9.979 91 HD22 LEU 10 HD22 LEU 10 -7.782 2.807 -8.860 92 HD23 LEU 10 HD23 LEU 10 -8.404 1.268 -8.262 93 H LYS 11 HN LYS 11 -8.090 2.820 -13.034 94 HA LYS 11 HA LYS 11 -5.961 3.802 -14.812 95 HB2 LYS 11 HB2 LYS 11 -8.927 3.587 -15.349 96 HB3 LYS 11 HB1 LYS 11 -7.841 4.559 -16.332 97 HG2 LYS 11 HG2 LYS 11 -6.547 2.546 -16.871 98 HG3 LYS 11 HG1 LYS 11 -7.677 1.581 -15.922 99 HD2 LYS 11 HD2 LYS 11 -9.500 2.245 -17.405 100 HD3 LYS 11 HD1 LYS 11 -8.386 3.243 -18.340 101 HE2 LYS 11 HE2 LYS 11 -7.100 1.249 -18.935 102 HE3 LYS 11 HE1 LYS 11 -8.207 0.251 -17.994 103 HZ1 LYS 11 HZ1 LYS 11 -9.570 0.139 -19.719 104 HZ2 LYS 11 HZ2 LYS 11 -8.443 0.984 -20.656 105 HZ3 LYS 11 HZ3 LYS 11 -9.659 1.825 -19.835 106 H LEU 12 HN LEU 12 -5.398 5.826 -14.582 107 HA LEU 12 HA LEU 12 -7.078 7.522 -12.877 108 HB2 LEU 12 HB2 LEU 12 -4.353 6.952 -12.771 109 HB3 LEU 12 HB1 LEU 12 -4.422 8.557 -13.469 110 HG LEU 12 HG LEU 12 -5.573 7.714 -10.808 111 HD11 LEU 12 HD11 LEU 12 -3.880 9.129 -9.854 112 HD12 LEU 12 HD12 LEU 12 -3.326 9.613 -11.456 113 HD13 LEU 12 HD13 LEU 12 -3.111 7.949 -10.916 114 HD21 LEU 12 HD21 LEU 12 -5.796 10.262 -12.368 115 HD22 LEU 12 HD22 LEU 12 -5.860 10.265 -10.606 116 HD23 LEU 12 HD23 LEU 12 -7.056 9.355 -11.530 117 H TYR 13 HN TYR 13 -8.141 9.209 -13.910 118 HA TYR 13 HA TYR 13 -7.289 9.839 -16.646 119 HB2 TYR 13 HB2 TYR 13 -9.835 10.482 -15.136 120 HB3 TYR 13 HB1 TYR 13 -9.513 10.891 -16.819 121 HD1 TYR 13 HD1 TYR 13 -10.409 8.228 -14.492 122 HD2 TYR 13 HD2 TYR 13 -9.421 9.124 -18.532 123 HE1 TYR 13 HE1 TYR 13 -11.274 6.034 -15.182 124 HE2 TYR 13 HE2 TYR 13 -10.286 6.930 -19.234 125 HH TYR 13 HH TYR 13 -11.368 5.078 -18.598 126 H VAL 14 HN VAL 14 -6.070 11.623 -16.894 127 HA VAL 14 HA VAL 14 -6.353 13.777 -14.899 128 HB VAL 14 HB VAL 14 -3.956 14.263 -15.184 129 HG11 VAL 14 HG11 VAL 14 -4.505 13.003 -13.264 130 HG12 VAL 14 HG12 VAL 14 -3.117 12.190 -13.988 131 HG13 VAL 14 HG13 VAL 14 -4.738 11.529 -14.205 132 HG21 VAL 14 HG21 VAL 14 -3.732 11.618 -16.604 133 HG22 VAL 14 HG22 VAL 14 -2.472 12.823 -16.343 134 HG23 VAL 14 HG23 VAL 14 -3.799 13.164 -17.453 135 H ALA 15 HN ALA 15 -5.696 15.902 -15.661 136 HA ALA 15 HA ALA 15 -6.146 16.202 -18.554 137 HB1 ALA 15 HB1 ALA 15 -7.854 17.105 -16.639 138 HB2 ALA 15 HB2 ALA 15 -7.685 17.822 -18.242 139 HB3 ALA 15 HB3 ALA 15 -6.820 18.516 -16.870 140 H GLY 16 HN GLY 16 -4.176 16.505 -19.346 141 HA2 GLY 16 HA2 GLY 16 -2.179 17.513 -19.815 142 HA3 GLY 16 HA1 GLY 16 -2.831 18.941 -19.026 143 H ASN 17 HN ASN 17 -1.208 19.634 -17.782 144 HA ASN 17 HA ASN 17 -0.101 17.727 -15.832 145 HB2 ASN 17 HB2 ASN 17 1.385 20.025 -17.138 146 HB3 ASN 17 HB1 ASN 17 2.038 18.941 -15.916 147 HD21 ASN 17 HD21 ASN 17 1.619 16.517 -16.608 148 HD22 ASN 17 HD22 ASN 17 2.157 16.149 -18.207 149 H THR 18 HN THR 18 -2.351 19.104 -15.264 150 HA THR 18 HA THR 18 -1.841 21.581 -13.930 151 HB THR 18 HB THR 18 -4.093 21.206 -12.900 152 HG1 THR 18 HG1 THR 18 -4.638 19.086 -14.597 153 HG21 THR 18 HG21 THR 18 -3.862 22.384 -15.025 154 HG22 THR 18 HG22 THR 18 -5.351 21.439 -14.982 155 HG23 THR 18 HG23 THR 18 -3.959 20.852 -15.893 156 HA PRO 19 HA PRO 19 -0.155 20.307 -10.104 157 HB2 PRO 19 HB2 PRO 19 -1.769 21.707 -8.328 158 HB3 PRO 19 HB1 PRO 19 -0.356 22.370 -9.154 159 HG2 PRO 19 HG2 PRO 19 -3.253 22.605 -9.867 160 HG3 PRO 19 HG1 PRO 19 -1.976 23.834 -9.946 161 HD2 PRO 19 HD2 PRO 19 -2.821 22.597 -12.145 162 HD3 PRO 19 HD1 PRO 19 -1.097 22.965 -11.915 163 H ASN 20 HN ASN 20 -3.671 20.245 -10.329 164 HA ASN 20 HA ASN 20 -4.089 18.452 -8.168 165 HB2 ASN 20 HB2 ASN 20 -5.816 18.940 -10.627 166 HB3 ASN 20 HB1 ASN 20 -6.293 17.951 -9.256 167 HD21 ASN 20 HD21 ASN 20 -6.322 19.006 -7.134 168 HD22 ASN 20 HD22 ASN 20 -6.790 20.667 -7.055 169 H SER 21 HN SER 21 -3.630 17.975 -11.661 170 HA SER 21 HA SER 21 -3.851 15.118 -11.625 171 HB2 SER 21 HB2 SER 21 -2.605 17.010 -13.631 172 HB3 SER 21 HB1 SER 21 -2.852 15.285 -13.896 173 HG SER 21 HG SER 21 -4.765 17.343 -13.658 174 H VAL 22 HN VAL 22 -1.106 17.352 -11.529 175 HA VAL 22 HA VAL 22 0.835 15.308 -11.600 176 HB VAL 22 HB VAL 22 0.968 18.143 -10.541 177 HG11 VAL 22 HG11 VAL 22 3.460 17.838 -10.619 178 HG12 VAL 22 HG12 VAL 22 3.167 16.102 -10.744 179 HG13 VAL 22 HG13 VAL 22 2.629 16.987 -9.314 180 HG21 VAL 22 HG21 VAL 22 0.723 18.165 -12.880 181 HG22 VAL 22 HG22 VAL 22 1.842 16.818 -13.091 182 HG23 VAL 22 HG23 VAL 22 2.447 18.397 -12.590 183 H ARG 23 HN ARG 23 -0.754 16.977 -8.931 184 HA ARG 23 HA ARG 23 0.659 15.799 -6.809 185 HB2 ARG 23 HB2 ARG 23 -1.177 17.717 -6.974 186 HB3 ARG 23 HB1 ARG 23 -2.251 16.386 -6.553 187 HG2 ARG 23 HG2 ARG 23 -1.810 16.981 -4.455 188 HG3 ARG 23 HG1 ARG 23 -0.296 16.101 -4.692 189 HD2 ARG 23 HD2 ARG 23 0.819 18.158 -5.341 190 HD3 ARG 23 HD1 ARG 23 -0.699 19.047 -5.195 191 HE ARG 23 HE ARG 23 -0.184 17.811 -2.744 192 HH11 ARG 23 HH11 ARG 23 1.178 20.292 -4.772 193 HH12 ARG 23 HH12 ARG 23 1.858 21.185 -3.453 194 HH21 ARG 23 HH21 ARG 23 0.703 18.973 -0.996 195 HH22 ARG 23 HH22 ARG 23 1.587 20.431 -1.298 196 H ALA 24 HN ALA 24 -2.385 14.918 -8.392 197 HA ALA 24 HA ALA 24 -2.954 12.664 -6.813 198 HB1 ALA 24 HB1 ALA 24 -4.795 12.490 -8.075 199 HB2 ALA 24 HB2 ALA 24 -3.879 12.486 -9.582 200 HB3 ALA 24 HB3 ALA 24 -4.263 14.014 -8.788 201 H LEU 25 HN LEU 25 -1.243 13.018 -9.885 202 HA LEU 25 HA LEU 25 -0.809 10.298 -10.434 203 HB2 LEU 25 HB2 LEU 25 -0.509 12.033 -12.110 204 HB3 LEU 25 HB1 LEU 25 0.812 12.729 -11.195 205 HG LEU 25 HG LEU 25 2.152 10.703 -11.600 206 HD11 LEU 25 HD11 LEU 25 1.241 9.222 -13.509 207 HD12 LEU 25 HD12 LEU 25 -0.339 9.835 -13.019 208 HD13 LEU 25 HD13 LEU 25 0.658 8.945 -11.867 209 HD21 LEU 25 HD21 LEU 25 1.036 11.989 -14.088 210 HD22 LEU 25 HD22 LEU 25 2.553 11.095 -13.983 211 HD23 LEU 25 HD23 LEU 25 2.358 12.607 -13.098 212 H LYS 26 HN LYS 26 1.296 12.636 -8.736 213 HA LYS 26 HA LYS 26 3.380 10.794 -8.252 214 HB2 LYS 26 HB2 LYS 26 2.579 13.322 -6.814 215 HB3 LYS 26 HB1 LYS 26 4.004 12.390 -6.381 216 HG2 LYS 26 HG2 LYS 26 4.904 12.726 -8.633 217 HG3 LYS 26 HG1 LYS 26 3.476 13.675 -9.054 218 HD2 LYS 26 HD2 LYS 26 4.036 15.292 -7.305 219 HD3 LYS 26 HD1 LYS 26 5.460 14.343 -6.877 220 HE2 LYS 26 HE2 LYS 26 4.952 15.623 -9.561 221 HE3 LYS 26 HE1 LYS 26 6.007 16.272 -8.306 222 HZ1 LYS 26 HZ1 LYS 26 7.555 15.144 -9.462 223 HZ2 LYS 26 HZ2 LYS 26 6.446 14.062 -10.139 224 HZ3 LYS 26 HZ3 LYS 26 7.002 13.823 -8.560 225 H THR 27 HN THR 27 0.503 11.655 -6.382 226 HA THR 27 HA THR 27 1.131 10.168 -4.059 227 HB THR 27 HB THR 27 -1.558 11.014 -5.156 228 HG1 THR 27 HG1 THR 27 -0.432 12.855 -4.758 229 HG21 THR 27 HG21 THR 27 -1.846 11.011 -2.479 230 HG22 THR 27 HG22 THR 27 -0.732 9.655 -2.671 231 HG23 THR 27 HG23 THR 27 -2.284 9.647 -3.506 232 H LEU 28 HN LEU 28 -0.804 9.380 -6.949 233 HA LEU 28 HA LEU 28 -1.594 6.813 -6.016 234 HB2 LEU 28 HB2 LEU 28 -1.959 8.424 -8.385 235 HB3 LEU 28 HB1 LEU 28 -1.623 6.762 -8.824 236 HG LEU 28 HG LEU 28 -3.979 6.985 -8.736 237 HD11 LEU 28 HD11 LEU 28 -3.851 5.795 -6.088 238 HD12 LEU 28 HD12 LEU 28 -2.634 5.157 -7.192 239 HD13 LEU 28 HD13 LEU 28 -4.342 5.093 -7.628 240 HD21 LEU 28 HD21 LEU 28 -4.830 8.669 -7.562 241 HD22 LEU 28 HD22 LEU 28 -3.402 8.769 -6.532 242 HD23 LEU 28 HD23 LEU 28 -4.695 7.636 -6.140 243 H ALA 29 HN ALA 29 0.915 7.825 -8.373 244 HA ALA 29 HA ALA 29 1.770 5.238 -9.024 245 HB1 ALA 29 HB1 ALA 29 2.811 7.971 -9.394 246 HB2 ALA 29 HB2 ALA 29 2.542 6.682 -10.569 247 HB3 ALA 29 HB3 ALA 29 3.973 6.651 -9.538 248 H ASN 30 HN ASN 30 3.005 7.478 -6.525 249 HA ASN 30 HA ASN 30 5.226 5.813 -5.840 250 HB2 ASN 30 HB2 ASN 30 4.987 8.284 -5.285 251 HB3 ASN 30 HB1 ASN 30 3.867 7.806 -4.014 252 HD21 ASN 30 HD21 ASN 30 5.014 8.328 -2.246 253 HD22 ASN 30 HD22 ASN 30 6.552 7.653 -1.842 254 H ILE 31 HN ILE 31 1.964 6.101 -4.522 255 HA ILE 31 HA ILE 31 2.382 4.291 -2.430 256 HB ILE 31 HB ILE 31 -0.111 5.253 -3.775 257 HG12 ILE 31 HG12 ILE 31 0.960 5.603 -0.974 258 HG13 ILE 31 HG11 ILE 31 1.268 6.722 -2.297 259 HG21 ILE 31 HG21 ILE 31 -1.513 3.996 -2.466 260 HG22 ILE 31 HG22 ILE 31 -0.264 3.645 -1.269 261 HG23 ILE 31 HG23 ILE 31 -0.244 2.827 -2.830 262 HD11 ILE 31 HD11 ILE 31 -0.536 7.400 -0.739 263 HD12 ILE 31 HD12 ILE 31 -1.469 6.019 -1.310 264 HD13 ILE 31 HD13 ILE 31 -1.021 7.304 -2.431 265 H LEU 32 HN LEU 32 1.136 3.829 -5.720 266 HA LEU 32 HA LEU 32 0.717 1.042 -5.408 267 HB2 LEU 32 HB2 LEU 32 0.865 2.816 -7.821 268 HB3 LEU 32 HB1 LEU 32 0.599 1.084 -7.945 269 HG LEU 32 HG LEU 32 -1.188 2.918 -6.332 270 HD11 LEU 32 HD11 LEU 32 -1.212 3.507 -8.741 271 HD12 LEU 32 HD12 LEU 32 -2.745 2.848 -8.173 272 HD13 LEU 32 HD13 LEU 32 -1.648 1.839 -9.115 273 HD21 LEU 32 HD21 LEU 32 -2.045 1.021 -5.591 274 HD22 LEU 32 HD22 LEU 32 -0.935 0.085 -6.589 275 HD23 LEU 32 HD23 LEU 32 -2.488 0.599 -7.244 276 H GLU 33 HN GLU 33 3.569 2.886 -6.264 277 HA GLU 33 HA GLU 33 4.923 0.503 -7.270 278 HB2 GLU 33 HB2 GLU 33 5.982 3.304 -6.856 279 HB3 GLU 33 HB1 GLU 33 6.870 1.984 -7.603 280 HG2 GLU 33 HG2 GLU 33 5.129 1.888 -9.369 281 HG3 GLU 33 HG1 GLU 33 4.378 3.309 -8.635 282 H LYS 34 HN LYS 34 4.270 1.646 -4.237 283 HA LYS 34 HA LYS 34 6.649 0.273 -3.188 284 HB2 LYS 34 HB2 LYS 34 6.942 2.697 -2.913 285 HB3 LYS 34 HB1 LYS 34 5.412 2.790 -2.052 286 HG2 LYS 34 HG2 LYS 34 7.205 2.852 -0.467 287 HG3 LYS 34 HG1 LYS 34 6.358 1.312 -0.303 288 HD2 LYS 34 HD2 LYS 34 8.090 0.191 -1.579 289 HD3 LYS 34 HD1 LYS 34 8.915 1.728 -1.852 290 HE2 LYS 34 HE2 LYS 34 9.270 1.961 0.557 291 HE3 LYS 34 HE1 LYS 34 8.445 0.427 0.827 292 HZ1 LYS 34 HZ1 LYS 34 10.832 0.138 0.854 293 HZ2 LYS 34 HZ2 LYS 34 10.968 0.799 -0.696 294 HZ3 LYS 34 HZ3 LYS 34 10.170 -0.675 -0.473 295 H GLU 35 HN GLU 35 3.576 1.650 -2.040 296 HA GLU 35 HA GLU 35 3.235 -0.186 0.073 297 HB2 GLU 35 HB2 GLU 35 1.331 1.678 -1.354 298 HB3 GLU 35 HB1 GLU 35 0.849 0.698 0.031 299 HG2 GLU 35 HG2 GLU 35 3.025 2.783 0.011 300 HG3 GLU 35 HG1 GLU 35 1.412 2.972 0.694 301 H PHE 36 HN PHE 36 1.937 -0.148 -3.238 302 HA PHE 36 HA PHE 36 0.975 -2.895 -2.761 303 HB2 PHE 36 HB2 PHE 36 -0.320 -0.777 -4.485 304 HB3 PHE 36 HB1 PHE 36 -0.847 -2.453 -4.383 305 HD1 PHE 36 HD1 PHE 36 -0.887 0.799 -2.812 306 HD2 PHE 36 HD2 PHE 36 -1.784 -3.323 -2.263 307 HE1 PHE 36 HE1 PHE 36 -2.284 1.366 -0.870 308 HE2 PHE 36 HE2 PHE 36 -3.186 -2.763 -0.320 309 HZ PHE 36 HZ PHE 36 -3.435 -0.415 0.378 310 H LYS 37 HN LYS 37 3.565 -2.049 -3.838 311 HA LYS 37 HA LYS 37 3.643 -2.246 -6.637 312 HB2 LYS 37 HB2 LYS 37 5.538 -1.434 -5.296 313 HB3 LYS 37 HB1 LYS 37 5.771 -3.052 -4.648 314 HG2 LYS 37 HG2 LYS 37 6.422 -3.898 -6.778 315 HG3 LYS 37 HG1 LYS 37 5.952 -2.399 -7.580 316 HD2 LYS 37 HD2 LYS 37 8.343 -2.433 -7.368 317 HD3 LYS 37 HD1 LYS 37 7.700 -1.216 -6.260 318 HE2 LYS 37 HE2 LYS 37 9.417 -2.472 -5.140 319 HE3 LYS 37 HE1 LYS 37 7.854 -2.866 -4.427 320 HZ1 LYS 37 HZ1 LYS 37 8.886 -4.558 -6.591 321 HZ2 LYS 37 HZ2 LYS 37 7.884 -4.967 -5.291 322 HZ3 LYS 37 HZ3 LYS 37 9.540 -4.735 -5.041 323 H GLY 38 HN GLY 38 3.406 -3.882 -7.993 324 HA2 GLY 38 HA2 GLY 38 3.651 -6.077 -8.780 325 HA3 GLY 38 HA1 GLY 38 3.980 -6.605 -7.137 326 H VAL 39 HN VAL 39 1.362 -4.783 -6.671 327 HA VAL 39 HA VAL 39 -0.403 -7.087 -7.093 328 HB VAL 39 HB VAL 39 -0.817 -4.806 -5.142 329 HG11 VAL 39 HG11 VAL 39 -2.663 -5.968 -4.290 330 HG12 VAL 39 HG12 VAL 39 -2.214 -7.464 -5.111 331 HG13 VAL 39 HG13 VAL 39 -2.836 -6.100 -6.041 332 HG21 VAL 39 HG21 VAL 39 0.005 -7.624 -4.474 333 HG22 VAL 39 HG22 VAL 39 -0.071 -6.229 -3.397 334 HG23 VAL 39 HG23 VAL 39 1.156 -6.301 -4.662 335 H TYR 40 HN TYR 40 -0.263 -3.542 -7.461 336 HA TYR 40 HA TYR 40 -2.604 -3.845 -9.196 337 HB2 TYR 40 HB2 TYR 40 -1.791 -1.582 -7.405 338 HB3 TYR 40 HB1 TYR 40 -2.761 -1.235 -8.823 339 HD1 TYR 40 HD1 TYR 40 -2.723 -3.088 -5.611 340 HD2 TYR 40 HD2 TYR 40 -5.061 -1.580 -8.826 341 HE1 TYR 40 HE1 TYR 40 -4.772 -3.499 -4.313 342 HE2 TYR 40 HE2 TYR 40 -7.110 -1.994 -7.542 343 HH TYR 40 HH TYR 40 -7.918 -3.240 -5.731 344 H ALA 41 HN ALA 41 -2.657 -2.893 -11.191 345 HA ALA 41 HA ALA 41 -0.096 -1.842 -12.192 346 HB1 ALA 41 HB1 ALA 41 -2.401 -2.784 -13.886 347 HB2 ALA 41 HB2 ALA 41 -1.196 -3.902 -13.243 348 HB3 ALA 41 HB3 ALA 41 -0.705 -2.609 -14.339 349 H LEU 42 HN LEU 42 0.000 0.307 -12.661 350 HA LEU 42 HA LEU 42 -2.499 1.807 -12.539 351 HB2 LEU 42 HB2 LEU 42 -0.698 2.526 -11.064 352 HB3 LEU 42 HB1 LEU 42 0.367 2.749 -12.438 353 HG LEU 42 HG LEU 42 -1.094 4.568 -13.259 354 HD11 LEU 42 HD11 LEU 42 -2.672 5.467 -11.375 355 HD12 LEU 42 HD12 LEU 42 -2.691 3.779 -10.866 356 HD13 LEU 42 HD13 LEU 42 -3.230 4.216 -12.487 357 HD21 LEU 42 HD21 LEU 42 0.865 4.952 -11.742 358 HD22 LEU 42 HD22 LEU 42 -0.275 5.034 -10.399 359 HD23 LEU 42 HD23 LEU 42 -0.365 6.214 -11.707 360 H LYS 43 HN LYS 43 -3.425 2.737 -14.187 361 HA LYS 43 HA LYS 43 -1.943 3.123 -16.695 362 HB2 LYS 43 HB2 LYS 43 -4.299 1.497 -16.192 363 HB3 LYS 43 HB1 LYS 43 -4.642 2.762 -17.360 364 HG2 LYS 43 HG2 LYS 43 -3.944 1.151 -18.777 365 HG3 LYS 43 HG1 LYS 43 -2.380 1.887 -18.418 366 HD2 LYS 43 HD2 LYS 43 -1.792 0.160 -16.937 367 HD3 LYS 43 HD1 LYS 43 -3.457 -0.415 -16.818 368 HE2 LYS 43 HE2 LYS 43 -2.304 -1.957 -18.202 369 HE3 LYS 43 HE1 LYS 43 -3.325 -0.983 -19.261 370 HZ1 LYS 43 HZ1 LYS 43 -1.557 -0.089 -20.280 371 HZ2 LYS 43 HZ2 LYS 43 -0.730 -1.442 -19.692 372 HZ3 LYS 43 HZ3 LYS 43 -0.642 0.030 -18.863 373 H VAL 44 HN VAL 44 -1.775 5.209 -16.988 374 HA VAL 44 HA VAL 44 -3.884 7.020 -16.015 375 HB VAL 44 HB VAL 44 -1.040 7.544 -16.876 376 HG11 VAL 44 HG11 VAL 44 -2.214 9.520 -17.415 377 HG12 VAL 44 HG12 VAL 44 -1.510 9.825 -15.827 378 HG13 VAL 44 HG13 VAL 44 -3.219 9.410 -15.968 379 HG21 VAL 44 HG21 VAL 44 -1.973 8.121 -14.135 380 HG22 VAL 44 HG22 VAL 44 -0.417 7.514 -14.703 381 HG23 VAL 44 HG23 VAL 44 -1.798 6.423 -14.574 382 H ILE 45 HN ILE 45 -5.174 8.063 -17.265 383 HA ILE 45 HA ILE 45 -4.815 7.862 -20.182 384 HB ILE 45 HB ILE 45 -7.341 8.256 -18.577 385 HG12 ILE 45 HG12 ILE 45 -6.418 6.062 -18.108 386 HG13 ILE 45 HG11 ILE 45 -7.870 5.905 -19.086 387 HG21 ILE 45 HG21 ILE 45 -7.075 7.471 -21.477 388 HG22 ILE 45 HG22 ILE 45 -7.395 9.111 -20.916 389 HG23 ILE 45 HG23 ILE 45 -8.567 7.826 -20.599 390 HD11 ILE 45 HD11 ILE 45 -5.046 5.720 -20.100 391 HD12 ILE 45 HD12 ILE 45 -6.514 5.504 -21.054 392 HD13 ILE 45 HD13 ILE 45 -6.119 4.359 -19.770 393 H ASP 46 HN ASP 46 -4.185 9.816 -21.034 394 HA ASP 46 HA ASP 46 -4.739 12.258 -19.582 395 HB2 ASP 46 HB2 ASP 46 -2.562 11.789 -20.796 396 HB3 ASP 46 HB1 ASP 46 -3.448 12.026 -22.300 397 H VAL 47 HN VAL 47 -6.792 12.933 -19.731 398 HA VAL 47 HA VAL 47 -8.496 12.382 -21.920 399 HB VAL 47 HB VAL 47 -10.149 13.760 -20.817 400 HG11 VAL 47 HG11 VAL 47 -8.712 11.603 -19.574 401 HG12 VAL 47 HG12 VAL 47 -10.439 11.963 -19.536 402 HG13 VAL 47 HG13 VAL 47 -9.362 12.687 -18.343 403 HG21 VAL 47 HG21 VAL 47 -8.651 15.617 -20.171 404 HG22 VAL 47 HG22 VAL 47 -7.966 14.594 -18.906 405 HG23 VAL 47 HG23 VAL 47 -9.666 15.062 -18.840 406 H LEU 48 HN LEU 48 -6.220 14.959 -21.528 407 HA LEU 48 HA LEU 48 -7.669 16.671 -23.384 408 HB2 LEU 48 HB2 LEU 48 -5.041 17.110 -21.978 409 HB3 LEU 48 HB1 LEU 48 -5.786 18.261 -23.070 410 HG LEU 48 HG LEU 48 -6.945 17.320 -20.444 411 HD11 LEU 48 HD11 LEU 48 -6.571 19.706 -19.803 412 HD12 LEU 48 HD12 LEU 48 -5.624 19.893 -21.280 413 HD13 LEU 48 HD13 LEU 48 -5.096 18.765 -20.030 414 HD21 LEU 48 HD21 LEU 48 -7.999 19.066 -22.632 415 HD22 LEU 48 HD22 LEU 48 -8.468 19.361 -20.957 416 HD23 LEU 48 HD23 LEU 48 -8.820 17.805 -21.709 417 H LYS 49 HN LYS 49 -4.697 14.724 -23.331 418 HA LYS 49 HA LYS 49 -3.868 15.554 -25.934 419 HB2 LYS 49 HB2 LYS 49 -3.095 13.159 -24.271 420 HB3 LYS 49 HB1 LYS 49 -2.415 13.482 -25.859 421 HG2 LYS 49 HG2 LYS 49 -1.694 15.726 -24.962 422 HG3 LYS 49 HG1 LYS 49 -2.142 15.132 -23.363 423 HD2 LYS 49 HD2 LYS 49 -0.187 13.751 -25.195 424 HD3 LYS 49 HD1 LYS 49 0.282 14.883 -23.927 425 HE2 LYS 49 HE2 LYS 49 -0.797 13.418 -22.262 426 HE3 LYS 49 HE1 LYS 49 -1.186 12.275 -23.546 427 HZ1 LYS 49 HZ1 LYS 49 1.492 12.695 -23.821 428 HZ2 LYS 49 HZ2 LYS 49 0.770 11.353 -23.089 429 HZ3 LYS 49 HZ3 LYS 49 1.276 12.661 -22.143 430 H ASN 50 HN ASN 50 -5.827 12.920 -24.695 431 HA ASN 50 HA ASN 50 -6.702 12.391 -27.455 432 HB2 ASN 50 HB2 ASN 50 -5.120 10.596 -26.428 433 HB3 ASN 50 HB1 ASN 50 -6.512 10.183 -25.427 434 HD21 ASN 50 HD21 ASN 50 -4.934 9.168 -27.997 435 HD22 ASN 50 HD22 ASN 50 -6.223 8.527 -28.951 436 HA PRO 51 HA PRO 51 -10.211 13.432 -24.644 437 HB2 PRO 51 HB2 PRO 51 -11.565 14.816 -26.601 438 HB3 PRO 51 HB1 PRO 51 -10.427 15.550 -25.467 439 HG2 PRO 51 HG2 PRO 51 -9.983 14.674 -28.292 440 HG3 PRO 51 HG1 PRO 51 -9.395 16.126 -27.461 441 HD2 PRO 51 HD2 PRO 51 -7.826 13.995 -27.897 442 HD3 PRO 51 HD1 PRO 51 -7.675 14.993 -26.434 443 H GLN 52 HN GLN 52 -9.892 11.923 -27.749 444 HA GLN 52 HA GLN 52 -12.543 11.023 -28.122 445 HB2 GLN 52 HB2 GLN 52 -9.891 9.850 -28.987 446 HB3 GLN 52 HB1 GLN 52 -11.446 9.200 -29.490 447 HG2 GLN 52 HG2 GLN 52 -11.074 10.530 -31.271 448 HG3 GLN 52 HG1 GLN 52 -11.805 11.742 -30.221 449 HE21 GLN 52 HE21 GLN 52 -10.007 12.199 -32.396 450 HE22 GLN 52 HE22 GLN 52 -8.599 12.957 -31.745 451 H LEU 53 HN LEU 53 -9.787 9.691 -26.375 452 HA LEU 53 HA LEU 53 -11.142 7.285 -25.675 453 HB2 LEU 53 HB2 LEU 53 -8.671 8.584 -24.531 454 HB3 LEU 53 HB1 LEU 53 -9.278 7.027 -23.995 455 HG LEU 53 HG LEU 53 -8.447 7.651 -26.825 456 HD11 LEU 53 HD11 LEU 53 -6.932 5.904 -24.915 457 HD12 LEU 53 HD12 LEU 53 -6.634 7.641 -24.994 458 HD13 LEU 53 HD13 LEU 53 -6.387 6.638 -26.424 459 HD21 LEU 53 HD21 LEU 53 -9.682 5.327 -25.501 460 HD22 LEU 53 HD22 LEU 53 -8.348 4.973 -26.598 461 HD23 LEU 53 HD23 LEU 53 -9.758 5.859 -27.182 462 H ALA 54 HN ALA 54 -10.727 10.455 -24.234 463 HA ALA 54 HA ALA 54 -11.766 9.888 -21.669 464 HB1 ALA 54 HB1 ALA 54 -10.489 11.944 -22.326 465 HB2 ALA 54 HB2 ALA 54 -11.955 12.242 -21.390 466 HB3 ALA 54 HB3 ALA 54 -11.951 12.511 -23.134 467 H GLU 55 HN GLU 55 -13.201 10.952 -24.711 468 HA GLU 55 HA GLU 55 -15.861 11.215 -23.739 469 HB2 GLU 55 HB2 GLU 55 -15.094 12.282 -25.836 470 HB3 GLU 55 HB1 GLU 55 -14.932 10.693 -26.571 471 HG2 GLU 55 HG2 GLU 55 -17.331 10.313 -26.300 472 HG3 GLU 55 HG1 GLU 55 -17.498 11.897 -25.548 473 H GLU 56 HN GLU 56 -14.029 8.554 -25.152 474 HA GLU 56 HA GLU 56 -16.162 6.774 -25.547 475 HB2 GLU 56 HB2 GLU 56 -13.258 6.229 -24.870 476 HB3 GLU 56 HB1 GLU 56 -14.401 4.982 -25.344 477 HG2 GLU 56 HG2 GLU 56 -14.714 6.183 -27.506 478 HG3 GLU 56 HG1 GLU 56 -13.427 7.299 -27.019 479 H ASP 57 HN ASP 57 -14.145 7.416 -22.694 480 HA ASP 57 HA ASP 57 -15.879 5.635 -21.152 481 HB2 ASP 57 HB2 ASP 57 -13.230 6.968 -20.484 482 HB3 ASP 57 HB1 ASP 57 -14.199 6.137 -19.269 483 H LYS 58 HN LYS 58 -16.229 8.563 -22.183 484 HA LYS 58 HA LYS 58 -17.270 10.468 -21.547 485 HB2 LYS 58 HB2 LYS 58 -18.746 8.423 -19.906 486 HB3 LYS 58 HB1 LYS 58 -19.270 10.096 -20.058 487 HG2 LYS 58 HG2 LYS 58 -18.815 8.312 -22.439 488 HG3 LYS 58 HG1 LYS 58 -20.372 8.437 -21.613 489 HD2 LYS 58 HD2 LYS 58 -20.350 10.877 -22.043 490 HD3 LYS 58 HD1 LYS 58 -18.844 10.676 -22.942 491 HE2 LYS 58 HE2 LYS 58 -21.462 9.340 -23.616 492 HE3 LYS 58 HE1 LYS 58 -20.825 10.781 -24.409 493 HZ1 LYS 58 HZ1 LYS 58 -18.778 8.981 -24.553 494 HZ2 LYS 58 HZ2 LYS 58 -19.850 9.371 -25.807 495 HZ3 LYS 58 HZ3 LYS 58 -20.155 8.030 -24.823 496 H ILE 59 HN ILE 59 -14.947 10.603 -20.419 497 HA ILE 59 HA ILE 59 -15.173 11.012 -17.551 498 HB ILE 59 HB ILE 59 -12.848 11.529 -19.414 499 HG12 ILE 59 HG12 ILE 59 -13.491 9.174 -19.408 500 HG13 ILE 59 HG11 ILE 59 -11.959 9.396 -18.567 501 HG21 ILE 59 HG21 ILE 59 -13.198 11.747 -16.467 502 HG22 ILE 59 HG22 ILE 59 -12.256 12.749 -17.571 503 HG23 ILE 59 HG23 ILE 59 -11.655 11.163 -17.086 504 HD11 ILE 59 HD11 ILE 59 -12.973 8.012 -17.099 505 HD12 ILE 59 HD12 ILE 59 -14.595 8.560 -17.527 506 HD13 ILE 59 HD13 ILE 59 -13.578 9.546 -16.475 507 H LEU 60 HN LEU 60 -16.196 12.808 -16.923 508 HA LEU 60 HA LEU 60 -15.694 15.307 -18.391 509 HB2 LEU 60 HB2 LEU 60 -17.976 14.598 -16.546 510 HB3 LEU 60 HB1 LEU 60 -17.777 16.131 -17.371 511 HG LEU 60 HG LEU 60 -18.203 13.466 -18.730 512 HD11 LEU 60 HD11 LEU 60 -20.196 14.201 -17.554 513 HD12 LEU 60 HD12 LEU 60 -20.412 14.364 -19.296 514 HD13 LEU 60 HD13 LEU 60 -20.079 15.790 -18.312 515 HD21 LEU 60 HD21 LEU 60 -17.776 16.252 -19.753 516 HD22 LEU 60 HD22 LEU 60 -18.676 15.061 -20.692 517 HD23 LEU 60 HD23 LEU 60 -16.995 14.752 -20.254 518 H ALA 61 HN ALA 61 -14.480 13.788 -15.817 519 HA ALA 61 HA ALA 61 -13.908 16.309 -14.447 520 HB1 ALA 61 HB1 ALA 61 -14.674 15.697 -12.401 521 HB2 ALA 61 HB2 ALA 61 -14.346 13.985 -12.667 522 HB3 ALA 61 HB3 ALA 61 -15.781 14.729 -13.374 523 H THR 62 HN THR 62 -11.940 16.370 -13.359 524 HA THR 62 HA THR 62 -10.197 14.053 -13.367 525 HB THR 62 HB THR 62 -8.325 15.442 -14.365 526 HG1 THR 62 HG1 THR 62 -9.767 17.424 -14.163 527 HG21 THR 62 HG21 THR 62 -9.478 13.661 -15.647 528 HG22 THR 62 HG22 THR 62 -8.887 14.975 -16.668 529 HG23 THR 62 HG23 THR 62 -10.603 14.874 -16.263 530 HA PRO 63 HA PRO 63 -8.238 13.567 -12.764 531 HB2 PRO 63 HB2 PRO 63 -7.422 12.779 -10.085 532 HB3 PRO 63 HB1 PRO 63 -6.408 13.144 -11.484 533 HG2 PRO 63 HG2 PRO 63 -6.497 14.735 -9.286 534 HG3 PRO 63 HG1 PRO 63 -6.197 15.364 -10.916 535 HD2 PRO 63 HD2 PRO 63 -8.759 15.333 -9.347 536 HD3 PRO 63 HD1 PRO 63 -8.041 16.654 -10.299 537 H THR 64 HN THR 64 -9.003 11.453 -12.749 538 HA THR 64 HA THR 64 -11.070 10.810 -10.760 539 HB THR 64 HB THR 64 -11.291 10.223 -13.721 540 HG1 THR 64 HG1 THR 64 -12.150 12.182 -13.633 541 HG21 THR 64 HG21 THR 64 -13.470 9.264 -13.200 542 HG22 THR 64 HG22 THR 64 -13.201 9.559 -11.483 543 HG23 THR 64 HG23 THR 64 -12.193 8.399 -12.345 544 H LEU 65 HN LEU 65 -10.817 8.896 -9.833 545 HA LEU 65 HA LEU 65 -8.770 7.047 -10.904 546 HB2 LEU 65 HB2 LEU 65 -8.325 7.971 -8.673 547 HB3 LEU 65 HB1 LEU 65 -9.873 7.371 -8.112 548 HG LEU 65 HG LEU 65 -9.098 5.054 -8.503 549 HD11 LEU 65 HD11 LEU 65 -7.501 5.226 -10.211 550 HD12 LEU 65 HD12 LEU 65 -6.573 4.804 -8.773 551 HD13 LEU 65 HD13 LEU 65 -6.590 6.468 -9.354 552 HD21 LEU 65 HD21 LEU 65 -7.674 4.921 -6.586 553 HD22 LEU 65 HD22 LEU 65 -8.843 6.213 -6.309 554 HD23 LEU 65 HD23 LEU 65 -7.186 6.606 -6.767 555 H ALA 66 HN ALA 66 -9.587 5.284 -11.889 556 HA ALA 66 HA ALA 66 -11.996 4.064 -10.721 557 HB1 ALA 66 HB1 ALA 66 -12.375 5.528 -12.896 558 HB2 ALA 66 HB2 ALA 66 -13.198 3.982 -12.678 559 HB3 ALA 66 HB3 ALA 66 -11.761 4.078 -13.696 560 H LYS 67 HN LYS 67 -11.931 1.972 -10.523 561 HA LYS 67 HA LYS 67 -9.559 0.591 -11.508 562 HB2 LYS 67 HB2 LYS 67 -10.271 0.455 -9.080 563 HB3 LYS 67 HB1 LYS 67 -11.693 -0.423 -9.610 564 HG2 LYS 67 HG2 LYS 67 -10.263 -2.209 -10.487 565 HG3 LYS 67 HG1 LYS 67 -8.835 -1.325 -9.943 566 HD2 LYS 67 HD2 LYS 67 -9.064 -2.565 -8.083 567 HD3 LYS 67 HD1 LYS 67 -10.298 -1.380 -7.665 568 HE2 LYS 67 HE2 LYS 67 -10.577 -4.193 -8.548 569 HE3 LYS 67 HE1 LYS 67 -11.495 -3.289 -7.352 570 HZ1 LYS 67 HZ1 LYS 67 -13.059 -2.887 -8.847 571 HZ2 LYS 67 HZ2 LYS 67 -12.252 -3.888 -9.947 572 HZ3 LYS 67 HZ3 LYS 67 -11.947 -2.223 -9.933 573 H VAL 68 HN VAL 68 -9.902 -0.096 -13.556 574 HA VAL 68 HA VAL 68 -12.532 -0.878 -14.417 575 HB VAL 68 HB VAL 68 -11.477 -1.311 -16.600 576 HG11 VAL 68 HG11 VAL 68 -12.219 0.987 -15.721 577 HG12 VAL 68 HG12 VAL 68 -11.218 0.930 -17.170 578 HG13 VAL 68 HG13 VAL 68 -10.495 1.340 -15.614 579 HG21 VAL 68 HG21 VAL 68 -9.261 -1.438 -16.956 580 HG22 VAL 68 HG22 VAL 68 -9.172 -1.732 -15.219 581 HG23 VAL 68 HG23 VAL 68 -8.911 -0.107 -15.852 582 H LEU 69 HN LEU 69 -9.648 -2.465 -13.285 583 HA LEU 69 HA LEU 69 -11.083 -5.029 -13.608 584 HB2 LEU 69 HB2 LEU 69 -8.182 -4.587 -14.319 585 HB3 LEU 69 HB1 LEU 69 -8.951 -6.156 -14.212 586 HG LEU 69 HG LEU 69 -9.778 -3.998 -16.158 587 HD11 LEU 69 HD11 LEU 69 -7.675 -6.055 -16.268 588 HD12 LEU 69 HD12 LEU 69 -7.833 -4.539 -17.155 589 HD13 LEU 69 HD13 LEU 69 -8.730 -5.964 -17.677 590 HD21 LEU 69 HD21 LEU 69 -11.613 -5.427 -15.803 591 HD22 LEU 69 HD22 LEU 69 -10.589 -6.863 -15.750 592 HD23 LEU 69 HD23 LEU 69 -10.843 -6.018 -17.277 593 HA PRO 70 HA PRO 70 -10.972 -7.137 -12.957 594 HB2 PRO 70 HB2 PRO 70 -12.210 -7.896 -10.398 595 HB3 PRO 70 HB1 PRO 70 -11.328 -8.899 -11.553 596 HG2 PRO 70 HG2 PRO 70 -10.272 -8.271 -9.174 597 HG3 PRO 70 HG1 PRO 70 -9.264 -8.373 -10.631 598 HD2 PRO 70 HD2 PRO 70 -10.410 -5.937 -9.296 599 HD3 PRO 70 HD1 PRO 70 -8.755 -6.214 -9.886 600 HA PRO 71 HA PRO 71 -14.771 -4.834 -13.214 601 HB2 PRO 71 HB2 PRO 71 -16.380 -6.666 -14.404 602 HB3 PRO 71 HB1 PRO 71 -15.086 -5.830 -15.271 603 HG2 PRO 71 HG2 PRO 71 -15.076 -8.564 -14.036 604 HG3 PRO 71 HG1 PRO 71 -14.484 -8.059 -15.631 605 HD2 PRO 71 HD2 PRO 71 -12.816 -8.420 -13.550 606 HD3 PRO 71 HD1 PRO 71 -12.540 -7.155 -14.764 607 HA PRO 72 HA PRO 72 -17.161 -4.472 -13.512 608 HB2 PRO 72 HB2 PRO 72 -18.712 -2.906 -11.963 609 HB3 PRO 72 HB1 PRO 72 -19.281 -4.451 -12.607 610 HG2 PRO 72 HG2 PRO 72 -18.191 -3.825 -9.883 611 HG3 PRO 72 HG1 PRO 72 -19.627 -4.772 -10.318 612 HD2 PRO 72 HD2 PRO 72 -17.263 -5.927 -9.678 613 HD3 PRO 72 HD1 PRO 72 -18.384 -6.642 -10.855 614 H VAL 73 HN VAL 73 -16.912 -2.132 -13.735 615 HA VAL 73 HA VAL 73 -14.409 -1.246 -12.725 616 HB VAL 73 HB VAL 73 -16.540 0.295 -14.224 617 HG11 VAL 73 HG11 VAL 73 -13.715 0.974 -13.485 618 HG12 VAL 73 HG12 VAL 73 -15.177 1.943 -13.300 619 HG13 VAL 73 HG13 VAL 73 -14.488 1.685 -14.903 620 HG21 VAL 73 HG21 VAL 73 -15.956 -0.941 -15.977 621 HG22 VAL 73 HG22 VAL 73 -14.695 -1.751 -15.049 622 HG23 VAL 73 HG23 VAL 73 -14.343 -0.235 -15.878 623 H ARG 74 HN ARG 74 -13.952 -0.168 -10.944 624 HA ARG 74 HA ARG 74 -16.147 1.014 -9.375 625 HB2 ARG 74 HB2 ARG 74 -15.028 -0.692 -8.132 626 HB3 ARG 74 HB1 ARG 74 -13.448 -0.081 -8.590 627 HG2 ARG 74 HG2 ARG 74 -13.892 0.452 -6.289 628 HG3 ARG 74 HG1 ARG 74 -13.858 1.936 -7.241 629 HD2 ARG 74 HD2 ARG 74 -15.700 2.021 -5.682 630 HD3 ARG 74 HD1 ARG 74 -16.328 1.897 -7.325 631 HE ARG 74 HE ARG 74 -16.092 -0.674 -6.168 632 HH11 ARG 74 HH11 ARG 74 -18.026 2.218 -6.026 633 HH12 ARG 74 HH12 ARG 74 -19.460 1.394 -5.510 634 HH21 ARG 74 HH21 ARG 74 -17.969 -1.775 -5.489 635 HH22 ARG 74 HH22 ARG 74 -19.426 -0.884 -5.203 636 H ARG 75 HN ARG 75 -16.335 3.131 -9.546 637 HA ARG 75 HA ARG 75 -13.963 4.695 -10.221 638 HB2 ARG 75 HB2 ARG 75 -16.880 5.464 -10.198 639 HB3 ARG 75 HB1 ARG 75 -15.557 6.544 -10.614 640 HG2 ARG 75 HG2 ARG 75 -14.955 5.024 -12.471 641 HG3 ARG 75 HG1 ARG 75 -16.389 4.063 -12.097 642 HD2 ARG 75 HD2 ARG 75 -17.795 6.025 -12.493 643 HD3 ARG 75 HD1 ARG 75 -16.359 6.977 -12.864 644 HE ARG 75 HE ARG 75 -16.243 5.966 -14.933 645 HH11 ARG 75 HH11 ARG 75 -18.625 4.357 -12.961 646 HH12 ARG 75 HH12 ARG 75 -19.285 3.441 -14.274 647 HH21 ARG 75 HH21 ARG 75 -17.104 4.769 -16.669 648 HH22 ARG 75 HH22 ARG 75 -18.416 3.675 -16.388 649 H ILE 76 HN ILE 76 -12.932 5.824 -8.781 650 HA ILE 76 HA ILE 76 -14.192 6.263 -6.151 651 HB ILE 76 HB ILE 76 -11.257 6.107 -6.842 652 HG12 ILE 76 HG12 ILE 76 -13.024 4.165 -5.329 653 HG13 ILE 76 HG11 ILE 76 -12.498 3.955 -6.997 654 HG21 ILE 76 HG21 ILE 76 -12.712 6.581 -4.253 655 HG22 ILE 76 HG22 ILE 76 -11.427 7.543 -4.983 656 HG23 ILE 76 HG23 ILE 76 -11.063 5.958 -4.301 657 HD11 ILE 76 HD11 ILE 76 -10.151 3.994 -6.160 658 HD12 ILE 76 HD12 ILE 76 -11.118 2.611 -5.640 659 HD13 ILE 76 HD13 ILE 76 -10.810 3.945 -4.527 660 H ILE 77 HN ILE 77 -14.812 8.317 -5.806 661 HA ILE 77 HA ILE 77 -13.313 10.478 -7.138 662 HB ILE 77 HB ILE 77 -16.233 10.499 -6.373 663 HG12 ILE 77 HG12 ILE 77 -15.816 9.012 -8.278 664 HG13 ILE 77 HG11 ILE 77 -16.682 10.457 -8.791 665 HG21 ILE 77 HG21 ILE 77 -16.356 12.675 -6.963 666 HG22 ILE 77 HG22 ILE 77 -15.152 12.507 -8.242 667 HG23 ILE 77 HG23 ILE 77 -14.638 12.663 -6.561 668 HD11 ILE 77 HD11 ILE 77 -15.105 10.163 -10.451 669 HD12 ILE 77 HD12 ILE 77 -13.850 9.669 -9.314 670 HD13 ILE 77 HD13 ILE 77 -14.345 11.359 -9.402 671 H GLY 78 HN GLY 78 -12.350 11.918 -5.844 672 HA2 GLY 78 HA2 GLY 78 -13.357 13.095 -3.563 673 HA3 GLY 78 HA1 GLY 78 -12.496 11.666 -3.008 674 H ASP 79 HN ASP 79 -11.199 13.385 -1.897 675 HA ASP 79 HA ASP 79 -9.419 14.937 -3.573 676 HB2 ASP 79 HB2 ASP 79 -10.226 15.811 -1.386 677 HB3 ASP 79 HB1 ASP 79 -9.376 14.504 -0.571 678 H LEU 80 HN LEU 80 -8.063 13.645 -4.707 679 HA LEU 80 HA LEU 80 -6.825 11.351 -3.449 680 HB2 LEU 80 HB2 LEU 80 -6.507 12.485 -6.231 681 HB3 LEU 80 HB1 LEU 80 -5.798 10.982 -5.673 682 HG LEU 80 HG LEU 80 -8.763 11.531 -5.865 683 HD11 LEU 80 HD11 LEU 80 -8.806 10.397 -7.871 684 HD12 LEU 80 HD12 LEU 80 -7.266 9.592 -7.572 685 HD13 LEU 80 HD13 LEU 80 -7.298 11.301 -8.007 686 HD21 LEU 80 HD21 LEU 80 -8.858 9.019 -5.594 687 HD22 LEU 80 HD22 LEU 80 -8.416 9.933 -4.152 688 HD23 LEU 80 HD23 LEU 80 -7.173 9.098 -5.083 689 H SER 81 HN SER 81 -6.088 14.604 -3.532 690 HA SER 81 HA SER 81 -3.275 14.488 -3.939 691 HB2 SER 81 HB2 SER 81 -4.957 16.530 -2.456 692 HB3 SER 81 HB1 SER 81 -3.251 16.735 -2.862 693 HG SER 81 HG SER 81 -3.919 17.436 -4.715 694 H ASN 82 HN ASN 82 -5.352 13.748 -1.313 695 HA ASN 82 HA ASN 82 -3.264 13.767 0.689 696 HB2 ASN 82 HB2 ASN 82 -5.590 14.352 1.291 697 HB3 ASN 82 HB1 ASN 82 -6.095 12.734 0.833 698 HD21 ASN 82 HD21 ASN 82 -6.873 13.154 3.180 699 HD22 ASN 82 HD22 ASN 82 -5.837 12.532 4.414 700 H ARG 83 HN ARG 83 -1.859 12.182 0.853 701 HA ARG 83 HA ARG 83 -1.962 9.858 -0.668 702 HB2 ARG 83 HB2 ARG 83 -0.294 10.537 1.759 703 HB3 ARG 83 HB1 ARG 83 -0.080 9.044 0.855 704 HG2 ARG 83 HG2 ARG 83 0.327 10.452 -1.183 705 HG3 ARG 83 HG1 ARG 83 0.347 11.858 -0.118 706 HD2 ARG 83 HD2 ARG 83 2.156 9.459 0.152 707 HD3 ARG 83 HD1 ARG 83 2.608 10.977 -0.623 708 HE ARG 83 HE ARG 83 2.308 10.484 2.222 709 HH11 ARG 83 HH11 ARG 83 2.678 12.833 -0.326 710 HH12 ARG 83 HH12 ARG 83 3.257 14.079 0.728 711 HH21 ARG 83 HH21 ARG 83 3.069 12.114 3.620 712 HH22 ARG 83 HH22 ARG 83 3.479 13.669 2.977 713 H GLU 84 HN GLU 84 -3.042 10.411 2.645 714 HA GLU 84 HA GLU 84 -3.382 7.719 3.387 715 HB2 GLU 84 HB2 GLU 84 -4.752 10.240 4.271 716 HB3 GLU 84 HB1 GLU 84 -5.154 8.665 4.945 717 HG2 GLU 84 HG2 GLU 84 -2.965 8.374 5.796 718 HG3 GLU 84 HG1 GLU 84 -2.368 9.788 4.928 719 H LYS 85 HN LYS 85 -5.685 9.916 1.720 720 HA LYS 85 HA LYS 85 -7.754 7.974 1.735 721 HB2 LYS 85 HB2 LYS 85 -7.294 10.380 -0.044 722 HB3 LYS 85 HB1 LYS 85 -8.702 9.339 -0.214 723 HG2 LYS 85 HG2 LYS 85 -9.393 9.899 2.057 724 HG3 LYS 85 HG1 LYS 85 -7.981 10.942 2.232 725 HD2 LYS 85 HD2 LYS 85 -8.781 12.269 0.287 726 HD3 LYS 85 HD1 LYS 85 -10.225 11.258 0.238 727 HE2 LYS 85 HE2 LYS 85 -9.373 12.961 2.580 728 HE3 LYS 85 HE1 LYS 85 -10.620 13.388 1.408 729 HZ1 LYS 85 HZ1 LYS 85 -11.962 12.437 2.915 730 HZ2 LYS 85 HZ2 LYS 85 -10.725 11.531 3.630 731 HZ3 LYS 85 HZ3 LYS 85 -11.461 10.984 2.209 732 H VAL 86 HN VAL 86 -5.224 8.691 -0.603 733 HA VAL 86 HA VAL 86 -6.087 6.847 -2.555 734 HB VAL 86 HB VAL 86 -3.317 7.918 -1.960 735 HG11 VAL 86 HG11 VAL 86 -3.061 7.167 -4.472 736 HG12 VAL 86 HG12 VAL 86 -4.278 5.977 -4.006 737 HG13 VAL 86 HG13 VAL 86 -2.738 6.046 -3.149 738 HG21 VAL 86 HG21 VAL 86 -5.655 8.832 -3.481 739 HG22 VAL 86 HG22 VAL 86 -4.128 8.921 -4.358 740 HG23 VAL 86 HG23 VAL 86 -4.306 9.749 -2.811 741 H LEU 87 HN LEU 87 -3.935 6.515 0.235 742 HA LEU 87 HA LEU 87 -3.234 3.789 -0.247 743 HB2 LEU 87 HB2 LEU 87 -2.638 5.829 1.669 744 HB3 LEU 87 HB1 LEU 87 -3.135 4.388 2.534 745 HG LEU 87 HG LEU 87 -0.942 4.417 0.468 746 HD11 LEU 87 HD11 LEU 87 -0.924 5.542 3.054 747 HD12 LEU 87 HD12 LEU 87 0.448 5.260 1.980 748 HD13 LEU 87 HD13 LEU 87 -0.024 4.026 3.148 749 HD21 LEU 87 HD21 LEU 87 -0.994 2.379 2.571 750 HD22 LEU 87 HD22 LEU 87 -0.724 2.211 0.837 751 HD23 LEU 87 HD23 LEU 87 -2.369 2.304 1.468 752 H ILE 88 HN ILE 88 -5.611 5.300 1.925 753 HA ILE 88 HA ILE 88 -6.545 2.903 3.049 754 HB ILE 88 HB ILE 88 -7.821 5.610 2.756 755 HG12 ILE 88 HG12 ILE 88 -6.830 4.166 5.217 756 HG13 ILE 88 HG11 ILE 88 -5.788 5.182 4.229 757 HG21 ILE 88 HG21 ILE 88 -9.424 4.751 4.541 758 HG22 ILE 88 HG22 ILE 88 -8.925 3.131 4.053 759 HG23 ILE 88 HG23 ILE 88 -9.705 4.202 2.887 760 HD11 ILE 88 HD11 ILE 88 -7.701 5.911 6.257 761 HD12 ILE 88 HD12 ILE 88 -7.984 6.774 4.745 762 HD13 ILE 88 HD13 ILE 88 -6.402 6.859 5.528 763 H ALA 89 HN ALA 89 -7.780 4.764 0.256 764 HA ALA 89 HA ALA 89 -9.936 3.018 -0.298 765 HB1 ALA 89 HB1 ALA 89 -8.800 4.335 -2.645 766 HB2 ALA 89 HB2 ALA 89 -9.099 5.430 -1.295 767 HB3 ALA 89 HB3 ALA 89 -10.415 4.455 -1.949 768 H LEU 90 HN LEU 90 -6.584 3.047 -1.443 769 HA LEU 90 HA LEU 90 -6.921 0.912 -3.294 770 HB2 LEU 90 HB2 LEU 90 -4.687 2.470 -2.208 771 HB3 LEU 90 HB1 LEU 90 -4.268 0.806 -2.555 772 HG LEU 90 HG LEU 90 -4.583 1.060 -4.841 773 HD11 LEU 90 HD11 LEU 90 -5.673 3.640 -5.235 774 HD12 LEU 90 HD12 LEU 90 -6.713 2.792 -4.091 775 HD13 LEU 90 HD13 LEU 90 -6.369 2.077 -5.670 776 HD21 LEU 90 HD21 LEU 90 -3.707 3.816 -4.012 777 HD22 LEU 90 HD22 LEU 90 -3.252 2.928 -5.466 778 HD23 LEU 90 HD23 LEU 90 -2.682 2.385 -3.886 779 H ARG 91 HN ARG 91 -6.091 1.068 0.136 780 HA ARG 91 HA ARG 91 -5.290 -1.637 0.453 781 HB2 ARG 91 HB2 ARG 91 -4.767 0.141 2.078 782 HB3 ARG 91 HB1 ARG 91 -6.474 0.286 2.464 783 HG2 ARG 91 HG2 ARG 91 -6.511 -1.910 3.416 784 HG3 ARG 91 HG1 ARG 91 -4.862 -2.225 2.868 785 HD2 ARG 91 HD2 ARG 91 -5.631 -0.050 4.810 786 HD3 ARG 91 HD1 ARG 91 -5.036 -1.641 5.282 787 HE ARG 91 HE ARG 91 -3.185 -0.569 3.512 788 HH11 ARG 91 HH11 ARG 91 -4.475 0.156 6.664 789 HH12 ARG 91 HH12 ARG 91 -3.027 0.923 7.226 790 HH21 ARG 91 HH21 ARG 91 -1.270 0.433 4.237 791 HH22 ARG 91 HH22 ARG 91 -1.200 1.082 5.842 792 H LEU 92 HN LEU 92 -8.410 0.012 0.971 793 HA LEU 92 HA LEU 92 -9.826 -2.275 1.807 794 HB2 LEU 92 HB2 LEU 92 -10.762 0.290 0.527 795 HB3 LEU 92 HB1 LEU 92 -11.861 -0.944 1.113 796 HG LEU 92 HG LEU 92 -9.844 0.476 2.854 797 HD11 LEU 92 HD11 LEU 92 -11.395 2.124 2.120 798 HD12 LEU 92 HD12 LEU 92 -11.861 1.653 3.755 799 HD13 LEU 92 HD13 LEU 92 -12.761 1.037 2.369 800 HD21 LEU 92 HD21 LEU 92 -11.641 -0.407 4.567 801 HD22 LEU 92 HD22 LEU 92 -10.320 -1.438 4.016 802 HD23 LEU 92 HD23 LEU 92 -11.925 -1.605 3.304 803 H LEU 93 HN LEU 93 -9.288 -0.908 -1.400 804 HA LEU 93 HA LEU 93 -11.078 -2.640 -2.768 805 HB2 LEU 93 HB2 LEU 93 -8.949 -0.727 -3.514 806 HB3 LEU 93 HB1 LEU 93 -9.283 -1.989 -4.682 807 HG LEU 93 HG LEU 93 -10.515 0.103 -5.135 808 HD11 LEU 93 HD11 LEU 93 -11.973 -1.215 -6.143 809 HD12 LEU 93 HD12 LEU 93 -12.847 -1.423 -4.626 810 HD13 LEU 93 HD13 LEU 93 -11.545 -2.533 -5.051 811 HD21 LEU 93 HD21 LEU 93 -10.822 0.683 -2.700 812 HD22 LEU 93 HD22 LEU 93 -12.136 -0.496 -2.675 813 HD23 LEU 93 HD23 LEU 93 -12.234 0.913 -3.732 814 H ALA 94 HN ALA 94 -7.637 -2.799 -1.990 815 HA ALA 94 HA ALA 94 -6.999 -5.097 -3.476 816 HB1 ALA 94 HB1 ALA 94 -5.484 -3.382 -2.196 817 HB2 ALA 94 HB2 ALA 94 -4.949 -5.044 -2.452 818 HB3 ALA 94 HB3 ALA 94 -5.619 -4.564 -0.892 819 H GLU 95 HN GLU 95 -8.290 -4.715 -0.215 820 HA GLU 95 HA GLU 95 -8.035 -7.381 0.634 821 HB2 GLU 95 HB2 GLU 95 -9.993 -5.202 1.364 822 HB3 GLU 95 HB1 GLU 95 -9.957 -6.767 2.166 823 HG2 GLU 95 HG2 GLU 95 -7.748 -6.369 2.991 824 HG3 GLU 95 HG1 GLU 95 -7.602 -4.900 2.029 825 H GLU 96 HN GLU 96 -10.513 -5.709 -1.215 826 HA GLU 96 HA GLU 96 -12.445 -7.755 -1.280 827 HB2 GLU 96 HB2 GLU 96 -11.798 -5.519 -3.215 828 HB3 GLU 96 HB1 GLU 96 -13.194 -6.578 -3.399 829 HG2 GLU 96 HG2 GLU 96 -12.656 -4.748 -1.066 830 HG3 GLU 96 HG1 GLU 96 -13.816 -4.470 -2.363 831 H ILE 97 HN ILE 97 -9.691 -7.016 -3.338 832 HA ILE 97 HA ILE 97 -10.150 -8.967 -5.329 833 HB ILE 97 HB ILE 97 -7.607 -7.588 -4.455 834 HG12 ILE 97 HG12 ILE 97 -9.383 -7.082 -6.838 835 HG13 ILE 97 HG11 ILE 97 -9.547 -6.229 -5.306 836 HG21 ILE 97 HG21 ILE 97 -6.681 -8.244 -6.638 837 HG22 ILE 97 HG22 ILE 97 -8.131 -9.198 -6.959 838 HG23 ILE 97 HG23 ILE 97 -7.051 -9.654 -5.641 839 HD11 ILE 97 HD11 ILE 97 -8.180 -5.219 -7.271 840 HD12 ILE 97 HD12 ILE 97 -6.906 -6.264 -6.638 841 HD13 ILE 97 HD13 ILE 97 -7.645 -5.044 -5.600 842 H GLY 98 HN GLY 98 -8.144 -8.966 -2.396 843 HA2 GLY 98 HA2 GLY 98 -7.050 -11.546 -2.710 844 HA3 GLY 98 HA1 GLY 98 -7.198 -10.680 -1.188 845 H ASP 99 HN ASP 99 -10.049 -10.447 -1.249 846 HA ASP 99 HA ASP 99 -10.791 -12.847 0.020 847 HB2 ASP 99 HB2 ASP 99 -11.846 -10.639 0.454 848 HB3 ASP 99 HB1 ASP 99 -12.618 -10.726 -1.127 849 H TYR 100 HN TYR 100 -11.344 -11.674 -3.266 850 HA TYR 100 HA TYR 100 -13.015 -13.909 -3.964 851 HB2 TYR 100 HB2 TYR 100 -13.386 -11.732 -5.020 852 HB3 TYR 100 HB1 TYR 100 -11.753 -11.753 -5.676 853 HD1 TYR 100 HD1 TYR 100 -15.001 -13.567 -5.799 854 HD2 TYR 100 HD2 TYR 100 -11.335 -12.698 -7.777 855 HE1 TYR 100 HE1 TYR 100 -15.838 -14.678 -7.826 856 HE2 TYR 100 HE2 TYR 100 -12.163 -13.807 -9.809 857 HH TYR 100 HH TYR 100 -15.127 -14.347 -10.533 858 H LYS 101 HN LYS 101 -12.215 -15.840 -4.295 859 HA LYS 101 HA LYS 101 -9.521 -16.108 -5.445 860 HB2 LYS 101 HB2 LYS 101 -11.066 -18.112 -3.786 861 HB3 LYS 101 HB1 LYS 101 -9.435 -18.327 -4.403 862 HG2 LYS 101 HG2 LYS 101 -10.224 -16.147 -2.484 863 HG3 LYS 101 HG1 LYS 101 -9.577 -17.711 -1.990 864 HD2 LYS 101 HD2 LYS 101 -8.129 -15.912 -3.917 865 HD3 LYS 101 HD1 LYS 101 -7.928 -15.773 -2.171 866 HE2 LYS 101 HE2 LYS 101 -7.417 -18.262 -3.800 867 HE3 LYS 101 HE1 LYS 101 -6.178 -17.158 -3.207 868 HZ1 LYS 101 HZ1 LYS 101 -7.644 -19.208 -1.801 869 HZ2 LYS 101 HZ2 LYS 101 -7.528 -17.745 -0.961 870 HZ3 LYS 101 HZ3 LYS 101 -6.124 -18.541 -1.468 871 H ASP 102 HN ASP 102 -9.181 -17.505 -7.167 872 HA ASP 102 HA ASP 102 -11.560 -18.082 -8.744 873 HB2 ASP 102 HB2 ASP 102 -9.587 -16.978 -9.791 874 HB3 ASP 102 HB1 ASP 102 -8.642 -18.431 -9.477 875 H ASP 103 HN ASP 103 -12.545 -19.917 -8.112 876 HA ASP 103 HA ASP 103 -10.958 -22.257 -7.402 877 HB2 ASP 103 HB2 ASP 103 -12.944 -21.601 -6.033 878 HB3 ASP 103 HB1 ASP 103 -13.969 -21.928 -7.425 879 H ASP 104 HN ASP 104 -10.208 -23.375 -9.076 880 HA ASP 104 HA ASP 104 -11.347 -23.421 -11.659 881 HB2 ASP 104 HB2 ASP 104 -8.941 -23.876 -11.123 882 HB3 ASP 104 HB1 ASP 104 -9.429 -25.445 -10.489 883 H ASP 105 HN ASP 105 -11.862 -25.417 -8.846 884 HA ASP 105 HA ASP 105 -13.225 -27.490 -10.355 885 HB2 ASP 105 HB2 ASP 105 -11.868 -28.033 -8.333 886 HB3 ASP 105 HB1 ASP 105 -13.022 -27.130 -7.356 887 H LYS 106 HN LYS 106 -15.138 -26.886 -11.179 888 HA LYS 106 HA LYS 106 -16.880 -25.041 -9.823 889 HB2 LYS 106 HB2 LYS 106 -17.433 -26.731 -12.271 890 HB3 LYS 106 HB1 LYS 106 -18.372 -25.349 -11.726 891 HG2 LYS 106 HG2 LYS 106 -15.505 -25.250 -12.652 892 HG3 LYS 106 HG1 LYS 106 -16.912 -24.802 -13.618 893 HD2 LYS 106 HD2 LYS 106 -17.457 -23.054 -11.963 894 HD3 LYS 106 HD1 LYS 106 -16.005 -23.485 -11.057 895 HE2 LYS 106 HE2 LYS 106 -15.586 -21.542 -12.449 896 HE3 LYS 106 HE1 LYS 106 -14.630 -22.914 -13.007 897 HZ1 LYS 106 HZ1 LYS 106 -15.758 -23.029 -14.938 898 HZ2 LYS 106 HZ2 LYS 106 -16.079 -21.398 -14.626 899 HZ3 LYS 106 HZ3 LYS 106 -17.236 -22.573 -14.252 Start of MODEL 3 1 H1 MET 1 HT1 MET 1 -4.371 -13.250 -24.113 2 H2 MET 1 HT2 MET 1 -5.618 -13.529 -25.219 3 H3 MET 1 HT3 MET 1 -5.437 -14.545 -23.881 4 HA MET 1 HA MET 1 -6.573 -11.862 -24.055 5 HB2 MET 1 HB2 MET 1 -7.899 -13.998 -23.806 6 HB3 MET 1 HB1 MET 1 -7.185 -14.180 -22.211 7 HG2 MET 1 HG2 MET 1 -9.373 -13.233 -21.995 8 HG3 MET 1 HG1 MET 1 -8.172 -12.020 -21.555 9 HE1 MET 1 HE1 MET 1 -11.209 -12.057 -24.859 10 HE2 MET 1 HE2 MET 1 -10.583 -13.426 -23.941 11 HE3 MET 1 HE3 MET 1 -9.761 -12.899 -25.411 12 H ALA 2 HN ALA 2 -4.374 -13.745 -22.151 13 HA ALA 2 HA ALA 2 -3.157 -13.363 -20.266 14 HB1 ALA 2 HB1 ALA 2 -1.747 -11.766 -20.867 15 HB2 ALA 2 HB2 ALA 2 -2.881 -10.559 -20.260 16 HB3 ALA 2 HB3 ALA 2 -2.956 -11.068 -21.947 17 HA PRO 3 HA PRO 3 -6.875 -11.805 -17.849 18 HB2 PRO 3 HB2 PRO 3 -7.444 -14.081 -16.529 19 HB3 PRO 3 HB1 PRO 3 -8.087 -13.734 -18.140 20 HG2 PRO 3 HG2 PRO 3 -5.723 -15.396 -17.367 21 HG3 PRO 3 HG1 PRO 3 -7.018 -15.773 -18.516 22 HD2 PRO 3 HD2 PRO 3 -4.602 -14.872 -19.314 23 HD3 PRO 3 HD1 PRO 3 -6.097 -14.448 -20.174 24 H LEU 4 HN LEU 4 -6.899 -11.234 -15.672 25 HA LEU 4 HA LEU 4 -4.428 -11.874 -14.205 26 HB2 LEU 4 HB2 LEU 4 -6.117 -9.380 -13.992 27 HB3 LEU 4 HB1 LEU 4 -4.617 -9.689 -13.138 28 HG LEU 4 HG LEU 4 -4.918 -9.329 -16.122 29 HD11 LEU 4 HD11 LEU 4 -3.158 -7.453 -15.002 30 HD12 LEU 4 HD12 LEU 4 -4.588 -7.473 -13.969 31 HD13 LEU 4 HD13 LEU 4 -4.753 -7.165 -15.699 32 HD21 LEU 4 HD21 LEU 4 -2.266 -9.126 -15.618 33 HD22 LEU 4 HD22 LEU 4 -3.067 -10.596 -16.180 34 HD23 LEU 4 HD23 LEU 4 -2.730 -10.378 -14.463 35 H ARG 5 HN ARG 5 -4.570 -12.416 -12.036 36 HA ARG 5 HA ARG 5 -7.287 -13.010 -11.088 37 HB2 ARG 5 HB2 ARG 5 -4.750 -14.449 -10.953 38 HB3 ARG 5 HB1 ARG 5 -5.547 -14.334 -9.390 39 HG2 ARG 5 HG2 ARG 5 -6.280 -16.349 -10.357 40 HG3 ARG 5 HG1 ARG 5 -7.623 -15.217 -10.514 41 HD2 ARG 5 HD2 ARG 5 -7.132 -14.846 -12.821 42 HD3 ARG 5 HD1 ARG 5 -5.618 -15.742 -12.700 43 HE ARG 5 HE ARG 5 -7.701 -17.450 -11.962 44 HH11 ARG 5 HH11 ARG 5 -6.524 -15.788 -14.786 45 HH12 ARG 5 HH12 ARG 5 -7.163 -16.951 -15.898 46 HH21 ARG 5 HH21 ARG 5 -8.550 -18.985 -13.403 47 HH22 ARG 5 HH22 ARG 5 -8.321 -18.778 -15.108 48 H LYS 6 HN LYS 6 -4.169 -12.400 -9.455 49 HA LYS 6 HA LYS 6 -5.594 -10.929 -7.388 50 HB2 LYS 6 HB2 LYS 6 -2.680 -11.712 -7.562 51 HB3 LYS 6 HB1 LYS 6 -3.458 -10.974 -6.170 52 HG2 LYS 6 HG2 LYS 6 -4.169 -13.666 -7.324 53 HG3 LYS 6 HG1 LYS 6 -3.149 -13.397 -5.909 54 HD2 LYS 6 HD2 LYS 6 -5.038 -12.291 -4.781 55 HD3 LYS 6 HD1 LYS 6 -6.052 -12.611 -6.190 56 HE2 LYS 6 HE2 LYS 6 -5.725 -15.017 -5.876 57 HE3 LYS 6 HE1 LYS 6 -4.715 -14.696 -4.466 58 HZ1 LYS 6 HZ1 LYS 6 -7.630 -14.254 -4.777 59 HZ2 LYS 6 HZ2 LYS 6 -6.741 -13.496 -3.551 60 HZ3 LYS 6 HZ3 LYS 6 -6.819 -15.183 -3.614 61 H THR 7 HN THR 7 -3.921 -10.237 -10.225 62 HA THR 7 HA THR 7 -3.035 -7.627 -9.310 63 HB THR 7 HB THR 7 -2.532 -7.505 -11.933 64 HG1 THR 7 HG1 THR 7 -2.674 -9.396 -12.858 65 HG21 THR 7 HG21 THR 7 -0.315 -8.793 -11.248 66 HG22 THR 7 HG22 THR 7 -1.005 -8.612 -9.635 67 HG23 THR 7 HG23 THR 7 -0.687 -7.184 -10.627 68 H ALA 8 HN ALA 8 -4.130 -5.846 -9.531 69 HA ALA 8 HA ALA 8 -6.523 -5.853 -11.250 70 HB1 ALA 8 HB1 ALA 8 -6.081 -4.052 -8.886 71 HB2 ALA 8 HB2 ALA 8 -6.819 -5.647 -8.739 72 HB3 ALA 8 HB3 ALA 8 -7.589 -4.406 -9.729 73 H VAL 9 HN VAL 9 -7.066 -3.892 -12.346 74 HA VAL 9 HA VAL 9 -4.668 -2.305 -12.967 75 HB VAL 9 HB VAL 9 -7.061 -2.844 -14.726 76 HG11 VAL 9 HG11 VAL 9 -5.298 -1.804 -16.422 77 HG12 VAL 9 HG12 VAL 9 -4.749 -0.978 -14.964 78 HG13 VAL 9 HG13 VAL 9 -6.415 -0.787 -15.511 79 HG21 VAL 9 HG21 VAL 9 -4.281 -3.663 -15.406 80 HG22 VAL 9 HG22 VAL 9 -5.818 -4.392 -15.871 81 HG23 VAL 9 HG23 VAL 9 -5.187 -4.631 -14.242 82 H LEU 10 HN LEU 10 -4.722 -0.253 -12.433 83 HA LEU 10 HA LEU 10 -7.317 1.016 -11.807 84 HB2 LEU 10 HB2 LEU 10 -4.865 0.822 -10.312 85 HB3 LEU 10 HB1 LEU 10 -5.195 2.503 -10.671 86 HG LEU 10 HG LEU 10 -6.053 1.873 -8.473 87 HD11 LEU 10 HD11 LEU 10 -8.449 2.541 -8.803 88 HD12 LEU 10 HD12 LEU 10 -8.147 2.497 -10.541 89 HD13 LEU 10 HD13 LEU 10 -7.254 3.624 -9.519 90 HD21 LEU 10 HD21 LEU 10 -8.052 0.338 -8.398 91 HD22 LEU 10 HD22 LEU 10 -6.490 -0.431 -8.670 92 HD23 LEU 10 HD23 LEU 10 -7.598 -0.186 -10.020 93 H LYS 11 HN LYS 11 -7.810 2.864 -12.981 94 HA LYS 11 HA LYS 11 -5.629 3.840 -14.698 95 HB2 LYS 11 HB2 LYS 11 -8.560 3.573 -15.372 96 HB3 LYS 11 HB1 LYS 11 -7.441 4.547 -16.317 97 HG2 LYS 11 HG2 LYS 11 -6.099 2.543 -16.762 98 HG3 LYS 11 HG1 LYS 11 -7.259 1.577 -15.855 99 HD2 LYS 11 HD2 LYS 11 -9.017 2.193 -17.432 100 HD3 LYS 11 HD1 LYS 11 -7.875 3.196 -18.327 101 HE2 LYS 11 HE2 LYS 11 -6.533 1.218 -18.835 102 HE3 LYS 11 HE1 LYS 11 -7.667 0.212 -17.933 103 HZ1 LYS 11 HZ1 LYS 11 -7.789 0.817 -20.602 104 HZ2 LYS 11 HZ2 LYS 11 -8.991 1.784 -19.908 105 HZ3 LYS 11 HZ3 LYS 11 -9.015 0.108 -19.676 106 H LEU 12 HN LEU 12 -5.154 5.894 -14.589 107 HA LEU 12 HA LEU 12 -6.905 7.605 -12.973 108 HB2 LEU 12 HB2 LEU 12 -4.120 7.147 -12.901 109 HB3 LEU 12 HB1 LEU 12 -4.329 8.776 -13.509 110 HG LEU 12 HG LEU 12 -5.503 7.748 -10.925 111 HD11 LEU 12 HD11 LEU 12 -3.047 7.857 -10.876 112 HD12 LEU 12 HD12 LEU 12 -3.792 9.057 -9.819 113 HD13 LEU 12 HD13 LEU 12 -3.126 9.546 -11.378 114 HD21 LEU 12 HD21 LEU 12 -5.507 10.425 -12.282 115 HD22 LEU 12 HD22 LEU 12 -5.722 10.264 -10.540 116 HD23 LEU 12 HD23 LEU 12 -6.870 9.508 -11.643 117 H TYR 13 HN TYR 13 -7.969 9.246 -14.051 118 HA TYR 13 HA TYR 13 -7.131 9.813 -16.810 119 HB2 TYR 13 HB2 TYR 13 -9.705 10.378 -15.315 120 HB3 TYR 13 HB1 TYR 13 -9.389 10.818 -16.991 121 HD1 TYR 13 HD1 TYR 13 -9.997 8.020 -14.680 122 HD2 TYR 13 HD2 TYR 13 -9.434 9.159 -18.741 123 HE1 TYR 13 HE1 TYR 13 -10.783 5.808 -15.402 124 HE2 TYR 13 HE2 TYR 13 -10.220 6.947 -19.473 125 HH TYR 13 HH TYR 13 -11.948 4.973 -17.832 126 H VAL 14 HN VAL 14 -5.981 11.636 -17.088 127 HA VAL 14 HA VAL 14 -6.356 13.815 -15.137 128 HB VAL 14 HB VAL 14 -3.957 14.362 -15.375 129 HG11 VAL 14 HG11 VAL 14 -4.565 13.229 -13.394 130 HG12 VAL 14 HG12 VAL 14 -3.151 12.370 -14.012 131 HG13 VAL 14 HG13 VAL 14 -4.764 11.695 -14.242 132 HG21 VAL 14 HG21 VAL 14 -3.900 12.846 -17.561 133 HG22 VAL 14 HG22 VAL 14 -3.376 11.635 -16.392 134 HG23 VAL 14 HG23 VAL 14 -2.464 13.134 -16.579 135 H ALA 15 HN ALA 15 -5.693 15.931 -15.931 136 HA ALA 15 HA ALA 15 -6.105 16.162 -18.835 137 HB1 ALA 15 HB1 ALA 15 -7.739 17.207 -16.852 138 HB2 ALA 15 HB2 ALA 15 -7.697 17.716 -18.541 139 HB3 ALA 15 HB3 ALA 15 -6.736 18.575 -17.337 140 H GLY 16 HN GLY 16 -4.130 16.459 -19.644 141 HA2 GLY 16 HA2 GLY 16 -2.106 17.446 -20.077 142 HA3 GLY 16 HA1 GLY 16 -2.720 18.859 -19.229 143 H ASN 17 HN ASN 17 -1.235 19.454 -17.781 144 HA ASN 17 HA ASN 17 -0.282 17.419 -15.892 145 HB2 ASN 17 HB2 ASN 17 1.389 18.141 -17.825 146 HB3 ASN 17 HB1 ASN 17 1.631 19.542 -16.786 147 HD21 ASN 17 HD21 ASN 17 3.635 19.167 -16.052 148 HD22 ASN 17 HD22 ASN 17 4.100 17.775 -15.140 149 H THR 18 HN THR 18 -2.319 18.902 -15.197 150 HA THR 18 HA THR 18 -1.590 21.416 -14.014 151 HB THR 18 HB THR 18 -3.833 21.379 -13.011 152 HG1 THR 18 HG1 THR 18 -5.195 19.528 -13.587 153 HG21 THR 18 HG21 THR 18 -5.008 21.733 -14.964 154 HG22 THR 18 HG22 THR 18 -4.252 20.371 -15.792 155 HG23 THR 18 HG23 THR 18 -3.342 21.860 -15.532 156 HA PRO 19 HA PRO 19 0.004 20.209 -10.105 157 HB2 PRO 19 HB2 PRO 19 -2.136 21.887 -8.849 158 HB3 PRO 19 HB1 PRO 19 -0.391 21.898 -8.570 159 HG2 PRO 19 HG2 PRO 19 -1.476 23.807 -10.034 160 HG3 PRO 19 HG1 PRO 19 0.045 23.056 -10.557 161 HD2 PRO 19 HD2 PRO 19 -2.738 22.592 -11.566 162 HD3 PRO 19 HD1 PRO 19 -1.218 22.733 -12.475 163 H ASN 20 HN ASN 20 -3.537 20.161 -10.308 164 HA ASN 20 HA ASN 20 -3.952 18.372 -8.138 165 HB2 ASN 20 HB2 ASN 20 -5.691 18.867 -10.585 166 HB3 ASN 20 HB1 ASN 20 -6.165 17.891 -9.202 167 HD21 ASN 20 HD21 ASN 20 -6.118 18.975 -7.078 168 HD22 ASN 20 HD22 ASN 20 -6.591 20.634 -7.011 169 H SER 21 HN SER 21 -3.620 17.879 -11.647 170 HA SER 21 HA SER 21 -3.829 15.041 -11.628 171 HB2 SER 21 HB2 SER 21 -2.508 16.924 -13.600 172 HB3 SER 21 HB1 SER 21 -2.819 15.212 -13.889 173 HG SER 21 HG SER 21 -4.556 17.366 -13.909 174 H VAL 22 HN VAL 22 -1.031 17.224 -11.521 175 HA VAL 22 HA VAL 22 0.871 15.140 -11.581 176 HB VAL 22 HB VAL 22 1.064 17.970 -10.514 177 HG11 VAL 22 HG11 VAL 22 3.559 17.600 -10.668 178 HG12 VAL 22 HG12 VAL 22 3.204 15.875 -10.739 179 HG13 VAL 22 HG13 VAL 22 2.731 16.815 -9.322 180 HG21 VAL 22 HG21 VAL 22 0.801 18.064 -12.833 181 HG22 VAL 22 HG22 VAL 22 1.832 16.658 -13.100 182 HG23 VAL 22 HG23 VAL 22 2.543 18.188 -12.587 183 H ARG 23 HN ARG 23 -0.634 16.889 -8.899 184 HA ARG 23 HA ARG 23 0.777 15.656 -6.797 185 HB2 ARG 23 HB2 ARG 23 -0.725 17.712 -6.729 186 HB3 ARG 23 HB1 ARG 23 -2.082 16.586 -6.702 187 HG2 ARG 23 HG2 ARG 23 -1.715 15.952 -4.579 188 HG3 ARG 23 HG1 ARG 23 0.030 16.203 -4.670 189 HD2 ARG 23 HD2 ARG 23 -2.020 18.417 -4.605 190 HD3 ARG 23 HD1 ARG 23 -1.152 17.822 -3.188 191 HE ARG 23 HE ARG 23 0.750 18.507 -5.092 192 HH11 ARG 23 HH11 ARG 23 -1.706 20.076 -3.187 193 HH12 ARG 23 HH12 ARG 23 -0.876 21.594 -3.124 194 HH21 ARG 23 HH21 ARG 23 1.859 20.497 -5.016 195 HH22 ARG 23 HH22 ARG 23 1.159 21.834 -4.167 196 H ALA 24 HN ALA 24 -2.323 14.892 -8.341 197 HA ALA 24 HA ALA 24 -2.953 12.687 -6.724 198 HB1 ALA 24 HB1 ALA 24 -4.812 12.561 -7.962 199 HB2 ALA 24 HB2 ALA 24 -3.910 12.474 -9.475 200 HB3 ALA 24 HB3 ALA 24 -4.226 14.039 -8.726 201 H LEU 25 HN LEU 25 -1.255 12.936 -9.810 202 HA LEU 25 HA LEU 25 -0.888 10.193 -10.312 203 HB2 LEU 25 HB2 LEU 25 -0.555 11.894 -12.021 204 HB3 LEU 25 HB1 LEU 25 0.791 12.568 -11.126 205 HG LEU 25 HG LEU 25 2.072 10.501 -11.501 206 HD11 LEU 25 HD11 LEU 25 -0.453 9.673 -12.884 207 HD12 LEU 25 HD12 LEU 25 0.532 8.777 -11.726 208 HD13 LEU 25 HD13 LEU 25 1.106 9.009 -13.378 209 HD21 LEU 25 HD21 LEU 25 2.472 10.839 -13.890 210 HD22 LEU 25 HD22 LEU 25 2.310 12.374 -13.038 211 HD23 LEU 25 HD23 LEU 25 0.974 11.760 -14.012 212 H LYS 26 HN LYS 26 1.252 12.519 -8.651 213 HA LYS 26 HA LYS 26 3.308 10.658 -8.130 214 HB2 LYS 26 HB2 LYS 26 2.531 13.210 -6.721 215 HB3 LYS 26 HB1 LYS 26 3.939 12.261 -6.268 216 HG2 LYS 26 HG2 LYS 26 4.862 12.564 -8.517 217 HG3 LYS 26 HG1 LYS 26 3.451 13.532 -8.956 218 HD2 LYS 26 HD2 LYS 26 4.023 15.160 -7.228 219 HD3 LYS 26 HD1 LYS 26 5.419 14.187 -6.761 220 HE2 LYS 26 HE2 LYS 26 6.379 14.498 -8.990 221 HE3 LYS 26 HE1 LYS 26 4.982 15.465 -9.460 222 HZ1 LYS 26 HZ1 LYS 26 5.575 17.064 -7.733 223 HZ2 LYS 26 HZ2 LYS 26 6.831 16.871 -8.846 224 HZ3 LYS 26 HZ3 LYS 26 6.934 16.142 -7.326 225 H THR 27 HN THR 27 0.415 11.560 -6.311 226 HA THR 27 HA THR 27 0.972 10.121 -3.954 227 HB THR 27 HB THR 27 -1.691 10.876 -5.176 228 HG1 THR 27 HG1 THR 27 -0.567 12.738 -4.762 229 HG21 THR 27 HG21 THR 27 -0.948 9.551 -2.654 230 HG22 THR 27 HG22 THR 27 -2.473 9.536 -3.535 231 HG23 THR 27 HG23 THR 27 -2.070 10.905 -2.498 232 H LEU 28 HN LEU 28 -0.847 9.232 -6.887 233 HA LEU 28 HA LEU 28 -1.601 6.662 -5.953 234 HB2 LEU 28 HB2 LEU 28 -1.867 8.208 -8.386 235 HB3 LEU 28 HB1 LEU 28 -1.483 6.540 -8.754 236 HG LEU 28 HG LEU 28 -3.850 6.743 -8.798 237 HD11 LEU 28 HD11 LEU 28 -4.176 4.831 -7.730 238 HD12 LEU 28 HD12 LEU 28 -3.914 5.587 -6.157 239 HD13 LEU 28 HD13 LEU 28 -2.540 4.992 -7.090 240 HD21 LEU 28 HD21 LEU 28 -4.761 8.448 -7.697 241 HD22 LEU 28 HD22 LEU 28 -3.402 8.553 -6.577 242 HD23 LEU 28 HD23 LEU 28 -4.716 7.420 -6.265 243 H ALA 29 HN ALA 29 1.006 7.697 -8.194 244 HA ALA 29 HA ALA 29 1.987 5.120 -8.704 245 HB1 ALA 29 HB1 ALA 29 2.786 6.558 -10.252 246 HB2 ALA 29 HB2 ALA 29 4.165 6.585 -9.151 247 HB3 ALA 29 HB3 ALA 29 2.968 7.879 -9.097 248 H ASN 30 HN ASN 30 2.960 7.490 -6.222 249 HA ASN 30 HA ASN 30 5.227 6.060 -5.278 250 HB2 ASN 30 HB2 ASN 30 4.833 8.421 -4.729 251 HB3 ASN 30 HB1 ASN 30 3.407 7.975 -3.800 252 HD21 ASN 30 HD21 ASN 30 6.902 7.606 -3.984 253 HD22 ASN 30 HD22 ASN 30 7.144 7.350 -2.293 254 H ILE 31 HN ILE 31 1.863 6.082 -4.220 255 HA ILE 31 HA ILE 31 2.230 4.285 -2.103 256 HB ILE 31 HB ILE 31 -0.210 5.159 -3.590 257 HG12 ILE 31 HG12 ILE 31 0.645 5.485 -0.716 258 HG13 ILE 31 HG11 ILE 31 1.062 6.628 -1.992 259 HG21 ILE 31 HG21 ILE 31 -1.576 3.677 -2.624 260 HG22 ILE 31 HG22 ILE 31 -0.687 3.704 -1.101 261 HG23 ILE 31 HG23 ILE 31 -0.127 2.690 -2.430 262 HD11 ILE 31 HD11 ILE 31 -0.884 7.272 -0.593 263 HD12 ILE 31 HD12 ILE 31 -1.748 5.889 -1.265 264 HD13 ILE 31 HD13 ILE 31 -1.213 7.194 -2.324 265 H LEU 32 HN LEU 32 1.203 3.758 -5.462 266 HA LEU 32 HA LEU 32 0.848 0.971 -5.157 267 HB2 LEU 32 HB2 LEU 32 1.213 2.706 -7.578 268 HB3 LEU 32 HB1 LEU 32 0.973 0.970 -7.690 269 HG LEU 32 HG LEU 32 -0.976 2.832 -6.314 270 HD11 LEU 32 HD11 LEU 32 -0.734 3.302 -8.756 271 HD12 LEU 32 HD12 LEU 32 -2.337 2.739 -8.277 272 HD13 LEU 32 HD13 LEU 32 -1.214 1.635 -9.071 273 HD21 LEU 32 HD21 LEU 32 -2.256 0.544 -7.192 274 HD22 LEU 32 HD22 LEU 32 -1.784 0.920 -5.536 275 HD23 LEU 32 HD23 LEU 32 -0.717 -0.037 -6.561 276 H GLU 33 HN GLU 33 3.664 2.909 -6.006 277 HA GLU 33 HA GLU 33 5.297 0.778 -6.910 278 HB2 GLU 33 HB2 GLU 33 5.996 3.488 -5.797 279 HB3 GLU 33 HB1 GLU 33 7.209 2.349 -6.363 280 HG2 GLU 33 HG2 GLU 33 6.264 2.398 -8.588 281 HG3 GLU 33 HG1 GLU 33 4.962 3.448 -8.031 282 H LYS 34 HN LYS 34 4.716 2.027 -3.647 283 HA LYS 34 HA LYS 34 6.668 0.040 -2.681 284 HB2 LYS 34 HB2 LYS 34 7.221 2.343 -2.072 285 HB3 LYS 34 HB1 LYS 34 5.653 2.531 -1.305 286 HG2 LYS 34 HG2 LYS 34 7.310 2.178 0.387 287 HG3 LYS 34 HG1 LYS 34 6.273 0.753 0.303 288 HD2 LYS 34 HD2 LYS 34 7.952 -0.432 -0.983 289 HD3 LYS 34 HD1 LYS 34 8.975 1.006 -1.019 290 HE2 LYS 34 HE2 LYS 34 9.172 0.921 1.419 291 HE3 LYS 34 HE1 LYS 34 8.151 -0.514 1.452 292 HZ1 LYS 34 HZ1 LYS 34 9.847 -1.620 0.042 293 HZ2 LYS 34 HZ2 LYS 34 10.408 -1.203 1.582 294 HZ3 LYS 34 HZ3 LYS 34 10.848 -0.270 0.242 295 H GLU 35 HN GLU 35 3.606 1.546 -1.672 296 HA GLU 35 HA GLU 35 2.996 -0.358 0.306 297 HB2 GLU 35 HB2 GLU 35 1.357 1.687 -1.172 298 HB3 GLU 35 HB1 GLU 35 0.619 0.604 0.001 299 HG2 GLU 35 HG2 GLU 35 1.101 2.678 1.078 300 HG3 GLU 35 HG1 GLU 35 2.201 1.458 1.716 301 H PHE 36 HN PHE 36 1.971 -0.215 -3.124 302 HA PHE 36 HA PHE 36 0.896 -2.925 -2.709 303 HB2 PHE 36 HB2 PHE 36 -0.249 -0.773 -4.483 304 HB3 PHE 36 HB1 PHE 36 -0.809 -2.441 -4.450 305 HD1 PHE 36 HD1 PHE 36 -0.904 0.777 -2.828 306 HD2 PHE 36 HD2 PHE 36 -1.862 -3.345 -2.395 307 HE1 PHE 36 HE1 PHE 36 -2.401 1.327 -0.955 308 HE2 PHE 36 HE2 PHE 36 -3.363 -2.804 -0.523 309 HZ PHE 36 HZ PHE 36 -3.632 -0.464 0.199 310 H LYS 37 HN LYS 37 3.576 -2.187 -3.708 311 HA LYS 37 HA LYS 37 3.731 -2.483 -6.488 312 HB2 LYS 37 HB2 LYS 37 5.626 -1.736 -5.114 313 HB3 LYS 37 HB1 LYS 37 5.754 -3.346 -4.416 314 HG2 LYS 37 HG2 LYS 37 6.477 -4.286 -6.456 315 HG3 LYS 37 HG1 LYS 37 6.015 -2.848 -7.368 316 HD2 LYS 37 HD2 LYS 37 8.415 -2.891 -7.109 317 HD3 LYS 37 HD1 LYS 37 7.749 -1.567 -6.149 318 HE2 LYS 37 HE2 LYS 37 9.432 -2.700 -4.862 319 HE3 LYS 37 HE1 LYS 37 7.851 -3.018 -4.152 320 HZ1 LYS 37 HZ1 LYS 37 8.990 -4.917 -6.091 321 HZ2 LYS 37 HZ2 LYS 37 7.878 -5.196 -4.850 322 HZ3 LYS 37 HZ3 LYS 37 9.509 -4.952 -4.482 323 H GLY 38 HN GLY 38 3.458 -4.134 -7.816 324 HA2 GLY 38 HA2 GLY 38 3.623 -6.353 -8.552 325 HA3 GLY 38 HA1 GLY 38 3.877 -6.861 -6.891 326 H VAL 39 HN VAL 39 1.320 -4.919 -6.552 327 HA VAL 39 HA VAL 39 -0.516 -7.166 -6.991 328 HB VAL 39 HB VAL 39 -0.885 -4.849 -5.073 329 HG11 VAL 39 HG11 VAL 39 -2.940 -6.053 -6.034 330 HG12 VAL 39 HG12 VAL 39 -2.821 -5.894 -4.281 331 HG13 VAL 39 HG13 VAL 39 -2.423 -7.427 -5.058 332 HG21 VAL 39 HG21 VAL 39 -0.291 -7.693 -4.309 333 HG22 VAL 39 HG22 VAL 39 -0.215 -6.243 -3.307 334 HG23 VAL 39 HG23 VAL 39 0.988 -6.507 -4.571 335 H TYR 40 HN TYR 40 -0.260 -3.624 -7.385 336 HA TYR 40 HA TYR 40 -2.560 -3.898 -9.181 337 HB2 TYR 40 HB2 TYR 40 -1.746 -1.591 -7.431 338 HB3 TYR 40 HB1 TYR 40 -2.773 -1.321 -8.827 339 HD1 TYR 40 HD1 TYR 40 -2.562 -2.953 -5.525 340 HD2 TYR 40 HD2 TYR 40 -5.059 -1.860 -8.783 341 HE1 TYR 40 HE1 TYR 40 -4.548 -3.407 -4.149 342 HE2 TYR 40 HE2 TYR 40 -7.050 -2.316 -7.421 343 HH TYR 40 HH TYR 40 -6.898 -2.773 -4.067 344 H ALA 41 HN ALA 41 -2.565 -2.951 -11.170 345 HA ALA 41 HA ALA 41 0.035 -1.979 -12.139 346 HB1 ALA 41 HB1 ALA 41 -1.220 -3.986 -13.200 347 HB2 ALA 41 HB2 ALA 41 -0.536 -2.759 -14.266 348 HB3 ALA 41 HB3 ALA 41 -2.263 -2.753 -13.910 349 H LEU 42 HN LEU 42 0.211 0.176 -12.601 350 HA LEU 42 HA LEU 42 -2.235 1.758 -12.467 351 HB2 LEU 42 HB2 LEU 42 -0.418 2.405 -10.983 352 HB3 LEU 42 HB1 LEU 42 0.661 2.600 -12.350 353 HG LEU 42 HG LEU 42 -0.726 4.480 -13.163 354 HD11 LEU 42 HD11 LEU 42 -2.879 4.225 -12.413 355 HD12 LEU 42 HD12 LEU 42 -2.275 5.415 -11.260 356 HD13 LEU 42 HD13 LEU 42 -2.376 3.715 -10.802 357 HD21 LEU 42 HD21 LEU 42 1.236 4.740 -11.589 358 HD22 LEU 42 HD22 LEU 42 0.055 4.930 -10.294 359 HD23 LEU 42 HD23 LEU 42 0.091 6.079 -11.632 360 H LYS 43 HN LYS 43 -3.120 2.762 -14.094 361 HA LYS 43 HA LYS 43 -1.634 3.145 -16.594 362 HB2 LYS 43 HB2 LYS 43 -4.100 1.635 -16.124 363 HB3 LYS 43 HB1 LYS 43 -4.292 2.888 -17.341 364 HG2 LYS 43 HG2 LYS 43 -3.632 1.211 -18.689 365 HG3 LYS 43 HG1 LYS 43 -2.037 1.814 -18.241 366 HD2 LYS 43 HD2 LYS 43 -1.670 0.060 -16.742 367 HD3 LYS 43 HD1 LYS 43 -3.388 -0.331 -16.641 368 HE2 LYS 43 HE2 LYS 43 -2.380 -2.029 -17.955 369 HE3 LYS 43 HE1 LYS 43 -3.275 -0.989 -19.062 370 HZ1 LYS 43 HZ1 LYS 43 -0.678 -1.719 -19.333 371 HZ2 LYS 43 HZ2 LYS 43 -0.554 -0.159 -18.689 372 HZ3 LYS 43 HZ3 LYS 43 -1.418 -0.416 -20.119 373 H VAL 44 HN VAL 44 -1.865 5.103 -17.490 374 HA VAL 44 HA VAL 44 -3.758 6.999 -16.226 375 HB VAL 44 HB VAL 44 -0.927 7.491 -17.150 376 HG11 VAL 44 HG11 VAL 44 -3.086 9.384 -16.260 377 HG12 VAL 44 HG12 VAL 44 -2.073 9.472 -17.702 378 HG13 VAL 44 HG13 VAL 44 -1.376 9.794 -16.113 379 HG21 VAL 44 HG21 VAL 44 -0.264 7.492 -14.991 380 HG22 VAL 44 HG22 VAL 44 -1.657 6.425 -14.809 381 HG23 VAL 44 HG23 VAL 44 -1.798 8.136 -14.406 382 H ILE 45 HN ILE 45 -5.062 8.062 -17.463 383 HA ILE 45 HA ILE 45 -4.750 7.820 -20.381 384 HB ILE 45 HB ILE 45 -7.256 8.230 -18.748 385 HG12 ILE 45 HG12 ILE 45 -6.327 6.043 -18.261 386 HG13 ILE 45 HG11 ILE 45 -7.788 5.870 -19.222 387 HG21 ILE 45 HG21 ILE 45 -7.031 7.408 -21.642 388 HG22 ILE 45 HG22 ILE 45 -7.350 9.055 -21.097 389 HG23 ILE 45 HG23 ILE 45 -8.512 7.769 -20.746 390 HD11 ILE 45 HD11 ILE 45 -6.493 5.383 -21.181 391 HD12 ILE 45 HD12 ILE 45 -5.973 4.330 -19.862 392 HD13 ILE 45 HD13 ILE 45 -4.993 5.724 -20.317 393 H ASP 46 HN ASP 46 -4.112 9.761 -21.251 394 HA ASP 46 HA ASP 46 -4.644 12.228 -19.826 395 HB2 ASP 46 HB2 ASP 46 -2.464 11.750 -20.999 396 HB3 ASP 46 HB1 ASP 46 -3.328 11.899 -22.526 397 H VAL 47 HN VAL 47 -6.718 12.869 -19.983 398 HA VAL 47 HA VAL 47 -8.401 12.301 -22.175 399 HB VAL 47 HB VAL 47 -10.054 13.717 -21.106 400 HG11 VAL 47 HG11 VAL 47 -8.614 11.573 -19.799 401 HG12 VAL 47 HG12 VAL 47 -10.350 11.880 -19.882 402 HG13 VAL 47 HG13 VAL 47 -9.379 12.649 -18.626 403 HG21 VAL 47 HG21 VAL 47 -9.590 15.030 -19.144 404 HG22 VAL 47 HG22 VAL 47 -8.509 15.546 -20.438 405 HG23 VAL 47 HG23 VAL 47 -7.903 14.512 -19.144 406 H LEU 48 HN LEU 48 -6.389 15.143 -21.517 407 HA LEU 48 HA LEU 48 -7.693 16.789 -23.444 408 HB2 LEU 48 HB2 LEU 48 -4.993 17.021 -22.146 409 HB3 LEU 48 HB1 LEU 48 -5.586 18.181 -23.320 410 HG LEU 48 HG LEU 48 -6.921 17.551 -20.684 411 HD11 LEU 48 HD11 LEU 48 -4.870 18.694 -20.252 412 HD12 LEU 48 HD12 LEU 48 -6.184 19.860 -20.097 413 HD13 LEU 48 HD13 LEU 48 -5.181 19.851 -21.548 414 HD21 LEU 48 HD21 LEU 48 -8.682 18.330 -21.891 415 HD22 LEU 48 HD22 LEU 48 -7.661 19.215 -23.023 416 HD23 LEU 48 HD23 LEU 48 -7.978 19.876 -21.419 417 H LYS 49 HN LYS 49 -4.897 14.630 -23.633 418 HA LYS 49 HA LYS 49 -4.176 15.435 -26.268 419 HB2 LYS 49 HB2 LYS 49 -3.469 12.990 -24.666 420 HB3 LYS 49 HB1 LYS 49 -2.874 13.266 -26.298 421 HG2 LYS 49 HG2 LYS 49 -1.831 15.357 -25.553 422 HG3 LYS 49 HG1 LYS 49 -2.398 15.041 -23.911 423 HD2 LYS 49 HD2 LYS 49 -1.096 12.977 -23.857 424 HD3 LYS 49 HD1 LYS 49 -0.545 13.279 -25.506 425 HE2 LYS 49 HE2 LYS 49 0.545 15.338 -24.763 426 HE3 LYS 49 HE1 LYS 49 -0.015 15.046 -23.117 427 HZ1 LYS 49 HZ1 LYS 49 2.365 14.348 -23.820 428 HZ2 LYS 49 HZ2 LYS 49 1.593 12.997 -24.482 429 HZ3 LYS 49 HZ3 LYS 49 1.453 13.324 -22.828 430 H ASN 50 HN ASN 50 -6.258 12.901 -24.977 431 HA ASN 50 HA ASN 50 -7.205 12.458 -27.728 432 HB2 ASN 50 HB2 ASN 50 -5.765 10.551 -26.740 433 HB3 ASN 50 HB1 ASN 50 -7.142 10.260 -25.678 434 HD21 ASN 50 HD21 ASN 50 -5.779 8.956 -28.174 435 HD22 ASN 50 HD22 ASN 50 -7.141 8.454 -29.111 436 HA PRO 51 HA PRO 51 -10.686 13.865 -25.133 437 HB2 PRO 51 HB2 PRO 51 -11.609 14.678 -27.836 438 HB3 PRO 51 HB1 PRO 51 -11.543 15.621 -26.342 439 HG2 PRO 51 HG2 PRO 51 -9.778 16.076 -28.276 440 HG3 PRO 51 HG1 PRO 51 -9.260 16.071 -26.580 441 HD2 PRO 51 HD2 PRO 51 -8.993 13.911 -28.641 442 HD3 PRO 51 HD1 PRO 51 -7.782 14.526 -27.488 443 H GLN 52 HN GLN 52 -10.535 11.949 -28.041 444 HA GLN 52 HA GLN 52 -13.212 11.058 -28.144 445 HB2 GLN 52 HB2 GLN 52 -11.497 10.822 -29.980 446 HB3 GLN 52 HB1 GLN 52 -10.759 9.531 -29.037 447 HG2 GLN 52 HG2 GLN 52 -12.170 8.610 -30.763 448 HG3 GLN 52 HG1 GLN 52 -12.845 8.253 -29.174 449 HE21 GLN 52 HE21 GLN 52 -14.967 8.368 -29.194 450 HE22 GLN 52 HE22 GLN 52 -15.922 9.522 -30.055 451 H LEU 53 HN LEU 53 -10.339 9.819 -26.505 452 HA LEU 53 HA LEU 53 -11.675 7.474 -25.600 453 HB2 LEU 53 HB2 LEU 53 -9.098 8.758 -24.699 454 HB3 LEU 53 HB1 LEU 53 -9.699 7.243 -24.045 455 HG LEU 53 HG LEU 53 -9.061 7.717 -26.955 456 HD11 LEU 53 HD11 LEU 53 -6.930 7.270 -26.526 457 HD12 LEU 53 HD12 LEU 53 -7.372 5.795 -25.667 458 HD13 LEU 53 HD13 LEU 53 -7.292 7.330 -24.802 459 HD21 LEU 53 HD21 LEU 53 -9.018 5.045 -26.593 460 HD22 LEU 53 HD22 LEU 53 -10.424 5.950 -27.157 461 HD23 LEU 53 HD23 LEU 53 -10.285 5.506 -25.454 462 H ALA 54 HN ALA 54 -11.120 10.695 -24.323 463 HA ALA 54 HA ALA 54 -12.000 10.225 -21.682 464 HB1 ALA 54 HB1 ALA 54 -12.056 12.557 -21.425 465 HB2 ALA 54 HB2 ALA 54 -12.349 12.824 -23.144 466 HB3 ALA 54 HB3 ALA 54 -10.767 12.269 -22.595 467 H GLU 55 HN GLU 55 -13.604 11.181 -24.658 468 HA GLU 55 HA GLU 55 -16.217 11.501 -23.569 469 HB2 GLU 55 HB2 GLU 55 -15.522 12.474 -25.742 470 HB3 GLU 55 HB1 GLU 55 -15.407 10.852 -26.411 471 HG2 GLU 55 HG2 GLU 55 -17.799 10.522 -26.027 472 HG3 GLU 55 HG1 GLU 55 -17.915 12.148 -25.359 473 H GLU 56 HN GLU 56 -14.470 8.777 -24.970 474 HA GLU 56 HA GLU 56 -16.630 7.001 -25.191 475 HB2 GLU 56 HB2 GLU 56 -13.697 6.461 -24.681 476 HB3 GLU 56 HB1 GLU 56 -14.873 5.201 -25.022 477 HG2 GLU 56 HG2 GLU 56 -15.344 6.318 -27.198 478 HG3 GLU 56 HG1 GLU 56 -14.023 7.444 -26.852 479 H ASP 57 HN ASP 57 -14.442 7.658 -22.446 480 HA ASP 57 HA ASP 57 -16.139 5.912 -20.818 481 HB2 ASP 57 HB2 ASP 57 -13.498 5.869 -20.810 482 HB3 ASP 57 HB1 ASP 57 -13.666 7.258 -19.740 483 H LYS 58 HN LYS 58 -16.572 8.787 -21.805 484 HA LYS 58 HA LYS 58 -17.546 10.707 -21.104 485 HB2 LYS 58 HB2 LYS 58 -18.775 8.740 -19.181 486 HB3 LYS 58 HB1 LYS 58 -19.351 10.387 -19.402 487 HG2 LYS 58 HG2 LYS 58 -19.800 9.910 -21.765 488 HG3 LYS 58 HG1 LYS 58 -19.236 8.254 -21.530 489 HD2 LYS 58 HD2 LYS 58 -21.022 7.861 -19.914 490 HD3 LYS 58 HD1 LYS 58 -21.574 9.526 -20.106 491 HE2 LYS 58 HE2 LYS 58 -22.963 8.036 -21.414 492 HE3 LYS 58 HE1 LYS 58 -22.028 9.083 -22.481 493 HZ1 LYS 58 HZ1 LYS 58 -21.182 6.331 -21.777 494 HZ2 LYS 58 HZ2 LYS 58 -20.565 7.323 -23.000 495 HZ3 LYS 58 HZ3 LYS 58 -22.126 6.686 -23.136 496 H ILE 59 HN ILE 59 -15.068 10.863 -20.223 497 HA ILE 59 HA ILE 59 -15.028 11.367 -17.358 498 HB ILE 59 HB ILE 59 -12.874 11.841 -19.428 499 HG12 ILE 59 HG12 ILE 59 -13.487 9.481 -19.319 500 HG13 ILE 59 HG11 ILE 59 -11.895 9.734 -18.613 501 HG21 ILE 59 HG21 ILE 59 -11.967 11.340 -16.730 502 HG22 ILE 59 HG22 ILE 59 -13.033 12.743 -16.797 503 HG23 ILE 59 HG23 ILE 59 -11.593 12.682 -17.812 504 HD11 ILE 59 HD11 ILE 59 -13.325 9.900 -16.392 505 HD12 ILE 59 HD12 ILE 59 -12.781 8.356 -17.049 506 HD13 ILE 59 HD13 ILE 59 -14.432 8.904 -17.338 507 H LEU 60 HN LEU 60 -16.066 13.177 -16.742 508 HA LEU 60 HA LEU 60 -15.709 15.617 -18.339 509 HB2 LEU 60 HB2 LEU 60 -17.766 14.983 -16.224 510 HB3 LEU 60 HB1 LEU 60 -17.675 16.478 -17.132 511 HG LEU 60 HG LEU 60 -18.219 13.752 -18.317 512 HD11 LEU 60 HD11 LEU 60 -20.076 14.549 -16.957 513 HD12 LEU 60 HD12 LEU 60 -20.484 14.599 -18.672 514 HD13 LEU 60 HD13 LEU 60 -20.064 16.087 -17.821 515 HD21 LEU 60 HD21 LEU 60 -17.915 16.488 -19.504 516 HD22 LEU 60 HD22 LEU 60 -18.920 15.266 -20.282 517 HD23 LEU 60 HD23 LEU 60 -17.202 14.962 -20.025 518 H ALA 61 HN ALA 61 -14.471 14.181 -15.602 519 HA ALA 61 HA ALA 61 -13.501 16.766 -14.634 520 HB1 ALA 61 HB1 ALA 61 -15.555 15.768 -13.307 521 HB2 ALA 61 HB2 ALA 61 -14.214 16.549 -12.468 522 HB3 ALA 61 HB3 ALA 61 -14.296 14.787 -12.554 523 H THR 62 HN THR 62 -11.441 16.713 -13.836 524 HA THR 62 HA THR 62 -10.088 14.137 -13.550 525 HB THR 62 HB THR 62 -8.098 15.084 -14.709 526 HG1 THR 62 HG1 THR 62 -9.120 17.339 -14.417 527 HG21 THR 62 HG21 THR 62 -9.631 13.631 -15.959 528 HG22 THR 62 HG22 THR 62 -8.909 14.864 -16.999 529 HG23 THR 62 HG23 THR 62 -10.575 15.044 -16.436 530 HA PRO 63 HA PRO 63 -7.970 13.569 -13.162 531 HB2 PRO 63 HB2 PRO 63 -6.918 12.391 -10.981 532 HB3 PRO 63 HB1 PRO 63 -6.045 13.600 -11.926 533 HG2 PRO 63 HG2 PRO 63 -7.499 13.906 -9.338 534 HG3 PRO 63 HG1 PRO 63 -5.955 14.610 -9.856 535 HD2 PRO 63 HD2 PRO 63 -8.332 15.974 -9.870 536 HD3 PRO 63 HD1 PRO 63 -6.974 16.346 -10.948 537 H THR 64 HN THR 64 -8.782 11.506 -13.134 538 HA THR 64 HA THR 64 -11.000 10.966 -11.263 539 HB THR 64 HB THR 64 -11.197 9.480 -13.751 540 HG1 THR 64 HG1 THR 64 -11.694 12.248 -14.074 541 HG21 THR 64 HG21 THR 64 -13.474 10.867 -13.637 542 HG22 THR 64 HG22 THR 64 -12.943 11.087 -11.971 543 HG23 THR 64 HG23 THR 64 -13.172 9.459 -12.617 544 H LEU 65 HN LEU 65 -10.700 9.177 -10.077 545 HA LEU 65 HA LEU 65 -8.627 7.254 -10.930 546 HB2 LEU 65 HB2 LEU 65 -8.316 8.372 -8.737 547 HB3 LEU 65 HB1 LEU 65 -9.848 7.706 -8.202 548 HG LEU 65 HG LEU 65 -8.905 5.418 -8.486 549 HD11 LEU 65 HD11 LEU 65 -7.211 5.713 -10.100 550 HD12 LEU 65 HD12 LEU 65 -6.376 5.320 -8.597 551 HD13 LEU 65 HD13 LEU 65 -6.434 6.989 -9.165 552 HD21 LEU 65 HD21 LEU 65 -7.589 5.450 -6.477 553 HD22 LEU 65 HD22 LEU 65 -8.898 6.622 -6.312 554 HD23 LEU 65 HD23 LEU 65 -7.261 7.173 -6.667 555 H ALA 66 HN ALA 66 -9.410 5.435 -11.842 556 HA ALA 66 HA ALA 66 -11.821 4.241 -10.666 557 HB1 ALA 66 HB1 ALA 66 -12.172 5.670 -12.887 558 HB2 ALA 66 HB2 ALA 66 -13.053 4.171 -12.585 559 HB3 ALA 66 HB3 ALA 66 -11.634 4.162 -13.630 560 H LYS 67 HN LYS 67 -11.868 2.126 -10.574 561 HA LYS 67 HA LYS 67 -9.487 0.690 -11.469 562 HB2 LYS 67 HB2 LYS 67 -10.049 0.355 -9.136 563 HB3 LYS 67 HB1 LYS 67 -11.714 -0.018 -9.546 564 HG2 LYS 67 HG2 LYS 67 -11.025 -2.088 -10.610 565 HG3 LYS 67 HG1 LYS 67 -9.333 -1.705 -10.299 566 HD2 LYS 67 HD2 LYS 67 -9.828 -3.165 -8.576 567 HD3 LYS 67 HD1 LYS 67 -10.078 -1.597 -7.812 568 HE2 LYS 67 HE2 LYS 67 -11.842 -3.588 -7.634 569 HE3 LYS 67 HE1 LYS 67 -12.327 -1.897 -7.628 570 HZ1 LYS 67 HZ1 LYS 67 -12.373 -3.768 -9.941 571 HZ2 LYS 67 HZ2 LYS 67 -12.667 -2.107 -10.069 572 HZ3 LYS 67 HZ3 LYS 67 -13.703 -3.077 -9.155 573 H VAL 68 HN VAL 68 -9.760 0.050 -13.552 574 HA VAL 68 HA VAL 68 -12.375 -0.641 -14.536 575 HB VAL 68 HB VAL 68 -11.244 -1.070 -16.683 576 HG11 VAL 68 HG11 VAL 68 -11.950 1.240 -15.770 577 HG12 VAL 68 HG12 VAL 68 -10.935 1.165 -17.210 578 HG13 VAL 68 HG13 VAL 68 -10.217 1.539 -15.643 579 HG21 VAL 68 HG21 VAL 68 -9.036 -1.332 -16.915 580 HG22 VAL 68 HG22 VAL 68 -8.990 -1.500 -15.160 581 HG23 VAL 68 HG23 VAL 68 -8.682 0.067 -15.904 582 H LEU 69 HN LEU 69 -9.569 -2.314 -13.338 583 HA LEU 69 HA LEU 69 -11.048 -4.838 -13.716 584 HB2 LEU 69 HB2 LEU 69 -8.114 -4.454 -14.326 585 HB3 LEU 69 HB1 LEU 69 -8.916 -6.008 -14.248 586 HG LEU 69 HG LEU 69 -9.631 -3.832 -16.218 587 HD11 LEU 69 HD11 LEU 69 -7.692 -4.418 -17.185 588 HD12 LEU 69 HD12 LEU 69 -8.579 -5.859 -17.682 589 HD13 LEU 69 HD13 LEU 69 -7.555 -5.906 -16.248 590 HD21 LEU 69 HD21 LEU 69 -11.504 -5.243 -15.879 591 HD22 LEU 69 HD22 LEU 69 -10.501 -6.693 -15.883 592 HD23 LEU 69 HD23 LEU 69 -10.737 -5.781 -17.373 593 HA PRO 70 HA PRO 70 -10.996 -6.846 -13.136 594 HB2 PRO 70 HB2 PRO 70 -12.228 -8.318 -11.269 595 HB3 PRO 70 HB1 PRO 70 -10.511 -8.543 -11.630 596 HG2 PRO 70 HG2 PRO 70 -11.792 -7.014 -9.389 597 HG3 PRO 70 HG1 PRO 70 -10.421 -8.139 -9.332 598 HD2 PRO 70 HD2 PRO 70 -10.135 -5.423 -9.394 599 HD3 PRO 70 HD1 PRO 70 -8.927 -6.547 -10.044 600 HA PRO 71 HA PRO 71 -14.921 -4.752 -13.325 601 HB2 PRO 71 HB2 PRO 71 -16.080 -7.398 -14.032 602 HB3 PRO 71 HB1 PRO 71 -16.144 -5.871 -14.920 603 HG2 PRO 71 HG2 PRO 71 -14.565 -7.828 -15.758 604 HG3 PRO 71 HG1 PRO 71 -14.004 -6.144 -15.800 605 HD2 PRO 71 HD2 PRO 71 -13.359 -8.303 -13.822 606 HD3 PRO 71 HD1 PRO 71 -12.283 -7.112 -14.576 607 HA PRO 72 HA PRO 72 -17.160 -4.276 -13.349 608 HB2 PRO 72 HB2 PRO 72 -18.649 -2.685 -11.790 609 HB3 PRO 72 HB1 PRO 72 -19.232 -4.267 -12.324 610 HG2 PRO 72 HG2 PRO 72 -18.004 -3.491 -9.700 611 HG3 PRO 72 HG1 PRO 72 -19.446 -4.478 -10.005 612 HD2 PRO 72 HD2 PRO 72 -17.001 -5.547 -9.455 613 HD3 PRO 72 HD1 PRO 72 -18.209 -6.363 -10.468 614 H VAL 73 HN VAL 73 -16.926 -1.930 -13.612 615 HA VAL 73 HA VAL 73 -14.387 -1.026 -12.677 616 HB VAL 73 HB VAL 73 -16.530 0.464 -14.209 617 HG11 VAL 73 HG11 VAL 73 -15.154 2.135 -13.327 618 HG12 VAL 73 HG12 VAL 73 -14.504 1.850 -14.941 619 HG13 VAL 73 HG13 VAL 73 -13.694 1.168 -13.531 620 HG21 VAL 73 HG21 VAL 73 -15.958 -0.845 -15.915 621 HG22 VAL 73 HG22 VAL 73 -14.661 -1.590 -14.980 622 HG23 VAL 73 HG23 VAL 73 -14.362 -0.098 -15.874 623 H ARG 74 HN ARG 74 -13.917 0.145 -10.943 624 HA ARG 74 HA ARG 74 -16.124 1.375 -9.417 625 HB2 ARG 74 HB2 ARG 74 -15.071 -0.379 -8.150 626 HB3 ARG 74 HB1 ARG 74 -13.475 0.219 -8.551 627 HG2 ARG 74 HG2 ARG 74 -13.857 0.816 -6.307 628 HG3 ARG 74 HG1 ARG 74 -14.016 2.295 -7.248 629 HD2 ARG 74 HD2 ARG 74 -16.536 0.824 -6.855 630 HD3 ARG 74 HD1 ARG 74 -15.799 1.428 -5.374 631 HE ARG 74 HE ARG 74 -15.752 3.535 -7.141 632 HH11 ARG 74 HH11 ARG 74 -18.185 1.490 -5.715 633 HH12 ARG 74 HH12 ARG 74 -19.410 2.715 -5.727 634 HH21 ARG 74 HH21 ARG 74 -17.343 5.158 -7.160 635 HH22 ARG 74 HH22 ARG 74 -18.931 4.809 -6.553 636 H ARG 75 HN ARG 75 -16.207 3.521 -9.538 637 HA ARG 75 HA ARG 75 -13.738 4.967 -10.164 638 HB2 ARG 75 HB2 ARG 75 -16.626 5.771 -10.403 639 HB3 ARG 75 HB1 ARG 75 -15.293 6.903 -10.583 640 HG2 ARG 75 HG2 ARG 75 -14.439 5.660 -12.465 641 HG3 ARG 75 HG1 ARG 75 -15.707 4.445 -12.268 642 HD2 ARG 75 HD2 ARG 75 -16.217 7.362 -12.792 643 HD3 ARG 75 HD1 ARG 75 -16.133 6.137 -14.057 644 HE ARG 75 HE ARG 75 -17.992 5.267 -12.181 645 HH11 ARG 75 HH11 ARG 75 -17.598 7.891 -14.435 646 HH12 ARG 75 HH12 ARG 75 -19.298 8.109 -14.686 647 HH21 ARG 75 HH21 ARG 75 -20.234 5.537 -12.500 648 HH22 ARG 75 HH22 ARG 75 -20.802 6.766 -13.583 649 H ILE 76 HN ILE 76 -12.697 5.908 -8.611 650 HA ILE 76 HA ILE 76 -14.079 6.545 -6.099 651 HB ILE 76 HB ILE 76 -11.124 6.323 -6.667 652 HG12 ILE 76 HG12 ILE 76 -12.982 4.446 -5.184 653 HG13 ILE 76 HG11 ILE 76 -12.384 4.187 -6.821 654 HG21 ILE 76 HG21 ILE 76 -10.984 6.274 -4.145 655 HG22 ILE 76 HG22 ILE 76 -12.661 6.822 -4.123 656 HG23 ILE 76 HG23 ILE 76 -11.412 7.832 -4.852 657 HD11 ILE 76 HD11 ILE 76 -10.512 4.551 -4.531 658 HD12 ILE 76 HD12 ILE 76 -10.225 3.794 -6.098 659 HD13 ILE 76 HD13 ILE 76 -11.229 2.982 -4.894 660 H ILE 77 HN ILE 77 -14.700 8.617 -5.885 661 HA ILE 77 HA ILE 77 -13.047 10.708 -7.138 662 HB ILE 77 HB ILE 77 -16.021 10.840 -6.656 663 HG12 ILE 77 HG12 ILE 77 -15.480 11.010 -9.403 664 HG13 ILE 77 HG11 ILE 77 -14.485 9.680 -8.818 665 HG21 ILE 77 HG21 ILE 77 -14.525 12.970 -6.690 666 HG22 ILE 77 HG22 ILE 77 -16.028 12.944 -7.611 667 HG23 ILE 77 HG23 ILE 77 -14.486 12.690 -8.432 668 HD11 ILE 77 HD11 ILE 77 -16.756 9.046 -9.646 669 HD12 ILE 77 HD12 ILE 77 -17.426 9.906 -8.259 670 HD13 ILE 77 HD13 ILE 77 -16.375 8.511 -8.008 671 H GLY 78 HN GLY 78 -12.202 12.190 -5.813 672 HA2 GLY 78 HA2 GLY 78 -13.373 13.440 -3.659 673 HA3 GLY 78 HA1 GLY 78 -12.595 12.010 -2.991 674 H ASP 79 HN ASP 79 -11.230 13.505 -1.795 675 HA ASP 79 HA ASP 79 -9.393 15.171 -3.277 676 HB2 ASP 79 HB2 ASP 79 -10.204 15.762 -0.978 677 HB3 ASP 79 HB1 ASP 79 -9.293 14.391 -0.351 678 H LEU 80 HN LEU 80 -8.393 13.682 -4.640 679 HA LEU 80 HA LEU 80 -7.073 11.349 -3.674 680 HB2 LEU 80 HB2 LEU 80 -6.805 12.834 -6.290 681 HB3 LEU 80 HB1 LEU 80 -6.071 11.278 -5.956 682 HG LEU 80 HG LEU 80 -9.044 11.807 -5.963 683 HD11 LEU 80 HD11 LEU 80 -7.140 10.846 -8.057 684 HD12 LEU 80 HD12 LEU 80 -8.473 11.995 -8.194 685 HD13 LEU 80 HD13 LEU 80 -8.808 10.270 -8.041 686 HD21 LEU 80 HD21 LEU 80 -8.778 9.968 -4.590 687 HD22 LEU 80 HD22 LEU 80 -7.352 9.396 -5.456 688 HD23 LEU 80 HD23 LEU 80 -8.952 9.215 -6.177 689 H SER 81 HN SER 81 -6.203 14.639 -3.690 690 HA SER 81 HA SER 81 -3.398 14.380 -3.993 691 HB2 SER 81 HB2 SER 81 -5.009 16.521 -2.575 692 HB3 SER 81 HB1 SER 81 -3.299 16.642 -2.992 693 HG SER 81 HG SER 81 -3.809 17.048 -4.992 694 H ASN 82 HN ASN 82 -5.552 13.675 -1.435 695 HA ASN 82 HA ASN 82 -3.528 13.716 0.638 696 HB2 ASN 82 HB2 ASN 82 -5.873 14.302 1.166 697 HB3 ASN 82 HB1 ASN 82 -6.363 12.683 0.699 698 HD21 ASN 82 HD21 ASN 82 -7.214 13.113 3.019 699 HD22 ASN 82 HD22 ASN 82 -6.217 12.496 4.287 700 H ARG 83 HN ARG 83 -2.111 12.137 0.823 701 HA ARG 83 HA ARG 83 -2.190 9.803 -0.679 702 HB2 ARG 83 HB2 ARG 83 -0.554 10.527 1.756 703 HB3 ARG 83 HB1 ARG 83 -0.342 8.998 0.919 704 HG2 ARG 83 HG2 ARG 83 1.263 10.184 -0.143 705 HG3 ARG 83 HG1 ARG 83 -0.100 10.631 -1.171 706 HD2 ARG 83 HD2 ARG 83 1.142 12.612 -0.603 707 HD3 ARG 83 HD1 ARG 83 -0.422 12.661 0.206 708 HE ARG 83 HE ARG 83 1.531 11.522 1.906 709 HH11 ARG 83 HH11 ARG 83 0.510 14.568 0.567 710 HH12 ARG 83 HH12 ARG 83 1.121 15.506 1.888 711 HH21 ARG 83 HH21 ARG 83 2.342 12.740 3.655 712 HH22 ARG 83 HH22 ARG 83 2.168 14.463 3.650 713 H GLU 84 HN GLU 84 -3.337 10.380 2.599 714 HA GLU 84 HA GLU 84 -3.670 7.699 3.384 715 HB2 GLU 84 HB2 GLU 84 -5.113 10.216 4.168 716 HB3 GLU 84 HB1 GLU 84 -5.507 8.649 4.865 717 HG2 GLU 84 HG2 GLU 84 -3.341 8.426 5.797 718 HG3 GLU 84 HG1 GLU 84 -2.748 9.838 4.920 719 H LYS 85 HN LYS 85 -5.950 9.845 1.623 720 HA LYS 85 HA LYS 85 -8.005 7.891 1.604 721 HB2 LYS 85 HB2 LYS 85 -7.506 10.279 -0.186 722 HB3 LYS 85 HB1 LYS 85 -8.904 9.229 -0.385 723 HG2 LYS 85 HG2 LYS 85 -9.656 9.810 1.865 724 HG3 LYS 85 HG1 LYS 85 -8.257 10.866 2.060 725 HD2 LYS 85 HD2 LYS 85 -9.016 12.162 0.079 726 HD3 LYS 85 HD1 LYS 85 -10.451 11.139 0.006 727 HE2 LYS 85 HE2 LYS 85 -9.672 12.876 2.346 728 HE3 LYS 85 HE1 LYS 85 -10.893 13.279 1.138 729 HZ1 LYS 85 HZ1 LYS 85 -11.769 10.904 1.927 730 HZ2 LYS 85 HZ2 LYS 85 -12.248 12.351 2.660 731 HZ3 LYS 85 HZ3 LYS 85 -11.028 11.412 3.361 732 H VAL 86 HN VAL 86 -5.430 8.601 -0.702 733 HA VAL 86 HA VAL 86 -6.275 6.736 -2.643 734 HB VAL 86 HB VAL 86 -3.523 7.846 -2.048 735 HG11 VAL 86 HG11 VAL 86 -2.897 5.975 -3.208 736 HG12 VAL 86 HG12 VAL 86 -3.246 7.063 -4.552 737 HG13 VAL 86 HG13 VAL 86 -4.434 5.855 -4.065 738 HG21 VAL 86 HG21 VAL 86 -4.306 8.818 -4.454 739 HG22 VAL 86 HG22 VAL 86 -4.560 9.648 -2.919 740 HG23 VAL 86 HG23 VAL 86 -5.858 8.687 -3.628 741 H LEU 87 HN LEU 87 -4.021 6.419 0.096 742 HA LEU 87 HA LEU 87 -3.346 3.706 -0.382 743 HB2 LEU 87 HB2 LEU 87 -1.914 5.084 0.976 744 HB3 LEU 87 HB1 LEU 87 -3.228 5.463 2.070 745 HG LEU 87 HG LEU 87 -3.257 3.109 2.810 746 HD11 LEU 87 HD11 LEU 87 -2.390 1.702 1.265 747 HD12 LEU 87 HD12 LEU 87 -0.921 1.975 2.203 748 HD13 LEU 87 HD13 LEU 87 -1.192 2.871 0.710 749 HD21 LEU 87 HD21 LEU 87 -1.408 3.309 4.262 750 HD22 LEU 87 HD22 LEU 87 -1.922 4.959 3.904 751 HD23 LEU 87 HD23 LEU 87 -0.504 4.280 3.100 752 H ILE 88 HN ILE 88 -5.751 5.187 1.771 753 HA ILE 88 HA ILE 88 -6.649 2.763 2.891 754 HB ILE 88 HB ILE 88 -7.970 5.450 2.614 755 HG12 ILE 88 HG12 ILE 88 -6.967 3.997 5.065 756 HG13 ILE 88 HG11 ILE 88 -5.948 5.061 4.103 757 HG21 ILE 88 HG21 ILE 88 -9.570 4.540 4.379 758 HG22 ILE 88 HG22 ILE 88 -9.044 2.937 3.864 759 HG23 ILE 88 HG23 ILE 88 -9.832 4.019 2.714 760 HD11 ILE 88 HD11 ILE 88 -7.896 5.699 6.128 761 HD12 ILE 88 HD12 ILE 88 -8.200 6.574 4.627 762 HD13 ILE 88 HD13 ILE 88 -6.627 6.700 5.419 763 H ALA 89 HN ALA 89 -7.866 4.620 0.095 764 HA ALA 89 HA ALA 89 -10.021 2.890 -0.480 765 HB1 ALA 89 HB1 ALA 89 -10.459 4.291 -2.181 766 HB2 ALA 89 HB2 ALA 89 -8.805 4.229 -2.790 767 HB3 ALA 89 HB3 ALA 89 -9.210 5.294 -1.442 768 H LEU 90 HN LEU 90 -6.663 2.894 -1.660 769 HA LEU 90 HA LEU 90 -7.036 0.759 -3.496 770 HB2 LEU 90 HB2 LEU 90 -4.551 1.808 -2.145 771 HB3 LEU 90 HB1 LEU 90 -4.520 0.508 -3.318 772 HG LEU 90 HG LEU 90 -5.548 3.284 -3.895 773 HD11 LEU 90 HD11 LEU 90 -2.856 2.232 -3.732 774 HD12 LEU 90 HD12 LEU 90 -3.411 3.894 -3.953 775 HD13 LEU 90 HD13 LEU 90 -3.230 2.833 -5.349 776 HD21 LEU 90 HD21 LEU 90 -5.242 0.777 -5.485 777 HD22 LEU 90 HD22 LEU 90 -5.006 2.334 -6.281 778 HD23 LEU 90 HD23 LEU 90 -6.543 1.970 -5.496 779 H ARG 91 HN ARG 91 -6.188 0.888 -0.073 780 HA ARG 91 HA ARG 91 -5.455 -1.840 0.226 781 HB2 ARG 91 HB2 ARG 91 -4.969 0.093 1.814 782 HB3 ARG 91 HB1 ARG 91 -6.633 -0.059 2.355 783 HG2 ARG 91 HG2 ARG 91 -5.190 -2.589 2.378 784 HG3 ARG 91 HG1 ARG 91 -4.472 -1.361 3.421 785 HD2 ARG 91 HD2 ARG 91 -7.408 -2.006 3.462 786 HD3 ARG 91 HD1 ARG 91 -6.236 -2.865 4.462 787 HE ARG 91 HE ARG 91 -5.927 -0.097 4.840 788 HH11 ARG 91 HH11 ARG 91 -8.150 -2.685 5.544 789 HH12 ARG 91 HH12 ARG 91 -8.789 -1.925 6.964 790 HH21 ARG 91 HH21 ARG 91 -6.754 0.913 6.710 791 HH22 ARG 91 HH22 ARG 91 -7.992 0.126 7.630 792 H LEU 92 HN LEU 92 -8.522 -0.097 0.731 793 HA LEU 92 HA LEU 92 -9.988 -2.347 1.588 794 HB2 LEU 92 HB2 LEU 92 -10.614 0.386 0.682 795 HB3 LEU 92 HB1 LEU 92 -11.895 -0.784 0.432 796 HG LEU 92 HG LEU 92 -12.050 -1.250 2.771 797 HD11 LEU 92 HD11 LEU 92 -9.489 0.294 2.964 798 HD12 LEU 92 HD12 LEU 92 -9.862 -1.323 3.563 799 HD13 LEU 92 HD13 LEU 92 -10.551 0.093 4.360 800 HD21 LEU 92 HD21 LEU 92 -11.697 1.730 2.581 801 HD22 LEU 92 HD22 LEU 92 -12.815 0.824 3.601 802 HD23 LEU 92 HD23 LEU 92 -13.060 0.877 1.856 803 H LEU 93 HN LEU 93 -9.417 -1.012 -1.633 804 HA LEU 93 HA LEU 93 -11.207 -2.733 -3.003 805 HB2 LEU 93 HB2 LEU 93 -8.728 -1.288 -3.929 806 HB3 LEU 93 HB1 LEU 93 -9.750 -2.221 -5.002 807 HG LEU 93 HG LEU 93 -10.694 0.163 -3.409 808 HD11 LEU 93 HD11 LEU 93 -9.461 1.307 -4.895 809 HD12 LEU 93 HD12 LEU 93 -10.775 0.923 -6.006 810 HD13 LEU 93 HD13 LEU 93 -9.315 -0.065 -5.993 811 HD21 LEU 93 HD21 LEU 93 -12.741 -0.421 -4.042 812 HD22 LEU 93 HD22 LEU 93 -12.089 -1.895 -4.761 813 HD23 LEU 93 HD23 LEU 93 -12.237 -0.429 -5.732 814 H ALA 94 HN ALA 94 -7.811 -2.960 -2.104 815 HA ALA 94 HA ALA 94 -7.195 -5.320 -3.503 816 HB1 ALA 94 HB1 ALA 94 -5.145 -5.235 -2.503 817 HB2 ALA 94 HB2 ALA 94 -5.803 -4.735 -0.943 818 HB3 ALA 94 HB3 ALA 94 -5.668 -3.568 -2.261 819 H GLU 95 HN GLU 95 -8.526 -4.792 -0.271 820 HA GLU 95 HA GLU 95 -8.301 -7.431 0.658 821 HB2 GLU 95 HB2 GLU 95 -10.251 -5.212 1.296 822 HB3 GLU 95 HB1 GLU 95 -10.260 -6.757 2.137 823 HG2 GLU 95 HG2 GLU 95 -8.069 -6.368 3.010 824 HG3 GLU 95 HG1 GLU 95 -7.874 -4.928 2.011 825 H GLU 96 HN GLU 96 -10.757 -5.783 -1.251 826 HA GLU 96 HA GLU 96 -12.662 -7.863 -1.329 827 HB2 GLU 96 HB2 GLU 96 -12.065 -5.587 -3.235 828 HB3 GLU 96 HB1 GLU 96 -13.437 -6.672 -3.430 829 HG2 GLU 96 HG2 GLU 96 -12.934 -4.864 -1.073 830 HG3 GLU 96 HG1 GLU 96 -14.102 -4.592 -2.365 831 H ILE 97 HN ILE 97 -9.926 -7.036 -3.383 832 HA ILE 97 HA ILE 97 -10.357 -9.011 -5.374 833 HB ILE 97 HB ILE 97 -7.846 -7.521 -4.587 834 HG12 ILE 97 HG12 ILE 97 -9.759 -7.039 -6.875 835 HG13 ILE 97 HG11 ILE 97 -9.856 -6.205 -5.325 836 HG21 ILE 97 HG21 ILE 97 -8.315 -8.792 -7.264 837 HG22 ILE 97 HG22 ILE 97 -7.605 -9.717 -5.941 838 HG23 ILE 97 HG23 ILE 97 -6.797 -8.264 -6.534 839 HD11 ILE 97 HD11 ILE 97 -8.528 -5.295 -7.479 840 HD12 ILE 97 HD12 ILE 97 -7.233 -6.108 -6.598 841 HD13 ILE 97 HD13 ILE 97 -8.178 -4.840 -5.812 842 H GLY 98 HN GLY 98 -8.296 -8.881 -2.490 843 HA2 GLY 98 HA2 GLY 98 -7.013 -11.364 -2.815 844 HA3 GLY 98 HA1 GLY 98 -7.219 -10.516 -1.291 845 H ASP 99 HN ASP 99 -10.090 -10.527 -1.350 846 HA ASP 99 HA ASP 99 -10.619 -12.952 -0.037 847 HB2 ASP 99 HB2 ASP 99 -11.885 -10.847 0.325 848 HB3 ASP 99 HB1 ASP 99 -12.623 -11.046 -1.263 849 H TYR 100 HN TYR 100 -11.225 -11.949 -3.369 850 HA TYR 100 HA TYR 100 -12.788 -14.208 -4.073 851 HB2 TYR 100 HB2 TYR 100 -12.925 -12.123 -5.348 852 HB3 TYR 100 HB1 TYR 100 -11.232 -12.269 -5.804 853 HD1 TYR 100 HD1 TYR 100 -14.531 -13.961 -6.142 854 HD2 TYR 100 HD2 TYR 100 -10.630 -13.415 -7.757 855 HE1 TYR 100 HE1 TYR 100 -15.188 -15.223 -8.147 856 HE2 TYR 100 HE2 TYR 100 -11.280 -14.676 -9.765 857 HH TYR 100 HH TYR 100 -13.429 -16.663 -10.074 858 H LYS 101 HN LYS 101 -12.154 -16.179 -4.489 859 HA LYS 101 HA LYS 101 -9.301 -16.687 -4.982 860 HB2 LYS 101 HB2 LYS 101 -11.374 -18.589 -3.863 861 HB3 LYS 101 HB1 LYS 101 -9.660 -18.927 -4.059 862 HG2 LYS 101 HG2 LYS 101 -10.840 -16.846 -2.226 863 HG3 LYS 101 HG1 LYS 101 -10.230 -18.428 -1.740 864 HD2 LYS 101 HD2 LYS 101 -7.998 -17.799 -2.570 865 HD3 LYS 101 HD1 LYS 101 -8.623 -16.204 -2.997 866 HE2 LYS 101 HE2 LYS 101 -9.201 -15.819 -0.640 867 HE3 LYS 101 HE1 LYS 101 -8.528 -17.396 -0.227 868 HZ1 LYS 101 HZ1 LYS 101 -7.139 -14.940 -1.053 869 HZ2 LYS 101 HZ2 LYS 101 -6.421 -16.442 -1.366 870 HZ3 LYS 101 HZ3 LYS 101 -6.787 -15.996 0.224 871 H ASP 102 HN ASP 102 -8.686 -18.077 -6.640 872 HA ASP 102 HA ASP 102 -10.294 -18.126 -8.950 873 HB2 ASP 102 HB2 ASP 102 -7.842 -18.218 -9.047 874 HB3 ASP 102 HB1 ASP 102 -7.865 -19.813 -8.303 875 H ASP 103 HN ASP 103 -9.562 -20.643 -6.565 876 HA ASP 103 HA ASP 103 -11.404 -22.478 -7.899 877 HB2 ASP 103 HB2 ASP 103 -9.186 -23.302 -7.084 878 HB3 ASP 103 HB1 ASP 103 -9.700 -22.945 -5.439 879 H ASP 104 HN ASP 104 -13.476 -22.136 -7.437 880 HA ASP 104 HA ASP 104 -14.441 -20.831 -5.127 881 HB2 ASP 104 HB2 ASP 104 -15.640 -20.982 -7.326 882 HB3 ASP 104 HB1 ASP 104 -16.006 -22.664 -6.953 883 H ASP 105 HN ASP 105 -13.796 -24.192 -5.812 884 HA ASP 105 HA ASP 105 -15.252 -25.103 -3.461 885 HB2 ASP 105 HB2 ASP 105 -15.223 -26.463 -5.549 886 HB3 ASP 105 HB1 ASP 105 -13.486 -26.673 -5.355 887 H LYS 106 HN LYS 106 -14.269 -24.502 -1.610 888 HA LYS 106 HA LYS 106 -11.574 -25.522 -1.139 889 HB2 LYS 106 HB2 LYS 106 -10.863 -23.427 -0.069 890 HB3 LYS 106 HB1 LYS 106 -11.233 -23.190 -1.770 891 HG2 LYS 106 HG2 LYS 106 -13.424 -22.263 -1.149 892 HG3 LYS 106 HG1 LYS 106 -13.009 -22.463 0.555 893 HD2 LYS 106 HD2 LYS 106 -11.068 -20.967 0.222 894 HD3 LYS 106 HD1 LYS 106 -11.576 -20.721 -1.450 895 HE2 LYS 106 HE2 LYS 106 -13.205 -20.043 0.998 896 HE3 LYS 106 HE1 LYS 106 -12.300 -18.888 0.018 897 HZ1 LYS 106 HZ1 LYS 106 -14.892 -19.965 -0.416 898 HZ2 LYS 106 HZ2 LYS 106 -13.897 -20.269 -1.749 899 HZ3 LYS 106 HZ3 LYS 106 -14.120 -18.682 -1.206 Start of MODEL 4 1 H1 MET 1 HT1 MET 1 -18.664 -13.447 -18.759 2 H2 MET 1 HT2 MET 1 -17.977 -11.917 -18.547 3 H3 MET 1 HT3 MET 1 -17.241 -13.276 -17.859 4 HA MET 1 HA MET 1 -16.845 -14.177 -20.092 5 HB2 MET 1 HB2 MET 1 -17.965 -11.481 -20.869 6 HB3 MET 1 HB1 MET 1 -17.001 -12.469 -21.961 7 HG2 MET 1 HG2 MET 1 -18.652 -14.249 -21.832 8 HG3 MET 1 HG1 MET 1 -19.609 -13.294 -20.701 9 HE1 MET 1 HE1 MET 1 -21.508 -13.982 -22.301 10 HE2 MET 1 HE2 MET 1 -20.678 -14.502 -23.767 11 HE3 MET 1 HE3 MET 1 -21.858 -13.191 -23.838 12 H ALA 2 HN ALA 2 -16.093 -11.760 -17.984 13 HA ALA 2 HA ALA 2 -13.527 -11.146 -19.283 14 HB1 ALA 2 HB1 ALA 2 -14.458 -9.712 -16.841 15 HB2 ALA 2 HB2 ALA 2 -15.202 -9.336 -18.396 16 HB3 ALA 2 HB3 ALA 2 -13.464 -9.132 -18.178 17 HA PRO 3 HA PRO 3 -11.846 -14.182 -16.385 18 HB2 PRO 3 HB2 PRO 3 -9.330 -13.121 -17.571 19 HB3 PRO 3 HB1 PRO 3 -9.873 -14.795 -17.398 20 HG2 PRO 3 HG2 PRO 3 -9.926 -13.626 -19.777 21 HG3 PRO 3 HG1 PRO 3 -11.269 -14.669 -19.264 22 HD2 PRO 3 HD2 PRO 3 -11.106 -11.671 -19.304 23 HD3 PRO 3 HD1 PRO 3 -12.443 -12.732 -19.800 24 H LEU 4 HN LEU 4 -10.920 -14.035 -14.386 25 HA LEU 4 HA LEU 4 -10.191 -11.327 -13.512 26 HB2 LEU 4 HB2 LEU 4 -11.066 -13.678 -11.828 27 HB3 LEU 4 HB1 LEU 4 -10.787 -12.043 -11.262 28 HG LEU 4 HG LEU 4 -12.978 -12.921 -13.143 29 HD11 LEU 4 HD11 LEU 4 -13.078 -11.970 -10.287 30 HD12 LEU 4 HD12 LEU 4 -13.361 -13.618 -10.849 31 HD13 LEU 4 HD13 LEU 4 -14.472 -12.326 -11.306 32 HD21 LEU 4 HD21 LEU 4 -13.737 -10.485 -12.506 33 HD22 LEU 4 HD22 LEU 4 -12.641 -10.780 -13.857 34 HD23 LEU 4 HD23 LEU 4 -12.003 -10.241 -12.303 35 H ARG 5 HN ARG 5 -8.249 -10.926 -12.603 36 HA ARG 5 HA ARG 5 -6.433 -13.193 -12.163 37 HB2 ARG 5 HB2 ARG 5 -5.752 -10.584 -13.539 38 HB3 ARG 5 HB1 ARG 5 -4.576 -11.802 -13.069 39 HG2 ARG 5 HG2 ARG 5 -4.848 -12.407 -15.233 40 HG3 ARG 5 HG1 ARG 5 -6.169 -13.348 -14.535 41 HD2 ARG 5 HD2 ARG 5 -7.087 -12.263 -16.412 42 HD3 ARG 5 HD1 ARG 5 -7.655 -11.352 -15.013 43 HE ARG 5 HE ARG 5 -5.253 -10.255 -16.077 44 HH11 ARG 5 HH11 ARG 5 -8.704 -10.420 -16.548 45 HH12 ARG 5 HH12 ARG 5 -8.788 -8.919 -17.412 46 HH21 ARG 5 HH21 ARG 5 -5.350 -8.281 -17.211 47 HH22 ARG 5 HH22 ARG 5 -6.876 -7.701 -17.790 48 H LYS 6 HN LYS 6 -4.587 -12.656 -10.748 49 HA LYS 6 HA LYS 6 -5.422 -11.447 -8.361 50 HB2 LYS 6 HB2 LYS 6 -2.698 -12.262 -9.332 51 HB3 LYS 6 HB1 LYS 6 -2.985 -11.626 -7.716 52 HG2 LYS 6 HG2 LYS 6 -4.786 -13.513 -7.603 53 HG3 LYS 6 HG1 LYS 6 -3.830 -14.227 -8.904 54 HD2 LYS 6 HD2 LYS 6 -2.648 -13.322 -6.290 55 HD3 LYS 6 HD1 LYS 6 -3.240 -14.960 -6.559 56 HE2 LYS 6 HE2 LYS 6 -1.052 -13.590 -8.128 57 HE3 LYS 6 HE1 LYS 6 -0.819 -14.814 -6.884 58 HZ1 LYS 6 HZ1 LYS 6 -2.559 -15.991 -8.595 59 HZ2 LYS 6 HZ2 LYS 6 -0.888 -16.256 -8.559 60 HZ3 LYS 6 HZ3 LYS 6 -1.544 -15.133 -9.641 61 H THR 7 HN THR 7 -3.433 -10.252 -10.987 62 HA THR 7 HA THR 7 -2.889 -7.762 -9.642 63 HB THR 7 HB THR 7 -2.170 -7.222 -12.170 64 HG1 THR 7 HG1 THR 7 -2.772 -9.129 -13.118 65 HG21 THR 7 HG21 THR 7 -0.387 -7.025 -10.801 66 HG22 THR 7 HG22 THR 7 0.019 -8.628 -11.418 67 HG23 THR 7 HG23 THR 7 -0.813 -8.464 -9.871 68 H ALA 8 HN ALA 8 -4.158 -6.077 -9.615 69 HA ALA 8 HA ALA 8 -6.454 -5.965 -11.428 70 HB1 ALA 8 HB1 ALA 8 -7.530 -4.642 -9.846 71 HB2 ALA 8 HB2 ALA 8 -6.014 -4.141 -9.095 72 HB3 ALA 8 HB3 ALA 8 -6.610 -5.785 -8.864 73 H VAL 9 HN VAL 9 -7.030 -4.011 -12.496 74 HA VAL 9 HA VAL 9 -4.679 -2.347 -13.103 75 HB VAL 9 HB VAL 9 -7.049 -2.948 -14.876 76 HG11 VAL 9 HG11 VAL 9 -5.334 -1.850 -16.569 77 HG12 VAL 9 HG12 VAL 9 -4.772 -1.032 -15.111 78 HG13 VAL 9 HG13 VAL 9 -6.450 -0.860 -15.629 79 HG21 VAL 9 HG21 VAL 9 -4.289 -3.676 -15.651 80 HG22 VAL 9 HG22 VAL 9 -5.811 -4.518 -15.948 81 HG23 VAL 9 HG23 VAL 9 -5.031 -4.634 -14.370 82 H LEU 10 HN LEU 10 -4.796 -0.305 -12.542 83 HA LEU 10 HA LEU 10 -7.430 0.886 -11.923 84 HB2 LEU 10 HB2 LEU 10 -4.990 0.744 -10.412 85 HB3 LEU 10 HB1 LEU 10 -5.335 2.420 -10.778 86 HG LEU 10 HG LEU 10 -6.191 1.713 -8.572 87 HD11 LEU 10 HD11 LEU 10 -8.208 2.547 -10.639 88 HD12 LEU 10 HD12 LEU 10 -7.293 3.566 -9.529 89 HD13 LEU 10 HD13 LEU 10 -8.559 2.503 -8.909 90 HD21 LEU 10 HD21 LEU 10 -6.707 -0.598 -9.059 91 HD22 LEU 10 HD22 LEU 10 -7.981 -0.104 -10.171 92 HD23 LEU 10 HD23 LEU 10 -8.136 0.233 -8.447 93 H LYS 11 HN LYS 11 -7.966 2.759 -13.063 94 HA LYS 11 HA LYS 11 -5.816 3.766 -14.798 95 HB2 LYS 11 HB2 LYS 11 -8.767 3.552 -15.406 96 HB3 LYS 11 HB1 LYS 11 -7.652 4.527 -16.357 97 HG2 LYS 11 HG2 LYS 11 -6.355 2.513 -16.873 98 HG3 LYS 11 HG1 LYS 11 -7.514 1.546 -15.963 99 HD2 LYS 11 HD2 LYS 11 -9.292 2.229 -17.488 100 HD3 LYS 11 HD1 LYS 11 -8.151 3.235 -18.382 101 HE2 LYS 11 HE2 LYS 11 -6.856 1.249 -18.968 102 HE3 LYS 11 HE1 LYS 11 -7.985 0.240 -18.066 103 HZ1 LYS 11 HZ1 LYS 11 -9.419 1.815 -19.901 104 HZ2 LYS 11 HZ2 LYS 11 -9.277 0.132 -19.844 105 HZ3 LYS 11 HZ3 LYS 11 -8.158 1.045 -20.725 106 H LEU 12 HN LEU 12 -5.303 5.808 -14.619 107 HA LEU 12 HA LEU 12 -7.035 7.495 -12.959 108 HB2 LEU 12 HB2 LEU 12 -4.319 6.942 -12.732 109 HB3 LEU 12 HB1 LEU 12 -4.358 8.533 -13.466 110 HG LEU 12 HG LEU 12 -5.666 7.761 -10.855 111 HD11 LEU 12 HD11 LEU 12 -3.183 7.898 -10.836 112 HD12 LEU 12 HD12 LEU 12 -3.977 9.085 -9.802 113 HD13 LEU 12 HD13 LEU 12 -3.318 9.575 -11.363 114 HD21 LEU 12 HD21 LEU 12 -5.703 10.274 -12.477 115 HD22 LEU 12 HD22 LEU 12 -5.834 10.339 -10.721 116 HD23 LEU 12 HD23 LEU 12 -7.032 9.450 -11.663 117 H TYR 13 HN TYR 13 -8.089 9.135 -14.056 118 HA TYR 13 HA TYR 13 -7.144 9.772 -16.761 119 HB2 TYR 13 HB2 TYR 13 -9.761 10.343 -15.350 120 HB3 TYR 13 HB1 TYR 13 -9.381 10.786 -17.012 121 HD1 TYR 13 HD1 TYR 13 -10.122 7.989 -14.744 122 HD2 TYR 13 HD2 TYR 13 -9.379 9.129 -18.775 123 HE1 TYR 13 HE1 TYR 13 -10.934 5.799 -15.505 124 HE2 TYR 13 HE2 TYR 13 -10.186 6.936 -19.546 125 HH TYR 13 HH TYR 13 -11.221 5.031 -18.945 126 H VAL 14 HN VAL 14 -5.989 11.595 -16.987 127 HA VAL 14 HA VAL 14 -6.385 13.734 -14.992 128 HB VAL 14 HB VAL 14 -3.997 14.278 -15.162 129 HG11 VAL 14 HG11 VAL 14 -3.133 12.213 -13.985 130 HG12 VAL 14 HG12 VAL 14 -4.711 11.487 -14.293 131 HG13 VAL 14 HG13 VAL 14 -4.588 12.941 -13.303 132 HG21 VAL 14 HG21 VAL 14 -4.047 12.690 -17.439 133 HG22 VAL 14 HG22 VAL 14 -3.109 11.756 -16.276 134 HG23 VAL 14 HG23 VAL 14 -2.621 13.402 -16.682 135 H ALA 15 HN ALA 15 -5.740 15.872 -15.742 136 HA ALA 15 HA ALA 15 -6.118 16.153 -18.646 137 HB1 ALA 15 HB1 ALA 15 -6.772 18.558 -17.178 138 HB2 ALA 15 HB2 ALA 15 -7.734 17.191 -16.611 139 HB3 ALA 15 HB3 ALA 15 -7.759 17.641 -18.316 140 H GLY 16 HN GLY 16 -4.164 16.472 -19.452 141 HA2 GLY 16 HA2 GLY 16 -2.140 17.455 -19.881 142 HA3 GLY 16 HA1 GLY 16 -2.748 18.859 -19.016 143 H ASN 17 HN ASN 17 -1.210 19.438 -17.619 144 HA ASN 17 HA ASN 17 -0.262 17.403 -15.727 145 HB2 ASN 17 HB2 ASN 17 1.406 18.093 -17.658 146 HB3 ASN 17 HB1 ASN 17 1.641 19.522 -16.658 147 HD21 ASN 17 HD21 ASN 17 3.660 19.170 -15.940 148 HD22 ASN 17 HD22 ASN 17 4.131 17.812 -14.983 149 H THR 18 HN THR 18 -2.306 18.939 -15.089 150 HA THR 18 HA THR 18 -1.551 21.434 -13.887 151 HB THR 18 HB THR 18 -3.813 21.438 -12.927 152 HG1 THR 18 HG1 THR 18 -5.129 19.513 -13.797 153 HG21 THR 18 HG21 THR 18 -3.283 21.943 -15.418 154 HG22 THR 18 HG22 THR 18 -4.964 21.780 -14.910 155 HG23 THR 18 HG23 THR 18 -4.157 20.443 -15.730 156 HA PRO 19 HA PRO 19 -0.057 20.206 -9.948 157 HB2 PRO 19 HB2 PRO 19 -2.217 21.887 -8.729 158 HB3 PRO 19 HB1 PRO 19 -0.479 21.887 -8.410 159 HG2 PRO 19 HG2 PRO 19 -1.518 23.811 -9.887 160 HG3 PRO 19 HG1 PRO 19 0.011 23.054 -10.380 161 HD2 PRO 19 HD2 PRO 19 -2.751 22.615 -11.456 162 HD3 PRO 19 HD1 PRO 19 -1.210 22.749 -12.328 163 H ASN 20 HN ASN 20 -3.598 20.175 -10.225 164 HA ASN 20 HA ASN 20 -4.054 18.379 -8.078 165 HB2 ASN 20 HB2 ASN 20 -5.739 18.917 -10.552 166 HB3 ASN 20 HB1 ASN 20 -6.229 17.841 -9.252 167 HD21 ASN 20 HD21 ASN 20 -7.643 20.130 -10.040 168 HD22 ASN 20 HD22 ASN 20 -7.640 21.240 -8.719 169 H SER 21 HN SER 21 -3.643 17.886 -11.576 170 HA SER 21 HA SER 21 -3.813 15.043 -11.569 171 HB2 SER 21 HB2 SER 21 -2.491 16.950 -13.516 172 HB3 SER 21 HB1 SER 21 -2.764 15.233 -13.811 173 HG SER 21 HG SER 21 -4.532 17.348 -13.893 174 H VAL 22 HN VAL 22 -1.045 17.259 -11.390 175 HA VAL 22 HA VAL 22 0.880 15.198 -11.427 176 HB VAL 22 HB VAL 22 1.017 18.010 -10.301 177 HG11 VAL 22 HG11 VAL 22 3.488 17.702 -10.281 178 HG12 VAL 22 HG12 VAL 22 3.227 15.976 -10.549 179 HG13 VAL 22 HG13 VAL 22 2.627 16.742 -9.074 180 HG21 VAL 22 HG21 VAL 22 2.594 18.244 -12.319 181 HG22 VAL 22 HG22 VAL 22 0.858 18.173 -12.618 182 HG23 VAL 22 HG23 VAL 22 1.858 16.745 -12.885 183 H ARG 23 HN ARG 23 -0.758 16.862 -8.787 184 HA ARG 23 HA ARG 23 0.593 15.641 -6.645 185 HB2 ARG 23 HB2 ARG 23 -1.185 17.610 -6.840 186 HB3 ARG 23 HB1 ARG 23 -2.301 16.307 -6.435 187 HG2 ARG 23 HG2 ARG 23 -1.869 16.880 -4.330 188 HG3 ARG 23 HG1 ARG 23 -0.372 15.971 -4.552 189 HD2 ARG 23 HD2 ARG 23 -0.490 18.846 -5.343 190 HD3 ARG 23 HD1 ARG 23 -0.313 18.424 -3.639 191 HE ARG 23 HE ARG 23 1.584 16.968 -5.067 192 HH11 ARG 23 HH11 ARG 23 0.858 20.292 -4.322 193 HH12 ARG 23 HH12 ARG 23 2.509 20.809 -4.404 194 HH21 ARG 23 HH21 ARG 23 3.760 17.631 -5.180 195 HH22 ARG 23 HH22 ARG 23 4.165 19.291 -4.895 196 H ALA 24 HN ALA 24 -2.465 14.853 -8.268 197 HA ALA 24 HA ALA 24 -3.102 12.612 -6.705 198 HB1 ALA 24 HB1 ALA 24 -4.009 12.425 -9.471 199 HB2 ALA 24 HB2 ALA 24 -4.333 13.991 -8.724 200 HB3 ALA 24 HB3 ALA 24 -4.937 12.514 -7.973 201 H LEU 25 HN LEU 25 -1.396 12.899 -9.798 202 HA LEU 25 HA LEU 25 -0.996 10.157 -10.292 203 HB2 LEU 25 HB2 LEU 25 -0.709 11.831 -12.023 204 HB3 LEU 25 HB1 LEU 25 0.616 12.562 -11.143 205 HG LEU 25 HG LEU 25 1.967 10.537 -11.497 206 HD11 LEU 25 HD11 LEU 25 -0.530 9.601 -12.863 207 HD12 LEU 25 HD12 LEU 25 0.474 8.762 -11.681 208 HD13 LEU 25 HD13 LEU 25 1.052 8.977 -13.333 209 HD21 LEU 25 HD21 LEU 25 0.813 11.703 -14.027 210 HD22 LEU 25 HD22 LEU 25 2.354 10.856 -13.884 211 HD23 LEU 25 HD23 LEU 25 2.117 12.400 -13.065 212 H LYS 26 HN LYS 26 1.127 12.527 -8.700 213 HA LYS 26 HA LYS 26 3.247 10.753 -8.195 214 HB2 LYS 26 HB2 LYS 26 3.467 13.191 -8.049 215 HB3 LYS 26 HB1 LYS 26 2.382 13.217 -6.667 216 HG2 LYS 26 HG2 LYS 26 3.968 12.137 -5.286 217 HG3 LYS 26 HG1 LYS 26 4.998 11.740 -6.664 218 HD2 LYS 26 HD2 LYS 26 5.957 13.604 -5.464 219 HD3 LYS 26 HD1 LYS 26 5.373 14.158 -7.033 220 HE2 LYS 26 HE2 LYS 26 4.771 15.767 -5.340 221 HE3 LYS 26 HE1 LYS 26 3.313 14.977 -5.941 222 HZ1 LYS 26 HZ1 LYS 26 3.629 15.282 -3.417 223 HZ2 LYS 26 HZ2 LYS 26 4.666 13.953 -3.531 224 HZ3 LYS 26 HZ3 LYS 26 3.045 13.800 -3.989 225 H THR 27 HN THR 27 0.425 11.639 -6.242 226 HA THR 27 HA THR 27 1.077 10.116 -3.955 227 HB THR 27 HB THR 27 -1.625 10.999 -4.982 228 HG1 THR 27 HG1 THR 27 -0.488 12.827 -4.596 229 HG21 THR 27 HG21 THR 27 -2.391 9.711 -3.312 230 HG22 THR 27 HG22 THR 27 -1.765 10.980 -2.258 231 HG23 THR 27 HG23 THR 27 -0.794 9.541 -2.584 232 H LEU 28 HN LEU 28 -0.931 9.363 -6.804 233 HA LEU 28 HA LEU 28 -1.744 6.810 -5.869 234 HB2 LEU 28 HB2 LEU 28 -2.166 8.446 -8.184 235 HB3 LEU 28 HB1 LEU 28 -1.775 6.819 -8.701 236 HG LEU 28 HG LEU 28 -4.122 6.889 -8.595 237 HD11 LEU 28 HD11 LEU 28 -3.925 5.755 -5.916 238 HD12 LEU 28 HD12 LEU 28 -2.723 5.131 -7.045 239 HD13 LEU 28 HD13 LEU 28 -4.441 5.017 -7.431 240 HD21 LEU 28 HD21 LEU 28 -3.649 8.744 -6.430 241 HD22 LEU 28 HD22 LEU 28 -4.880 7.553 -6.010 242 HD23 LEU 28 HD23 LEU 28 -5.067 8.543 -7.457 243 H ALA 29 HN ALA 29 0.738 7.776 -8.274 244 HA ALA 29 HA ALA 29 1.525 5.179 -8.965 245 HB1 ALA 29 HB1 ALA 29 2.356 7.862 -9.543 246 HB2 ALA 29 HB2 ALA 29 2.528 6.396 -10.510 247 HB3 ALA 29 HB3 ALA 29 3.756 6.814 -9.316 248 H ASN 30 HN ASN 30 2.890 7.371 -6.482 249 HA ASN 30 HA ASN 30 5.063 5.605 -5.905 250 HB2 ASN 30 HB2 ASN 30 4.957 8.103 -5.351 251 HB3 ASN 30 HB1 ASN 30 3.935 7.653 -3.990 252 HD21 ASN 30 HD21 ASN 30 5.288 8.179 -2.356 253 HD22 ASN 30 HD22 ASN 30 6.815 7.418 -2.081 254 H ILE 31 HN ILE 31 1.872 6.031 -4.464 255 HA ILE 31 HA ILE 31 2.305 4.229 -2.369 256 HB ILE 31 HB ILE 31 -0.215 5.224 -3.651 257 HG12 ILE 31 HG12 ILE 31 0.942 5.583 -0.885 258 HG13 ILE 31 HG11 ILE 31 1.233 6.684 -2.228 259 HG21 ILE 31 HG21 ILE 31 -0.157 2.780 -2.443 260 HG22 ILE 31 HG22 ILE 31 -1.563 3.842 -2.526 261 HG23 ILE 31 HG23 ILE 31 -0.538 3.847 -1.091 262 HD11 ILE 31 HD11 ILE 31 -1.498 6.037 -1.186 263 HD12 ILE 31 HD12 ILE 31 -1.036 7.321 -2.302 264 HD13 ILE 31 HD13 ILE 31 -0.527 7.392 -0.615 265 H LEU 32 HN LEU 32 0.989 3.765 -5.629 266 HA LEU 32 HA LEU 32 0.527 0.982 -5.308 267 HB2 LEU 32 HB2 LEU 32 0.765 2.722 -7.747 268 HB3 LEU 32 HB1 LEU 32 0.432 1.002 -7.839 269 HG LEU 32 HG LEU 32 -1.310 2.957 -6.328 270 HD11 LEU 32 HD11 LEU 32 -2.859 2.766 -8.222 271 HD12 LEU 32 HD12 LEU 32 -1.652 1.832 -9.107 272 HD13 LEU 32 HD13 LEU 32 -1.334 3.516 -8.695 273 HD21 LEU 32 HD21 LEU 32 -2.293 1.140 -5.539 274 HD22 LEU 32 HD22 LEU 32 -1.173 0.113 -6.433 275 HD23 LEU 32 HD23 LEU 32 -2.676 0.644 -7.187 276 H GLU 33 HN GLU 33 3.388 2.803 -6.179 277 HA GLU 33 HA GLU 33 4.745 0.444 -7.192 278 HB2 GLU 33 HB2 GLU 33 5.730 3.258 -6.714 279 HB3 GLU 33 HB1 GLU 33 6.731 1.965 -7.358 280 HG2 GLU 33 HG2 GLU 33 5.219 1.762 -9.276 281 HG3 GLU 33 HG1 GLU 33 4.235 3.071 -8.621 282 H LYS 34 HN LYS 34 4.239 1.791 -4.109 283 HA LYS 34 HA LYS 34 6.546 0.257 -3.085 284 HB2 LYS 34 HB2 LYS 34 5.278 2.660 -1.759 285 HB3 LYS 34 HB1 LYS 34 6.690 1.782 -1.198 286 HG2 LYS 34 HG2 LYS 34 6.510 3.396 -3.735 287 HG3 LYS 34 HG1 LYS 34 7.296 3.898 -2.239 288 HD2 LYS 34 HD2 LYS 34 8.795 1.899 -2.466 289 HD3 LYS 34 HD1 LYS 34 8.095 1.635 -4.065 290 HE2 LYS 34 HE2 LYS 34 9.555 4.110 -3.148 291 HE3 LYS 34 HE1 LYS 34 10.199 2.864 -4.217 292 HZ1 LYS 34 HZ1 LYS 34 8.199 3.427 -5.680 293 HZ2 LYS 34 HZ2 LYS 34 9.482 4.528 -5.646 294 HZ3 LYS 34 HZ3 LYS 34 8.073 4.847 -4.760 295 H GLU 35 HN GLU 35 3.460 1.589 -1.934 296 HA GLU 35 HA GLU 35 3.109 -0.280 0.146 297 HB2 GLU 35 HB2 GLU 35 1.221 1.608 -1.266 298 HB3 GLU 35 HB1 GLU 35 0.713 0.596 0.086 299 HG2 GLU 35 HG2 GLU 35 2.894 2.673 0.156 300 HG3 GLU 35 HG1 GLU 35 1.268 2.856 0.809 301 H PHE 36 HN PHE 36 1.866 -0.207 -3.177 302 HA PHE 36 HA PHE 36 0.868 -2.949 -2.744 303 HB2 PHE 36 HB2 PHE 36 -0.291 -0.828 -4.560 304 HB3 PHE 36 HB1 PHE 36 -0.853 -2.492 -4.464 305 HD1 PHE 36 HD1 PHE 36 -0.897 0.780 -2.923 306 HD2 PHE 36 HD2 PHE 36 -1.942 -3.313 -2.405 307 HE1 PHE 36 HE1 PHE 36 -2.384 1.398 -1.065 308 HE2 PHE 36 HE2 PHE 36 -3.435 -2.700 -0.550 309 HZ PHE 36 HZ PHE 36 -3.656 -0.341 0.124 310 H LYS 37 HN LYS 37 3.514 -2.137 -3.638 311 HA LYS 37 HA LYS 37 3.895 -2.274 -6.385 312 HB2 LYS 37 HB2 LYS 37 5.658 -1.682 -4.776 313 HB3 LYS 37 HB1 LYS 37 5.694 -3.346 -4.206 314 HG2 LYS 37 HG2 LYS 37 6.455 -4.096 -6.392 315 HG3 LYS 37 HG1 LYS 37 6.383 -2.439 -6.994 316 HD2 LYS 37 HD2 LYS 37 8.060 -1.774 -5.328 317 HD3 LYS 37 HD1 LYS 37 8.151 -3.446 -4.765 318 HE2 LYS 37 HE2 LYS 37 8.786 -2.505 -7.559 319 HE3 LYS 37 HE1 LYS 37 9.980 -2.864 -6.312 320 HZ1 LYS 37 HZ1 LYS 37 9.957 -4.918 -7.132 321 HZ2 LYS 37 HZ2 LYS 37 8.547 -4.654 -8.028 322 HZ3 LYS 37 HZ3 LYS 37 8.442 -5.105 -6.401 323 H GLY 38 HN GLY 38 3.662 -3.807 -7.851 324 HA2 GLY 38 HA2 GLY 38 3.750 -5.920 -8.808 325 HA3 GLY 38 HA1 GLY 38 4.119 -6.591 -7.229 326 H VAL 39 HN VAL 39 1.450 -4.702 -6.759 327 HA VAL 39 HA VAL 39 -0.280 -7.037 -7.173 328 HB VAL 39 HB VAL 39 -0.719 -4.743 -5.244 329 HG11 VAL 39 HG11 VAL 39 -2.737 -6.027 -6.196 330 HG12 VAL 39 HG12 VAL 39 -2.615 -5.840 -4.445 331 HG13 VAL 39 HG13 VAL 39 -2.166 -7.369 -5.201 332 HG21 VAL 39 HG21 VAL 39 0.046 -7.575 -4.568 333 HG22 VAL 39 HG22 VAL 39 -0.042 -6.187 -3.483 334 HG23 VAL 39 HG23 VAL 39 1.214 -6.263 -4.719 335 H TYR 40 HN TYR 40 -0.192 -3.493 -7.557 336 HA TYR 40 HA TYR 40 -2.503 -3.844 -9.320 337 HB2 TYR 40 HB2 TYR 40 -1.765 -1.564 -7.514 338 HB3 TYR 40 HB1 TYR 40 -2.745 -1.247 -8.935 339 HD1 TYR 40 HD1 TYR 40 -2.638 -3.073 -5.718 340 HD2 TYR 40 HD2 TYR 40 -5.029 -1.746 -8.971 341 HE1 TYR 40 HE1 TYR 40 -4.670 -3.617 -4.445 342 HE2 TYR 40 HE2 TYR 40 -7.062 -2.291 -7.712 343 HH TYR 40 HH TYR 40 -7.891 -3.113 -5.851 344 H ALA 41 HN ALA 41 -2.560 -2.897 -11.313 345 HA ALA 41 HA ALA 41 -0.007 -1.813 -12.291 346 HB1 ALA 41 HB1 ALA 41 -1.150 -3.886 -13.347 347 HB2 ALA 41 HB2 ALA 41 -0.537 -2.626 -14.418 348 HB3 ALA 41 HB3 ALA 41 -2.260 -2.714 -14.059 349 H LEU 42 HN LEU 42 0.066 0.343 -12.728 350 HA LEU 42 HA LEU 42 -2.451 1.812 -12.637 351 HB2 LEU 42 HB2 LEU 42 -0.664 2.548 -11.149 352 HB3 LEU 42 HB1 LEU 42 0.401 2.793 -12.519 353 HG LEU 42 HG LEU 42 -1.098 4.584 -13.340 354 HD11 LEU 42 HD11 LEU 42 -2.661 3.788 -10.924 355 HD12 LEU 42 HD12 LEU 42 -3.223 4.171 -12.552 356 HD13 LEU 42 HD13 LEU 42 -2.692 5.462 -11.475 357 HD21 LEU 42 HD21 LEU 42 -0.336 6.239 -11.854 358 HD22 LEU 42 HD22 LEU 42 0.865 4.950 -11.770 359 HD23 LEU 42 HD23 LEU 42 -0.331 5.126 -10.487 360 H LYS 43 HN LYS 43 -3.363 2.763 -14.290 361 HA LYS 43 HA LYS 43 -1.861 3.144 -16.787 362 HB2 LYS 43 HB2 LYS 43 -4.179 1.482 -16.309 363 HB3 LYS 43 HB1 LYS 43 -4.584 2.778 -17.424 364 HG2 LYS 43 HG2 LYS 43 -3.887 1.232 -18.913 365 HG3 LYS 43 HG1 LYS 43 -2.336 2.000 -18.575 366 HD2 LYS 43 HD2 LYS 43 -1.644 0.240 -17.193 367 HD3 LYS 43 HD1 LYS 43 -3.289 -0.374 -17.005 368 HE2 LYS 43 HE2 LYS 43 -1.831 -0.328 -19.636 369 HE3 LYS 43 HE1 LYS 43 -1.787 -1.707 -18.535 370 HZ1 LYS 43 HZ1 LYS 43 -4.457 -0.855 -18.988 371 HZ2 LYS 43 HZ2 LYS 43 -3.760 -2.371 -19.264 372 HZ3 LYS 43 HZ3 LYS 43 -3.686 -1.176 -20.460 373 H VAL 44 HN VAL 44 -1.660 5.241 -17.003 374 HA VAL 44 HA VAL 44 -3.798 7.048 -16.086 375 HB VAL 44 HB VAL 44 -0.934 7.578 -16.874 376 HG11 VAL 44 HG11 VAL 44 -2.073 9.566 -17.409 377 HG12 VAL 44 HG12 VAL 44 -1.441 9.842 -15.785 378 HG13 VAL 44 HG13 VAL 44 -3.141 9.426 -16.012 379 HG21 VAL 44 HG21 VAL 44 -0.359 7.512 -14.690 380 HG22 VAL 44 HG22 VAL 44 -1.743 6.424 -14.605 381 HG23 VAL 44 HG23 VAL 44 -1.924 8.117 -14.148 382 H ILE 45 HN ILE 45 -5.054 8.097 -17.362 383 HA ILE 45 HA ILE 45 -4.612 7.921 -20.267 384 HB ILE 45 HB ILE 45 -7.185 8.296 -18.738 385 HG12 ILE 45 HG12 ILE 45 -6.271 6.111 -18.225 386 HG13 ILE 45 HG11 ILE 45 -7.687 5.938 -19.251 387 HG21 ILE 45 HG21 ILE 45 -7.121 9.128 -21.110 388 HG22 ILE 45 HG22 ILE 45 -8.358 7.908 -20.778 389 HG23 ILE 45 HG23 ILE 45 -6.868 7.456 -21.614 390 HD11 ILE 45 HD11 ILE 45 -5.854 4.403 -19.821 391 HD12 ILE 45 HD12 ILE 45 -4.840 5.794 -20.210 392 HD13 ILE 45 HD13 ILE 45 -6.295 5.473 -21.154 393 H ASP 46 HN ASP 46 -3.968 9.884 -21.089 394 HA ASP 46 HA ASP 46 -4.567 12.321 -19.638 395 HB2 ASP 46 HB2 ASP 46 -2.346 11.883 -20.744 396 HB3 ASP 46 HB1 ASP 46 -3.158 12.049 -22.297 397 H VAL 47 HN VAL 47 -6.645 12.948 -19.855 398 HA VAL 47 HA VAL 47 -8.236 12.411 -22.127 399 HB VAL 47 HB VAL 47 -9.949 13.781 -21.088 400 HG11 VAL 47 HG11 VAL 47 -8.515 11.634 -19.749 401 HG12 VAL 47 HG12 VAL 47 -10.249 11.866 -19.981 402 HG13 VAL 47 HG13 VAL 47 -9.429 12.643 -18.627 403 HG21 VAL 47 HG21 VAL 47 -9.584 15.029 -19.065 404 HG22 VAL 47 HG22 VAL 47 -8.452 15.598 -20.290 405 HG23 VAL 47 HG23 VAL 47 -7.896 14.523 -19.007 406 H LEU 48 HN LEU 48 -6.308 15.274 -21.309 407 HA LEU 48 HA LEU 48 -7.567 16.940 -23.248 408 HB2 LEU 48 HB2 LEU 48 -4.931 17.201 -21.829 409 HB3 LEU 48 HB1 LEU 48 -5.499 18.376 -22.999 410 HG LEU 48 HG LEU 48 -6.934 17.649 -20.443 411 HD11 LEU 48 HD11 LEU 48 -5.213 20.011 -21.168 412 HD12 LEU 48 HD12 LEU 48 -4.932 18.827 -19.891 413 HD13 LEU 48 HD13 LEU 48 -6.280 19.957 -19.765 414 HD21 LEU 48 HD21 LEU 48 -8.011 19.971 -21.169 415 HD22 LEU 48 HD22 LEU 48 -8.659 18.421 -21.706 416 HD23 LEU 48 HD23 LEU 48 -7.609 19.353 -22.771 417 H LYS 49 HN LYS 49 -4.702 14.862 -23.374 418 HA LYS 49 HA LYS 49 -3.910 15.753 -25.963 419 HB2 LYS 49 HB2 LYS 49 -3.170 13.309 -24.374 420 HB3 LYS 49 HB1 LYS 49 -2.543 13.617 -25.987 421 HG2 LYS 49 HG2 LYS 49 -1.608 15.753 -25.185 422 HG3 LYS 49 HG1 LYS 49 -2.173 15.361 -23.559 423 HD2 LYS 49 HD2 LYS 49 -0.761 13.404 -23.498 424 HD3 LYS 49 HD1 LYS 49 -0.277 13.664 -25.174 425 HE2 LYS 49 HE2 LYS 49 1.470 14.431 -23.681 426 HE3 LYS 49 HE1 LYS 49 0.753 15.802 -24.526 427 HZ1 LYS 49 HZ1 LYS 49 -0.477 15.169 -21.984 428 HZ2 LYS 49 HZ2 LYS 49 -0.018 16.669 -22.627 429 HZ3 LYS 49 HZ3 LYS 49 1.134 15.683 -21.877 430 H ASN 50 HN ASN 50 -5.958 13.125 -24.808 431 HA ASN 50 HA ASN 50 -6.761 12.699 -27.610 432 HB2 ASN 50 HB2 ASN 50 -5.327 10.819 -26.581 433 HB3 ASN 50 HB1 ASN 50 -6.736 10.488 -25.572 434 HD21 ASN 50 HD21 ASN 50 -5.277 9.134 -27.929 435 HD22 ASN 50 HD22 ASN 50 -6.575 8.640 -28.955 436 HA PRO 51 HA PRO 51 -10.410 13.993 -25.196 437 HB2 PRO 51 HB2 PRO 51 -11.220 14.777 -27.944 438 HB3 PRO 51 HB1 PRO 51 -11.259 15.722 -26.451 439 HG2 PRO 51 HG2 PRO 51 -9.413 16.233 -28.292 440 HG3 PRO 51 HG1 PRO 51 -8.983 16.242 -26.571 441 HD2 PRO 51 HD2 PRO 51 -8.543 14.093 -28.614 442 HD3 PRO 51 HD1 PRO 51 -7.412 14.742 -27.403 443 H GLN 52 HN GLN 52 -10.059 12.085 -28.093 444 HA GLN 52 HA GLN 52 -12.700 11.113 -28.318 445 HB2 GLN 52 HB2 GLN 52 -10.054 9.950 -29.194 446 HB3 GLN 52 HB1 GLN 52 -11.605 9.221 -29.585 447 HG2 GLN 52 HG2 GLN 52 -12.262 11.204 -30.813 448 HG3 GLN 52 HG1 GLN 52 -10.752 12.000 -30.372 449 HE21 GLN 52 HE21 GLN 52 -8.962 11.620 -31.556 450 HE22 GLN 52 HE22 GLN 52 -8.897 10.554 -32.913 451 H LEU 53 HN LEU 53 -9.865 9.944 -26.553 452 HA LEU 53 HA LEU 53 -11.178 7.562 -25.721 453 HB2 LEU 53 HB2 LEU 53 -8.698 8.919 -24.666 454 HB3 LEU 53 HB1 LEU 53 -9.294 7.391 -24.043 455 HG LEU 53 HG LEU 53 -8.448 7.878 -26.899 456 HD11 LEU 53 HD11 LEU 53 -6.429 6.791 -26.429 457 HD12 LEU 53 HD12 LEU 53 -7.000 6.213 -24.865 458 HD13 LEU 53 HD13 LEU 53 -6.645 7.925 -25.096 459 HD21 LEU 53 HD21 LEU 53 -9.692 5.597 -25.478 460 HD22 LEU 53 HD22 LEU 53 -8.415 5.231 -26.638 461 HD23 LEU 53 HD23 LEU 53 -9.849 6.117 -27.157 462 H ALA 54 HN ALA 54 -10.790 10.793 -24.410 463 HA ALA 54 HA ALA 54 -11.798 10.290 -21.823 464 HB1 ALA 54 HB1 ALA 54 -10.562 12.363 -22.674 465 HB2 ALA 54 HB2 ALA 54 -11.898 12.608 -21.547 466 HB3 ALA 54 HB3 ALA 54 -12.133 12.892 -23.273 467 H GLU 55 HN GLU 55 -13.283 11.239 -24.873 468 HA GLU 55 HA GLU 55 -15.940 11.511 -23.883 469 HB2 GLU 55 HB2 GLU 55 -15.182 12.514 -26.018 470 HB3 GLU 55 HB1 GLU 55 -15.016 10.900 -26.699 471 HG2 GLU 55 HG2 GLU 55 -17.407 10.528 -26.442 472 HG3 GLU 55 HG1 GLU 55 -17.589 12.120 -25.712 473 H GLU 56 HN GLU 56 -14.121 8.825 -25.266 474 HA GLU 56 HA GLU 56 -16.250 7.017 -25.542 475 HB2 GLU 56 HB2 GLU 56 -13.308 6.554 -25.020 476 HB3 GLU 56 HB1 GLU 56 -14.444 5.254 -25.351 477 HG2 GLU 56 HG2 GLU 56 -13.772 7.541 -27.205 478 HG3 GLU 56 HG1 GLU 56 -13.204 5.874 -27.347 479 H ASP 57 HN ASP 57 -14.108 7.687 -22.774 480 HA ASP 57 HA ASP 57 -15.757 5.887 -21.167 481 HB2 ASP 57 HB2 ASP 57 -13.080 7.215 -20.616 482 HB3 ASP 57 HB1 ASP 57 -13.987 6.370 -19.364 483 H LYS 58 HN LYS 58 -16.227 8.788 -22.146 484 HA LYS 58 HA LYS 58 -17.308 10.651 -21.454 485 HB2 LYS 58 HB2 LYS 58 -18.544 8.609 -19.613 486 HB3 LYS 58 HB1 LYS 58 -19.169 10.239 -19.834 487 HG2 LYS 58 HG2 LYS 58 -19.505 9.782 -22.221 488 HG3 LYS 58 HG1 LYS 58 -18.893 8.145 -21.985 489 HD2 LYS 58 HD2 LYS 58 -20.727 7.665 -20.448 490 HD3 LYS 58 HD1 LYS 58 -21.330 9.312 -20.640 491 HE2 LYS 58 HE2 LYS 58 -22.612 7.793 -22.026 492 HE3 LYS 58 HE1 LYS 58 -21.673 8.889 -23.038 493 HZ1 LYS 58 HZ1 LYS 58 -20.113 7.184 -23.500 494 HZ2 LYS 58 HZ2 LYS 58 -21.646 6.514 -23.746 495 HZ3 LYS 58 HZ3 LYS 58 -20.781 6.147 -22.341 496 H ILE 59 HN ILE 59 -14.876 10.861 -20.478 497 HA ILE 59 HA ILE 59 -14.979 11.337 -17.607 498 HB ILE 59 HB ILE 59 -12.725 11.817 -19.564 499 HG12 ILE 59 HG12 ILE 59 -13.338 9.456 -19.483 500 HG13 ILE 59 HG11 ILE 59 -11.786 9.712 -18.691 501 HG21 ILE 59 HG21 ILE 59 -11.724 11.351 -16.989 502 HG22 ILE 59 HG22 ILE 59 -13.054 12.491 -16.785 503 HG23 ILE 59 HG23 ILE 59 -11.726 12.873 -17.879 504 HD11 ILE 59 HD11 ILE 59 -14.373 8.846 -17.570 505 HD12 ILE 59 HD12 ILE 59 -13.376 9.895 -16.562 506 HD13 ILE 59 HD13 ILE 59 -12.729 8.364 -17.150 507 H LEU 60 HN LEU 60 -16.053 13.138 -17.039 508 HA LEU 60 HA LEU 60 -15.605 15.589 -18.600 509 HB2 LEU 60 HB2 LEU 60 -17.805 14.933 -16.641 510 HB3 LEU 60 HB1 LEU 60 -17.655 16.435 -17.531 511 HG LEU 60 HG LEU 60 -18.105 13.715 -18.769 512 HD11 LEU 60 HD11 LEU 60 -20.342 14.568 -19.284 513 HD12 LEU 60 HD12 LEU 60 -19.987 16.038 -18.377 514 HD13 LEU 60 HD13 LEU 60 -20.058 14.486 -17.545 515 HD21 LEU 60 HD21 LEU 60 -16.969 14.949 -20.388 516 HD22 LEU 60 HD22 LEU 60 -17.739 16.463 -19.916 517 HD23 LEU 60 HD23 LEU 60 -18.666 15.231 -20.772 518 H ALA 61 HN ALA 61 -14.549 14.134 -15.800 519 HA ALA 61 HA ALA 61 -13.659 16.709 -14.743 520 HB1 ALA 61 HB1 ALA 61 -14.525 14.803 -12.663 521 HB2 ALA 61 HB2 ALA 61 -15.812 15.581 -13.585 522 HB3 ALA 61 HB3 ALA 61 -14.637 16.563 -12.711 523 H THR 62 HN THR 62 -11.675 16.653 -13.787 524 HA THR 62 HA THR 62 -10.339 14.075 -13.412 525 HB THR 62 HB THR 62 -8.261 15.046 -14.364 526 HG1 THR 62 HG1 THR 62 -9.313 17.302 -14.089 527 HG21 THR 62 HG21 THR 62 -9.640 13.652 -15.811 528 HG22 THR 62 HG22 THR 62 -8.893 14.955 -16.739 529 HG23 THR 62 HG23 THR 62 -10.594 15.060 -16.282 530 HA PRO 63 HA PRO 63 -8.155 13.594 -12.851 531 HB2 PRO 63 HB2 PRO 63 -7.611 12.686 -10.115 532 HB3 PRO 63 HB1 PRO 63 -6.476 12.978 -11.437 533 HG2 PRO 63 HG2 PRO 63 -6.582 14.581 -9.274 534 HG3 PRO 63 HG1 PRO 63 -6.211 15.208 -10.892 535 HD2 PRO 63 HD2 PRO 63 -8.819 15.259 -9.399 536 HD3 PRO 63 HD1 PRO 63 -8.023 16.562 -10.310 537 H THR 64 HN THR 64 -8.935 11.514 -13.050 538 HA THR 64 HA THR 64 -11.292 10.834 -11.408 539 HB THR 64 HB THR 64 -11.177 9.464 -13.980 540 HG1 THR 64 HG1 THR 64 -11.837 12.213 -14.159 541 HG21 THR 64 HG21 THR 64 -13.200 10.926 -12.337 542 HG22 THR 64 HG22 THR 64 -13.202 9.248 -12.890 543 HG23 THR 64 HG23 THR 64 -13.553 10.556 -14.025 544 H LEU 65 HN LEU 65 -10.940 9.094 -10.183 545 HA LEU 65 HA LEU 65 -8.825 7.193 -10.977 546 HB2 LEU 65 HB2 LEU 65 -8.573 8.349 -8.792 547 HB3 LEU 65 HB1 LEU 65 -10.100 7.659 -8.277 548 HG LEU 65 HG LEU 65 -9.106 5.389 -8.508 549 HD11 LEU 65 HD11 LEU 65 -7.391 5.704 -10.102 550 HD12 LEU 65 HD12 LEU 65 -6.579 5.330 -8.582 551 HD13 LEU 65 HD13 LEU 65 -6.648 6.995 -9.157 552 HD21 LEU 65 HD21 LEU 65 -8.964 5.826 -6.314 553 HD22 LEU 65 HD22 LEU 65 -8.314 7.443 -6.579 554 HD23 LEU 65 HD23 LEU 65 -7.242 6.044 -6.631 555 H ALA 66 HN ALA 66 -9.583 5.359 -11.890 556 HA ALA 66 HA ALA 66 -11.992 4.147 -10.723 557 HB1 ALA 66 HB1 ALA 66 -12.377 5.554 -12.931 558 HB2 ALA 66 HB2 ALA 66 -13.197 4.014 -12.666 559 HB3 ALA 66 HB3 ALA 66 -11.765 4.083 -13.692 560 H LYS 67 HN LYS 67 -12.041 2.022 -10.645 561 HA LYS 67 HA LYS 67 -9.634 0.603 -11.495 562 HB2 LYS 67 HB2 LYS 67 -10.192 0.216 -9.192 563 HB3 LYS 67 HB1 LYS 67 -11.879 -0.075 -9.583 564 HG2 LYS 67 HG2 LYS 67 -11.068 -2.106 -10.887 565 HG3 LYS 67 HG1 LYS 67 -9.523 -1.870 -10.071 566 HD2 LYS 67 HD2 LYS 67 -11.820 -1.819 -8.265 567 HD3 LYS 67 HD1 LYS 67 -11.630 -3.349 -9.121 568 HE2 LYS 67 HE2 LYS 67 -9.224 -3.337 -8.385 569 HE3 LYS 67 HE1 LYS 67 -9.619 -1.962 -7.356 570 HZ1 LYS 67 HZ1 LYS 67 -10.871 -3.243 -5.964 571 HZ2 LYS 67 HZ2 LYS 67 -9.724 -4.392 -6.441 572 HZ3 LYS 67 HZ3 LYS 67 -11.260 -4.383 -7.151 573 H VAL 68 HN VAL 68 -9.874 -0.051 -13.593 574 HA VAL 68 HA VAL 68 -12.479 -0.767 -14.594 575 HB VAL 68 HB VAL 68 -11.328 -1.200 -16.729 576 HG11 VAL 68 HG11 VAL 68 -12.061 1.110 -15.818 577 HG12 VAL 68 HG12 VAL 68 -11.068 1.030 -17.273 578 HG13 VAL 68 HG13 VAL 68 -10.328 1.427 -15.722 579 HG21 VAL 68 HG21 VAL 68 -9.102 -1.373 -16.973 580 HG22 VAL 68 HG22 VAL 68 -9.092 -1.647 -15.232 581 HG23 VAL 68 HG23 VAL 68 -8.785 -0.033 -15.872 582 H LEU 69 HN LEU 69 -9.660 -2.395 -13.379 583 HA LEU 69 HA LEU 69 -11.102 -4.941 -13.705 584 HB2 LEU 69 HB2 LEU 69 -8.182 -4.526 -14.357 585 HB3 LEU 69 HB1 LEU 69 -8.965 -6.088 -14.252 586 HG LEU 69 HG LEU 69 -9.739 -3.944 -16.234 587 HD11 LEU 69 HD11 LEU 69 -8.670 -5.888 -17.737 588 HD12 LEU 69 HD12 LEU 69 -7.664 -6.046 -16.297 589 HD13 LEU 69 HD13 LEU 69 -7.750 -4.504 -17.151 590 HD21 LEU 69 HD21 LEU 69 -11.595 -5.313 -16.006 591 HD22 LEU 69 HD22 LEU 69 -10.623 -6.760 -15.730 592 HD23 LEU 69 HD23 LEU 69 -10.725 -6.060 -17.346 593 HA PRO 70 HA PRO 70 -11.172 -6.871 -13.021 594 HB2 PRO 70 HB2 PRO 70 -12.429 -8.189 -11.058 595 HB3 PRO 70 HB1 PRO 70 -10.740 -8.526 -11.454 596 HG2 PRO 70 HG2 PRO 70 -11.865 -6.834 -9.250 597 HG3 PRO 70 HG1 PRO 70 -10.561 -8.032 -9.179 598 HD2 PRO 70 HD2 PRO 70 -10.117 -5.347 -9.364 599 HD3 PRO 70 HD1 PRO 70 -8.999 -6.565 -10.007 600 HA PRO 71 HA PRO 71 -14.953 -4.515 -13.013 601 HB2 PRO 71 HB2 PRO 71 -16.583 -6.227 -14.335 602 HB3 PRO 71 HB1 PRO 71 -15.285 -5.339 -15.145 603 HG2 PRO 71 HG2 PRO 71 -15.296 -8.162 -14.127 604 HG3 PRO 71 HG1 PRO 71 -14.717 -7.542 -15.687 605 HD2 PRO 71 HD2 PRO 71 -13.030 -8.079 -13.656 606 HD3 PRO 71 HD1 PRO 71 -12.752 -6.732 -14.778 607 HA PRO 72 HA PRO 72 -17.531 -4.213 -13.270 608 HB2 PRO 72 HB2 PRO 72 -18.596 -2.981 -10.806 609 HB3 PRO 72 HB1 PRO 72 -19.432 -3.403 -12.305 610 HG2 PRO 72 HG2 PRO 72 -19.826 -4.820 -10.083 611 HG3 PRO 72 HG1 PRO 72 -19.730 -5.618 -11.667 612 HD2 PRO 72 HD2 PRO 72 -17.619 -5.372 -9.543 613 HD3 PRO 72 HD1 PRO 72 -18.097 -6.800 -10.488 614 H VAL 73 HN VAL 73 -17.085 -1.988 -13.586 615 HA VAL 73 HA VAL 73 -14.544 -1.152 -12.618 616 HB VAL 73 HB VAL 73 -16.622 0.388 -14.190 617 HG11 VAL 73 HG11 VAL 73 -13.771 1.017 -13.494 618 HG12 VAL 73 HG12 VAL 73 -15.205 2.025 -13.301 619 HG13 VAL 73 HG13 VAL 73 -14.558 1.714 -14.911 620 HG21 VAL 73 HG21 VAL 73 -14.751 -1.704 -14.913 621 HG22 VAL 73 HG22 VAL 73 -14.491 -0.232 -15.851 622 HG23 VAL 73 HG23 VAL 73 -16.077 -1.003 -15.844 623 H ARG 74 HN ARG 74 -14.050 0.024 -10.889 624 HA ARG 74 HA ARG 74 -16.229 1.315 -9.386 625 HB2 ARG 74 HB2 ARG 74 -15.206 -0.399 -8.075 626 HB3 ARG 74 HB1 ARG 74 -13.593 0.142 -8.507 627 HG2 ARG 74 HG2 ARG 74 -14.072 0.757 -6.235 628 HG3 ARG 74 HG1 ARG 74 -13.967 2.213 -7.226 629 HD2 ARG 74 HD2 ARG 74 -15.846 2.354 -5.682 630 HD3 ARG 74 HD1 ARG 74 -16.414 2.301 -7.348 631 HE ARG 74 HE ARG 74 -17.372 0.241 -6.940 632 HH11 ARG 74 HH11 ARG 74 -15.402 1.199 -4.230 633 HH12 ARG 74 HH12 ARG 74 -15.995 -0.052 -3.188 634 HH21 ARG 74 HH21 ARG 74 -18.160 -1.407 -5.583 635 HH22 ARG 74 HH22 ARG 74 -17.566 -1.539 -3.961 636 H ARG 75 HN ARG 75 -16.320 3.443 -9.481 637 HA ARG 75 HA ARG 75 -13.878 4.914 -10.155 638 HB2 ARG 75 HB2 ARG 75 -16.786 5.664 -10.341 639 HB3 ARG 75 HB1 ARG 75 -15.488 6.833 -10.517 640 HG2 ARG 75 HG2 ARG 75 -14.594 5.457 -12.387 641 HG3 ARG 75 HG1 ARG 75 -16.054 4.465 -12.279 642 HD2 ARG 75 HD2 ARG 75 -16.016 7.443 -12.737 643 HD3 ARG 75 HD1 ARG 75 -16.166 6.239 -14.016 644 HE ARG 75 HE ARG 75 -18.197 7.018 -12.094 645 HH11 ARG 75 HH11 ARG 75 -17.191 4.757 -14.549 646 HH12 ARG 75 HH12 ARG 75 -18.791 4.169 -14.850 647 HH21 ARG 75 HH21 ARG 75 -20.309 6.253 -12.480 648 HH22 ARG 75 HH22 ARG 75 -20.568 5.022 -13.671 649 H ILE 76 HN ILE 76 -12.835 5.920 -8.647 650 HA ILE 76 HA ILE 76 -14.177 6.531 -6.101 651 HB ILE 76 HB ILE 76 -11.225 6.332 -6.704 652 HG12 ILE 76 HG12 ILE 76 -13.049 4.426 -5.214 653 HG13 ILE 76 HG11 ILE 76 -12.452 4.179 -6.853 654 HG21 ILE 76 HG21 ILE 76 -11.111 7.604 -4.839 655 HG22 ILE 76 HG22 ILE 76 -11.450 6.081 -4.017 656 HG23 ILE 76 HG23 ILE 76 -12.759 7.214 -4.346 657 HD11 ILE 76 HD11 ILE 76 -11.280 3.010 -4.892 658 HD12 ILE 76 HD12 ILE 76 -10.552 4.591 -4.604 659 HD13 ILE 76 HD13 ILE 76 -10.305 3.775 -6.148 660 H ILE 77 HN ILE 77 -14.805 8.609 -5.903 661 HA ILE 77 HA ILE 77 -13.169 10.685 -7.202 662 HB ILE 77 HB ILE 77 -16.124 10.886 -6.654 663 HG12 ILE 77 HG12 ILE 77 -15.716 10.873 -9.416 664 HG13 ILE 77 HG11 ILE 77 -14.691 9.575 -8.814 665 HG21 ILE 77 HG21 ILE 77 -14.630 12.574 -8.609 666 HG22 ILE 77 HG22 ILE 77 -14.535 12.952 -6.888 667 HG23 ILE 77 HG23 ILE 77 -16.099 12.935 -7.701 668 HD11 ILE 77 HD11 ILE 77 -16.535 8.458 -7.842 669 HD12 ILE 77 HD12 ILE 77 -17.003 8.905 -9.483 670 HD13 ILE 77 HD13 ILE 77 -17.598 9.840 -8.111 671 H GLY 78 HN GLY 78 -12.285 12.160 -5.903 672 HA2 GLY 78 HA2 GLY 78 -13.420 13.472 -3.768 673 HA3 GLY 78 HA1 GLY 78 -12.678 12.037 -3.073 674 H ASP 79 HN ASP 79 -11.327 13.611 -1.911 675 HA ASP 79 HA ASP 79 -9.401 15.117 -3.461 676 HB2 ASP 79 HB2 ASP 79 -10.260 15.964 -1.283 677 HB3 ASP 79 HB1 ASP 79 -9.507 14.595 -0.474 678 H LEU 80 HN LEU 80 -8.074 13.779 -4.580 679 HA LEU 80 HA LEU 80 -6.953 11.431 -3.293 680 HB2 LEU 80 HB2 LEU 80 -6.576 12.504 -6.092 681 HB3 LEU 80 HB1 LEU 80 -5.956 10.975 -5.506 682 HG LEU 80 HG LEU 80 -8.882 11.690 -5.736 683 HD11 LEU 80 HD11 LEU 80 -7.405 9.665 -7.380 684 HD12 LEU 80 HD12 LEU 80 -7.495 11.357 -7.870 685 HD13 LEU 80 HD13 LEU 80 -8.973 10.413 -7.683 686 HD21 LEU 80 HD21 LEU 80 -9.160 9.220 -5.373 687 HD22 LEU 80 HD22 LEU 80 -8.608 10.124 -3.963 688 HD23 LEU 80 HD23 LEU 80 -7.461 9.166 -4.901 689 H SER 81 HN SER 81 -6.119 14.637 -3.368 690 HA SER 81 HA SER 81 -3.304 14.437 -3.785 691 HB2 SER 81 HB2 SER 81 -4.932 16.540 -2.324 692 HB3 SER 81 HB1 SER 81 -3.224 16.696 -2.737 693 HG SER 81 HG SER 81 -4.228 17.646 -4.406 694 H ASN 82 HN ASN 82 -5.405 13.683 -1.223 695 HA ASN 82 HA ASN 82 -3.373 13.720 0.841 696 HB2 ASN 82 HB2 ASN 82 -5.675 14.319 1.426 697 HB3 ASN 82 HB1 ASN 82 -6.231 12.747 0.872 698 HD21 ASN 82 HD21 ASN 82 -4.310 14.400 3.292 699 HD22 ASN 82 HD22 ASN 82 -4.408 13.155 4.487 700 H ARG 83 HN ARG 83 -1.958 12.145 1.002 701 HA ARG 83 HA ARG 83 -2.030 9.810 -0.498 702 HB2 ARG 83 HB2 ARG 83 -0.383 10.593 1.900 703 HB3 ARG 83 HB1 ARG 83 -0.184 9.023 1.136 704 HG2 ARG 83 HG2 ARG 83 1.476 10.351 0.182 705 HG3 ARG 83 HG1 ARG 83 0.196 10.317 -1.034 706 HD2 ARG 83 HD2 ARG 83 1.065 12.564 -0.801 707 HD3 ARG 83 HD1 ARG 83 -0.602 12.497 -0.234 708 HE ARG 83 HE ARG 83 1.250 12.131 1.899 709 HH11 ARG 83 HH11 ARG 83 -0.215 14.535 -0.152 710 HH12 ARG 83 HH12 ARG 83 -0.001 15.828 0.984 711 HH21 ARG 83 HH21 ARG 83 1.536 13.820 3.408 712 HH22 ARG 83 HH22 ARG 83 0.998 15.417 3.015 713 H GLU 84 HN GLU 84 -3.117 10.332 2.824 714 HA GLU 84 HA GLU 84 -3.464 7.634 3.553 715 HB2 GLU 84 HB2 GLU 84 -4.831 10.159 4.434 716 HB3 GLU 84 HB1 GLU 84 -5.260 8.583 5.091 717 HG2 GLU 84 HG2 GLU 84 -3.039 8.262 5.926 718 HG3 GLU 84 HG1 GLU 84 -2.488 9.752 5.156 719 H LYS 85 HN LYS 85 -5.781 9.862 1.927 720 HA LYS 85 HA LYS 85 -7.845 7.920 1.896 721 HB2 LYS 85 HB2 LYS 85 -7.369 10.334 0.132 722 HB3 LYS 85 HB1 LYS 85 -8.784 9.306 -0.035 723 HG2 LYS 85 HG2 LYS 85 -9.441 9.862 2.260 724 HG3 LYS 85 HG1 LYS 85 -8.035 10.920 2.395 725 HD2 LYS 85 HD2 LYS 85 -8.887 12.219 0.453 726 HD3 LYS 85 HD1 LYS 85 -10.321 11.195 0.444 727 HE2 LYS 85 HE2 LYS 85 -9.440 12.932 2.746 728 HE3 LYS 85 HE1 LYS 85 -10.716 13.329 1.597 729 HZ1 LYS 85 HZ1 LYS 85 -11.974 12.407 3.215 730 HZ2 LYS 85 HZ2 LYS 85 -10.730 11.427 3.806 731 HZ3 LYS 85 HZ3 LYS 85 -11.574 10.973 2.412 732 H VAL 86 HN VAL 86 -5.330 8.694 -0.454 733 HA VAL 86 HA VAL 86 -6.186 6.897 -2.446 734 HB VAL 86 HB VAL 86 -3.422 7.962 -1.817 735 HG11 VAL 86 HG11 VAL 86 -3.221 7.265 -4.380 736 HG12 VAL 86 HG12 VAL 86 -4.346 6.013 -3.854 737 HG13 VAL 86 HG13 VAL 86 -2.776 6.175 -3.067 738 HG21 VAL 86 HG21 VAL 86 -4.422 9.803 -2.631 739 HG22 VAL 86 HG22 VAL 86 -5.760 8.891 -3.329 740 HG23 VAL 86 HG23 VAL 86 -4.228 9.011 -4.194 741 H LEU 87 HN LEU 87 -3.895 6.466 0.246 742 HA LEU 87 HA LEU 87 -3.235 3.781 -0.342 743 HB2 LEU 87 HB2 LEU 87 -1.801 5.122 1.051 744 HB3 LEU 87 HB1 LEU 87 -3.100 5.425 2.184 745 HG LEU 87 HG LEU 87 -3.076 3.038 2.808 746 HD11 LEU 87 HD11 LEU 87 -0.695 2.019 2.082 747 HD12 LEU 87 HD12 LEU 87 -1.103 2.933 0.630 748 HD13 LEU 87 HD13 LEU 87 -2.205 1.694 1.230 749 HD21 LEU 87 HD21 LEU 87 -1.211 3.200 4.238 750 HD22 LEU 87 HD22 LEU 87 -1.743 4.859 3.961 751 HD23 LEU 87 HD23 LEU 87 -0.334 4.230 3.104 752 H ILE 88 HN ILE 88 -5.604 5.175 1.903 753 HA ILE 88 HA ILE 88 -6.482 2.701 2.948 754 HB ILE 88 HB ILE 88 -7.773 5.421 2.854 755 HG12 ILE 88 HG12 ILE 88 -6.704 3.834 5.191 756 HG13 ILE 88 HG11 ILE 88 -5.704 4.929 4.243 757 HG21 ILE 88 HG21 ILE 88 -9.646 3.989 2.946 758 HG22 ILE 88 HG22 ILE 88 -9.332 4.464 4.617 759 HG23 ILE 88 HG23 ILE 88 -8.836 2.870 4.044 760 HD11 ILE 88 HD11 ILE 88 -7.924 6.433 4.933 761 HD12 ILE 88 HD12 ILE 88 -6.311 6.523 5.643 762 HD13 ILE 88 HD13 ILE 88 -7.545 5.496 6.376 763 H ALA 89 HN ALA 89 -7.786 4.699 0.272 764 HA ALA 89 HA ALA 89 -9.989 3.010 -0.276 765 HB1 ALA 89 HB1 ALA 89 -10.432 4.381 -2.044 766 HB2 ALA 89 HB2 ALA 89 -8.738 4.491 -2.524 767 HB3 ALA 89 HB3 ALA 89 -9.330 5.434 -1.154 768 H LEU 90 HN LEU 90 -6.680 3.018 -1.541 769 HA LEU 90 HA LEU 90 -7.093 0.910 -3.396 770 HB2 LEU 90 HB2 LEU 90 -4.589 1.920 -2.048 771 HB3 LEU 90 HB1 LEU 90 -4.578 0.648 -3.252 772 HG LEU 90 HG LEU 90 -5.607 3.437 -3.760 773 HD11 LEU 90 HD11 LEU 90 -3.458 4.030 -3.735 774 HD12 LEU 90 HD12 LEU 90 -3.313 3.108 -5.231 775 HD13 LEU 90 HD13 LEU 90 -2.901 2.357 -3.686 776 HD21 LEU 90 HD21 LEU 90 -6.593 2.173 -5.400 777 HD22 LEU 90 HD22 LEU 90 -5.308 0.967 -5.398 778 HD23 LEU 90 HD23 LEU 90 -5.048 2.531 -6.168 779 H ARG 91 HN ARG 91 -6.287 1.029 0.014 780 HA ARG 91 HA ARG 91 -5.465 -1.652 0.401 781 HB2 ARG 91 HB2 ARG 91 -5.218 0.326 1.988 782 HB3 ARG 91 HB1 ARG 91 -6.915 0.099 2.387 783 HG2 ARG 91 HG2 ARG 91 -5.992 -1.118 4.059 784 HG3 ARG 91 HG1 ARG 91 -6.086 -2.382 2.829 785 HD2 ARG 91 HD2 ARG 91 -3.903 -2.591 3.537 786 HD3 ARG 91 HD1 ARG 91 -3.731 -1.510 2.154 787 HE ARG 91 HE ARG 91 -4.077 -0.052 4.566 788 HH11 ARG 91 HH11 ARG 91 -1.736 -1.850 2.716 789 HH12 ARG 91 HH12 ARG 91 -0.372 -1.016 3.383 790 HH21 ARG 91 HH21 ARG 91 -2.292 1.051 5.457 791 HH22 ARG 91 HH22 ARG 91 -0.690 0.636 4.946 792 H LEU 92 HN LEU 92 -8.637 -0.068 0.714 793 HA LEU 92 HA LEU 92 -10.039 -2.393 1.489 794 HB2 LEU 92 HB2 LEU 92 -10.748 0.321 0.567 795 HB3 LEU 92 HB1 LEU 92 -11.967 -0.908 0.292 796 HG LEU 92 HG LEU 92 -12.126 -1.390 2.640 797 HD11 LEU 92 HD11 LEU 92 -9.941 -1.271 3.458 798 HD12 LEU 92 HD12 LEU 92 -10.777 0.069 4.247 799 HD13 LEU 92 HD13 LEU 92 -9.713 0.379 2.874 800 HD21 LEU 92 HD21 LEU 92 -13.088 0.616 3.414 801 HD22 LEU 92 HD22 LEU 92 -13.272 0.647 1.661 802 HD23 LEU 92 HD23 LEU 92 -12.008 1.606 2.433 803 H LEU 93 HN LEU 93 -9.372 -0.983 -1.677 804 HA LEU 93 HA LEU 93 -11.040 -2.723 -3.166 805 HB2 LEU 93 HB2 LEU 93 -8.569 -1.176 -3.936 806 HB3 LEU 93 HB1 LEU 93 -9.511 -2.109 -5.082 807 HG LEU 93 HG LEU 93 -10.609 0.193 -3.468 808 HD11 LEU 93 HD11 LEU 93 -10.584 1.035 -6.042 809 HD12 LEU 93 HD12 LEU 93 -9.094 0.091 -5.984 810 HD13 LEU 93 HD13 LEU 93 -9.340 1.423 -4.854 811 HD21 LEU 93 HD21 LEU 93 -11.930 -1.852 -4.795 812 HD22 LEU 93 HD22 LEU 93 -11.945 -0.514 -5.944 813 HD23 LEU 93 HD23 LEU 93 -12.610 -0.293 -4.326 814 H ALA 94 HN ALA 94 -7.654 -2.874 -2.171 815 HA ALA 94 HA ALA 94 -6.964 -5.213 -3.573 816 HB1 ALA 94 HB1 ALA 94 -5.686 -4.488 -0.965 817 HB2 ALA 94 HB2 ALA 94 -5.445 -3.486 -2.399 818 HB3 ALA 94 HB3 ALA 94 -4.954 -5.181 -2.412 819 H GLU 95 HN GLU 95 -8.368 -4.724 -0.368 820 HA GLU 95 HA GLU 95 -8.123 -7.362 0.562 821 HB2 GLU 95 HB2 GLU 95 -10.103 -5.165 1.179 822 HB3 GLU 95 HB1 GLU 95 -10.103 -6.711 2.018 823 HG2 GLU 95 HG2 GLU 95 -7.924 -6.300 2.912 824 HG3 GLU 95 HG1 GLU 95 -7.732 -4.862 1.911 825 H GLU 96 HN GLU 96 -10.533 -5.753 -1.423 826 HA GLU 96 HA GLU 96 -12.463 -7.799 -1.500 827 HB2 GLU 96 HB2 GLU 96 -11.738 -5.624 -3.479 828 HB3 GLU 96 HB1 GLU 96 -13.124 -6.692 -3.687 829 HG2 GLU 96 HG2 GLU 96 -12.682 -4.791 -1.390 830 HG3 GLU 96 HG1 GLU 96 -13.788 -4.553 -2.742 831 H ILE 97 HN ILE 97 -9.620 -7.143 -3.481 832 HA ILE 97 HA ILE 97 -10.046 -9.223 -5.372 833 HB ILE 97 HB ILE 97 -7.510 -7.755 -4.621 834 HG12 ILE 97 HG12 ILE 97 -9.387 -7.325 -6.945 835 HG13 ILE 97 HG11 ILE 97 -9.457 -6.407 -5.441 836 HG21 ILE 97 HG21 ILE 97 -8.083 -9.331 -7.130 837 HG22 ILE 97 HG22 ILE 97 -7.111 -9.927 -5.785 838 HG23 ILE 97 HG23 ILE 97 -6.575 -8.518 -6.706 839 HD11 ILE 97 HD11 ILE 97 -6.873 -6.529 -6.858 840 HD12 ILE 97 HD12 ILE 97 -7.597 -5.231 -5.906 841 HD13 ILE 97 HD13 ILE 97 -8.161 -5.541 -7.549 842 H GLY 98 HN GLY 98 -8.076 -8.936 -2.440 843 HA2 GLY 98 HA2 GLY 98 -6.835 -11.461 -2.554 844 HA3 GLY 98 HA1 GLY 98 -7.069 -10.506 -1.100 845 H ASP 99 HN ASP 99 -9.939 -10.465 -1.247 846 HA ASP 99 HA ASP 99 -10.560 -12.781 0.210 847 HB2 ASP 99 HB2 ASP 99 -11.804 -10.639 0.374 848 HB3 ASP 99 HB1 ASP 99 -12.485 -10.937 -1.222 849 H TYR 100 HN TYR 100 -11.035 -12.005 -3.202 850 HA TYR 100 HA TYR 100 -12.588 -14.307 -3.796 851 HB2 TYR 100 HB2 TYR 100 -12.702 -12.316 -5.211 852 HB3 TYR 100 HB1 TYR 100 -10.994 -12.477 -5.607 853 HD1 TYR 100 HD1 TYR 100 -14.277 -14.191 -5.948 854 HD2 TYR 100 HD2 TYR 100 -10.315 -13.768 -7.443 855 HE1 TYR 100 HE1 TYR 100 -14.863 -15.593 -7.882 856 HE2 TYR 100 HE2 TYR 100 -10.892 -15.168 -9.381 857 HH TYR 100 HH TYR 100 -13.035 -17.166 -9.633 858 H LYS 101 HN LYS 101 -11.939 -16.297 -4.073 859 HA LYS 101 HA LYS 101 -9.073 -16.824 -4.457 860 HB2 LYS 101 HB2 LYS 101 -11.185 -18.625 -3.247 861 HB3 LYS 101 HB1 LYS 101 -9.484 -19.028 -3.430 862 HG2 LYS 101 HG2 LYS 101 -10.542 -16.760 -1.750 863 HG3 LYS 101 HG1 LYS 101 -10.084 -18.351 -1.137 864 HD2 LYS 101 HD2 LYS 101 -7.793 -17.985 -1.978 865 HD3 LYS 101 HD1 LYS 101 -8.269 -16.373 -2.517 866 HE2 LYS 101 HE2 LYS 101 -7.126 -16.242 -0.382 867 HE3 LYS 101 HE1 LYS 101 -8.816 -15.768 -0.205 868 HZ1 LYS 101 HZ1 LYS 101 -9.309 -17.624 0.997 869 HZ2 LYS 101 HZ2 LYS 101 -7.698 -17.419 1.464 870 HZ3 LYS 101 HZ3 LYS 101 -8.094 -18.567 0.288 871 H ASP 102 HN ASP 102 -8.409 -18.302 -6.008 872 HA ASP 102 HA ASP 102 -9.949 -18.493 -8.355 873 HB2 ASP 102 HB2 ASP 102 -7.477 -18.574 -8.332 874 HB3 ASP 102 HB1 ASP 102 -7.546 -20.158 -7.565 875 H ASP 103 HN ASP 103 -9.295 -20.842 -5.791 876 HA ASP 103 HA ASP 103 -11.025 -22.805 -7.075 877 HB2 ASP 103 HB2 ASP 103 -8.873 -23.516 -6.019 878 HB3 ASP 103 HB1 ASP 103 -9.514 -23.014 -4.458 879 H ASP 104 HN ASP 104 -13.132 -22.488 -6.804 880 HA ASP 104 HA ASP 104 -14.308 -20.980 -4.731 881 HB2 ASP 104 HB2 ASP 104 -15.289 -21.478 -7.023 882 HB3 ASP 104 HB1 ASP 104 -15.735 -23.058 -6.388 883 H ASP 105 HN ASP 105 -13.521 -24.370 -4.987 884 HA ASP 105 HA ASP 105 -15.142 -25.068 -2.672 885 HB2 ASP 105 HB2 ASP 105 -14.901 -26.650 -4.582 886 HB3 ASP 105 HB1 ASP 105 -13.182 -26.775 -4.225 887 H LYS 106 HN LYS 106 -14.321 -24.182 -0.849 888 HA LYS 106 HA LYS 106 -11.568 -24.933 -0.137 889 HB2 LYS 106 HB2 LYS 106 -11.652 -22.538 -0.763 890 HB3 LYS 106 HB1 LYS 106 -12.887 -22.273 0.460 891 HG2 LYS 106 HG2 LYS 106 -11.304 -22.875 2.212 892 HG3 LYS 106 HG1 LYS 106 -10.066 -23.190 0.994 893 HD2 LYS 106 HD2 LYS 106 -10.193 -20.840 0.280 894 HD3 LYS 106 HD1 LYS 106 -11.404 -20.536 1.530 895 HE2 LYS 106 HE2 LYS 106 -8.582 -21.488 2.021 896 HE3 LYS 106 HE1 LYS 106 -9.144 -19.827 2.211 897 HZ1 LYS 106 HZ1 LYS 106 -9.669 -22.172 3.885 898 HZ2 LYS 106 HZ2 LYS 106 -10.879 -20.996 3.771 899 HZ3 LYS 106 HZ3 LYS 106 -9.341 -20.575 4.337 Start of MODEL 5 1 H1 MET 1 HT1 MET 1 -17.287 -10.693 -19.968 2 H2 MET 1 HT2 MET 1 -16.464 -12.169 -19.876 3 H3 MET 1 HT3 MET 1 -17.770 -11.992 -20.935 4 HA MET 1 HA MET 1 -15.680 -11.931 -22.127 5 HB2 MET 1 HB2 MET 1 -16.047 -9.788 -23.310 6 HB3 MET 1 HB1 MET 1 -17.541 -10.676 -23.047 7 HG2 MET 1 HG2 MET 1 -18.052 -9.225 -21.138 8 HG3 MET 1 HG1 MET 1 -16.568 -8.323 -21.438 9 HE1 MET 1 HE1 MET 1 -17.913 -5.998 -21.597 10 HE2 MET 1 HE2 MET 1 -19.347 -6.931 -21.167 11 HE3 MET 1 HE3 MET 1 -19.393 -5.828 -22.542 12 H ALA 2 HN ALA 2 -15.556 -10.581 -19.157 13 HA ALA 2 HA ALA 2 -13.092 -9.070 -19.706 14 HB1 ALA 2 HB1 ALA 2 -13.445 -8.133 -17.401 15 HB2 ALA 2 HB2 ALA 2 -15.010 -8.945 -17.389 16 HB3 ALA 2 HB3 ALA 2 -14.676 -7.694 -18.587 17 HA PRO 3 HA PRO 3 -11.069 -12.767 -18.061 18 HB2 PRO 3 HB2 PRO 3 -8.715 -10.984 -18.420 19 HB3 PRO 3 HB1 PRO 3 -8.972 -12.636 -18.994 20 HG2 PRO 3 HG2 PRO 3 -9.093 -10.607 -20.698 21 HG3 PRO 3 HG1 PRO 3 -10.258 -11.942 -20.812 22 HD2 PRO 3 HD2 PRO 3 -10.623 -9.205 -19.634 23 HD3 PRO 3 HD1 PRO 3 -11.723 -10.137 -20.674 24 H LEU 4 HN LEU 4 -10.226 -13.324 -16.092 25 HA LEU 4 HA LEU 4 -10.016 -11.140 -14.131 26 HB2 LEU 4 HB2 LEU 4 -10.632 -14.055 -13.632 27 HB3 LEU 4 HB1 LEU 4 -10.625 -12.777 -12.432 28 HG LEU 4 HG LEU 4 -12.556 -13.029 -14.739 29 HD11 LEU 4 HD11 LEU 4 -13.191 -13.185 -11.812 30 HD12 LEU 4 HD12 LEU 4 -12.758 -14.613 -12.753 31 HD13 LEU 4 HD13 LEU 4 -14.182 -13.667 -13.189 32 HD21 LEU 4 HD21 LEU 4 -12.441 -10.754 -14.458 33 HD22 LEU 4 HD22 LEU 4 -12.066 -10.872 -12.737 34 HD23 LEU 4 HD23 LEU 4 -13.707 -11.178 -13.305 35 H ARG 5 HN ARG 5 -8.210 -10.937 -12.904 36 HA ARG 5 HA ARG 5 -6.212 -13.047 -12.914 37 HB2 ARG 5 HB2 ARG 5 -4.537 -10.974 -13.303 38 HB3 ARG 5 HB1 ARG 5 -5.105 -12.023 -14.594 39 HG2 ARG 5 HG2 ARG 5 -6.971 -9.895 -14.124 40 HG3 ARG 5 HG1 ARG 5 -5.354 -9.254 -14.427 41 HD2 ARG 5 HD2 ARG 5 -5.271 -10.116 -16.554 42 HD3 ARG 5 HD1 ARG 5 -6.373 -11.437 -16.171 43 HE ARG 5 HE ARG 5 -8.201 -9.918 -16.391 44 HH11 ARG 5 HH11 ARG 5 -5.121 -8.602 -17.369 45 HH12 ARG 5 HH12 ARG 5 -5.822 -7.348 -18.335 46 HH21 ARG 5 HH21 ARG 5 -9.128 -8.279 -17.653 47 HH22 ARG 5 HH22 ARG 5 -8.107 -7.162 -18.497 48 H LYS 6 HN LYS 6 -4.413 -12.560 -11.367 49 HA LYS 6 HA LYS 6 -5.461 -11.752 -8.872 50 HB2 LYS 6 HB2 LYS 6 -2.597 -12.214 -9.715 51 HB3 LYS 6 HB1 LYS 6 -3.122 -11.992 -8.053 52 HG2 LYS 6 HG2 LYS 6 -3.986 -14.236 -9.872 53 HG3 LYS 6 HG1 LYS 6 -2.764 -14.350 -8.605 54 HD2 LYS 6 HD2 LYS 6 -4.519 -13.689 -6.956 55 HD3 LYS 6 HD1 LYS 6 -5.707 -13.787 -8.255 56 HE2 LYS 6 HE2 LYS 6 -3.952 -16.044 -7.290 57 HE3 LYS 6 HE1 LYS 6 -5.662 -15.838 -6.918 58 HZ1 LYS 6 HZ1 LYS 6 -5.718 -17.303 -8.676 59 HZ2 LYS 6 HZ2 LYS 6 -4.399 -16.593 -9.464 60 HZ3 LYS 6 HZ3 LYS 6 -5.903 -15.823 -9.483 61 H THR 7 HN THR 7 -3.431 -10.163 -11.227 62 HA THR 7 HA THR 7 -3.041 -7.834 -9.567 63 HB THR 7 HB THR 7 -2.148 -6.945 -11.892 64 HG1 THR 7 HG1 THR 7 -2.854 -8.680 -13.149 65 HG21 THR 7 HG21 THR 7 -0.979 -8.440 -9.724 66 HG22 THR 7 HG22 THR 7 -0.298 -7.111 -10.665 67 HG23 THR 7 HG23 THR 7 -0.133 -8.772 -11.236 68 H ALA 8 HN ALA 8 -4.402 -6.230 -9.406 69 HA ALA 8 HA ALA 8 -6.663 -6.009 -11.211 70 HB1 ALA 8 HB1 ALA 8 -6.825 -5.801 -8.701 71 HB2 ALA 8 HB2 ALA 8 -7.592 -4.512 -9.632 72 HB3 ALA 8 HB3 ALA 8 -6.027 -4.236 -8.866 73 H VAL 9 HN VAL 9 -7.240 -4.074 -12.300 74 HA VAL 9 HA VAL 9 -4.890 -2.451 -13.011 75 HB VAL 9 HB VAL 9 -7.341 -3.012 -14.684 76 HG11 VAL 9 HG11 VAL 9 -6.699 -0.939 -15.455 77 HG12 VAL 9 HG12 VAL 9 -5.693 -1.979 -16.462 78 HG13 VAL 9 HG13 VAL 9 -5.002 -1.189 -15.046 79 HG21 VAL 9 HG21 VAL 9 -6.196 -4.623 -15.800 80 HG22 VAL 9 HG22 VAL 9 -5.376 -4.768 -14.245 81 HG23 VAL 9 HG23 VAL 9 -4.635 -3.841 -15.552 82 H LEU 10 HN LEU 10 -4.948 -0.430 -12.397 83 HA LEU 10 HA LEU 10 -7.543 0.812 -11.733 84 HB2 LEU 10 HB2 LEU 10 -5.650 0.383 -9.941 85 HB3 LEU 10 HB1 LEU 10 -4.921 1.801 -10.659 86 HG LEU 10 HG LEU 10 -6.203 2.276 -8.589 87 HD11 LEU 10 HD11 LEU 10 -7.872 3.896 -10.113 88 HD12 LEU 10 HD12 LEU 10 -6.448 3.623 -11.119 89 HD13 LEU 10 HD13 LEU 10 -6.265 4.290 -9.497 90 HD21 LEU 10 HD21 LEU 10 -8.729 1.825 -10.132 91 HD22 LEU 10 HD22 LEU 10 -8.506 2.019 -8.393 92 HD23 LEU 10 HD23 LEU 10 -7.996 0.528 -9.190 93 H LYS 11 HN LYS 11 -8.078 2.632 -12.926 94 HA LYS 11 HA LYS 11 -5.933 3.628 -14.677 95 HB2 LYS 11 HB2 LYS 11 -8.900 3.451 -15.210 96 HB3 LYS 11 HB1 LYS 11 -7.806 4.424 -16.183 97 HG2 LYS 11 HG2 LYS 11 -6.540 2.408 -16.758 98 HG3 LYS 11 HG1 LYS 11 -7.670 1.440 -15.814 99 HD2 LYS 11 HD2 LYS 11 -9.499 2.134 -17.270 100 HD3 LYS 11 HD1 LYS 11 -8.388 3.145 -18.200 101 HE2 LYS 11 HE2 LYS 11 -7.118 1.157 -18.843 102 HE3 LYS 11 HE1 LYS 11 -8.219 0.145 -17.908 103 HZ1 LYS 11 HZ1 LYS 11 -8.478 0.876 -20.550 104 HZ2 LYS 11 HZ2 LYS 11 -9.650 1.784 -19.735 105 HZ3 LYS 11 HZ3 LYS 11 -9.639 0.098 -19.594 106 H LEU 12 HN LEU 12 -5.382 5.666 -14.488 107 HA LEU 12 HA LEU 12 -7.046 7.370 -12.769 108 HB2 LEU 12 HB2 LEU 12 -4.372 6.754 -12.561 109 HB3 LEU 12 HB1 LEU 12 -4.329 8.299 -13.386 110 HG LEU 12 HG LEU 12 -5.474 7.702 -10.662 111 HD11 LEU 12 HD11 LEU 12 -3.344 9.635 -11.557 112 HD12 LEU 12 HD12 LEU 12 -3.034 8.044 -10.865 113 HD13 LEU 12 HD13 LEU 12 -3.833 9.286 -9.899 114 HD21 LEU 12 HD21 LEU 12 -5.918 10.041 -12.467 115 HD22 LEU 12 HD22 LEU 12 -5.838 10.278 -10.721 116 HD23 LEU 12 HD23 LEU 12 -7.057 9.206 -11.410 117 H TYR 13 HN TYR 13 -8.084 9.085 -13.811 118 HA TYR 13 HA TYR 13 -7.200 9.703 -16.543 119 HB2 TYR 13 HB2 TYR 13 -9.761 10.354 -15.064 120 HB3 TYR 13 HB1 TYR 13 -9.415 10.772 -16.738 121 HD1 TYR 13 HD1 TYR 13 -10.335 8.089 -14.437 122 HD2 TYR 13 HD2 TYR 13 -9.353 9.033 -18.469 123 HE1 TYR 13 HE1 TYR 13 -11.226 5.915 -15.156 124 HE2 TYR 13 HE2 TYR 13 -10.244 6.858 -19.197 125 HH TYR 13 HH TYR 13 -11.372 5.021 -18.582 126 H VAL 14 HN VAL 14 -5.975 11.488 -16.773 127 HA VAL 14 HA VAL 14 -6.319 13.677 -14.819 128 HB VAL 14 HB VAL 14 -3.904 14.167 -15.035 129 HG11 VAL 14 HG11 VAL 14 -4.613 13.033 -13.066 130 HG12 VAL 14 HG12 VAL 14 -3.153 12.216 -13.629 131 HG13 VAL 14 HG13 VAL 14 -4.736 11.494 -13.922 132 HG21 VAL 14 HG21 VAL 14 -4.002 12.358 -17.146 133 HG22 VAL 14 HG22 VAL 14 -3.106 11.517 -15.880 134 HG23 VAL 14 HG23 VAL 14 -2.558 13.094 -16.451 135 H ALA 15 HN ALA 15 -5.574 15.788 -15.607 136 HA ALA 15 HA ALA 15 -5.909 16.028 -18.522 137 HB1 ALA 15 HB1 ALA 15 -7.572 17.500 -18.297 138 HB2 ALA 15 HB2 ALA 15 -6.696 18.409 -17.067 139 HB3 ALA 15 HB3 ALA 15 -7.658 17.003 -16.606 140 H GLY 16 HN GLY 16 -3.764 16.235 -19.053 141 HA2 GLY 16 HA2 GLY 16 -1.836 17.411 -19.464 142 HA3 GLY 16 HA1 GLY 16 -2.584 18.792 -18.679 143 H ASN 17 HN ASN 17 -0.608 19.328 -17.714 144 HA ASN 17 HA ASN 17 0.227 17.527 -15.543 145 HB2 ASN 17 HB2 ASN 17 2.439 18.598 -15.661 146 HB3 ASN 17 HB1 ASN 17 1.999 17.876 -17.203 147 HD21 ASN 17 HD21 ASN 17 3.840 20.101 -16.417 148 HD22 ASN 17 HD22 ASN 17 3.380 21.426 -17.423 149 H THR 18 HN THR 18 -1.961 19.207 -15.219 150 HA THR 18 HA THR 18 -1.257 21.647 -13.934 151 HB THR 18 HB THR 18 -3.580 21.646 -13.100 152 HG1 THR 18 HG1 THR 18 -4.592 19.813 -12.904 153 HG21 THR 18 HG21 THR 18 -4.162 20.751 -15.797 154 HG22 THR 18 HG22 THR 18 -2.748 21.803 -15.738 155 HG23 THR 18 HG23 THR 18 -4.289 22.362 -15.090 156 HA PRO 19 HA PRO 19 0.072 20.502 -9.937 157 HB2 PRO 19 HB2 PRO 19 -2.163 22.150 -8.813 158 HB3 PRO 19 HB1 PRO 19 -0.438 22.188 -8.426 159 HG2 PRO 19 HG2 PRO 19 -1.451 24.070 -9.971 160 HG3 PRO 19 HG1 PRO 19 0.104 23.329 -10.400 161 HD2 PRO 19 HD2 PRO 19 -2.616 22.825 -11.554 162 HD3 PRO 19 HD1 PRO 19 -1.053 22.980 -12.382 163 H ASN 20 HN ASN 20 -3.453 20.330 -10.323 164 HA ASN 20 HA ASN 20 -3.834 18.559 -8.119 165 HB2 ASN 20 HB2 ASN 20 -6.069 18.082 -9.234 166 HB3 ASN 20 HB1 ASN 20 -5.755 19.754 -8.793 167 HD21 ASN 20 HD21 ASN 20 -7.097 17.925 -11.080 168 HD22 ASN 20 HD22 ASN 20 -6.869 18.931 -12.465 169 H SER 21 HN SER 21 -3.557 18.073 -11.652 170 HA SER 21 HA SER 21 -3.763 15.238 -11.628 171 HB2 SER 21 HB2 SER 21 -2.446 17.120 -13.603 172 HB3 SER 21 HB1 SER 21 -2.736 15.405 -13.889 173 HG SER 21 HG SER 21 -4.427 17.484 -14.166 174 H VAL 22 HN VAL 22 -0.943 17.403 -11.517 175 HA VAL 22 HA VAL 22 0.942 15.295 -11.558 176 HB VAL 22 HB VAL 22 1.161 18.143 -10.563 177 HG11 VAL 22 HG11 VAL 22 2.793 16.986 -9.302 178 HG12 VAL 22 HG12 VAL 22 3.651 17.736 -10.650 179 HG13 VAL 22 HG13 VAL 22 3.280 16.012 -10.690 180 HG21 VAL 22 HG21 VAL 22 2.869 17.717 -12.714 181 HG22 VAL 22 HG22 VAL 22 1.320 18.562 -12.742 182 HG23 VAL 22 HG23 VAL 22 1.396 16.842 -13.131 183 H ARG 23 HN ARG 23 -0.545 17.086 -8.888 184 HA ARG 23 HA ARG 23 0.861 15.868 -6.771 185 HB2 ARG 23 HB2 ARG 23 -0.610 17.932 -6.702 186 HB3 ARG 23 HB1 ARG 23 -1.990 16.834 -6.711 187 HG2 ARG 23 HG2 ARG 23 -1.504 15.997 -4.613 188 HG3 ARG 23 HG1 ARG 23 0.139 16.642 -4.622 189 HD2 ARG 23 HD2 ARG 23 -0.746 18.910 -4.521 190 HD3 ARG 23 HD1 ARG 23 -2.394 18.285 -4.560 191 HE ARG 23 HE ARG 23 -1.165 17.083 -2.399 192 HH11 ARG 23 HH11 ARG 23 -1.909 20.328 -3.419 193 HH12 ARG 23 HH12 ARG 23 -2.064 20.942 -1.806 194 HH21 ARG 23 HH21 ARG 23 -1.364 17.872 -0.272 195 HH22 ARG 23 HH22 ARG 23 -1.752 19.540 -0.011 196 H ALA 24 HN ALA 24 -2.239 15.113 -8.307 197 HA ALA 24 HA ALA 24 -2.884 12.923 -6.676 198 HB1 ALA 24 HB1 ALA 24 -3.883 12.630 -9.378 199 HB2 ALA 24 HB2 ALA 24 -4.102 14.270 -8.761 200 HB3 ALA 24 HB3 ALA 24 -4.761 12.894 -7.870 201 H LEU 25 HN LEU 25 -1.194 13.143 -9.767 202 HA LEU 25 HA LEU 25 -0.868 10.399 -10.276 203 HB2 LEU 25 HB2 LEU 25 -0.523 12.102 -11.980 204 HB3 LEU 25 HB1 LEU 25 0.844 12.747 -11.093 205 HG LEU 25 HG LEU 25 2.078 10.650 -11.488 206 HD11 LEU 25 HD11 LEU 25 1.051 9.209 -13.385 207 HD12 LEU 25 HD12 LEU 25 -0.481 9.883 -12.830 208 HD13 LEU 25 HD13 LEU 25 0.525 8.952 -11.721 209 HD21 LEU 25 HD21 LEU 25 2.374 12.512 -13.013 210 HD22 LEU 25 HD22 LEU 25 0.991 11.978 -13.967 211 HD23 LEU 25 HD23 LEU 25 2.447 10.986 -13.894 212 H LYS 26 HN LYS 26 1.331 12.674 -8.616 213 HA LYS 26 HA LYS 26 3.365 10.774 -8.149 214 HB2 LYS 26 HB2 LYS 26 2.642 13.314 -6.690 215 HB3 LYS 26 HB1 LYS 26 4.048 12.342 -6.276 216 HG2 LYS 26 HG2 LYS 26 4.937 12.670 -8.534 217 HG3 LYS 26 HG1 LYS 26 3.529 13.657 -8.937 218 HD2 LYS 26 HD2 LYS 26 4.144 15.255 -7.195 219 HD3 LYS 26 HD1 LYS 26 5.539 14.262 -6.767 220 HE2 LYS 26 HE2 LYS 26 6.464 14.597 -9.007 221 HE3 LYS 26 HE1 LYS 26 5.067 15.583 -9.437 222 HZ1 LYS 26 HZ1 LYS 26 7.082 16.210 -7.347 223 HZ2 LYS 26 HZ2 LYS 26 5.706 17.138 -7.671 224 HZ3 LYS 26 HZ3 LYS 26 6.914 16.981 -8.844 225 H THR 27 HN THR 27 0.527 11.708 -6.269 226 HA THR 27 HA THR 27 1.096 10.194 -3.950 227 HB THR 27 HB THR 27 -1.557 11.123 -5.067 228 HG1 THR 27 HG1 THR 27 -0.392 12.933 -4.654 229 HG21 THR 27 HG21 THR 27 -2.373 9.826 -3.419 230 HG22 THR 27 HG22 THR 27 -1.813 11.123 -2.363 231 HG23 THR 27 HG23 THR 27 -0.810 9.691 -2.614 232 H LEU 28 HN LEU 28 -0.829 9.486 -6.857 233 HA LEU 28 HA LEU 28 -1.719 6.941 -5.950 234 HB2 LEU 28 HB2 LEU 28 -2.006 8.596 -8.302 235 HB3 LEU 28 HB1 LEU 28 -1.760 6.921 -8.752 236 HG LEU 28 HG LEU 28 -4.103 7.294 -8.653 237 HD11 LEU 28 HD11 LEU 28 -4.508 5.360 -7.645 238 HD12 LEU 28 HD12 LEU 28 -4.090 6.018 -6.062 239 HD13 LEU 28 HD13 LEU 28 -2.826 5.375 -7.111 240 HD21 LEU 28 HD21 LEU 28 -3.402 8.956 -6.381 241 HD22 LEU 28 HD22 LEU 28 -4.782 7.906 -6.050 242 HD23 LEU 28 HD23 LEU 28 -4.821 9.005 -7.428 243 H ALA 29 HN ALA 29 0.807 7.881 -8.319 244 HA ALA 29 HA ALA 29 1.539 5.271 -9.021 245 HB1 ALA 29 HB1 ALA 29 3.820 6.781 -9.387 246 HB2 ALA 29 HB2 ALA 29 2.506 7.951 -9.512 247 HB3 ALA 29 HB3 ALA 29 2.523 6.529 -10.557 248 H ASN 30 HN ASN 30 2.925 7.410 -6.511 249 HA ASN 30 HA ASN 30 5.065 5.614 -5.903 250 HB2 ASN 30 HB2 ASN 30 4.994 8.088 -5.316 251 HB3 ASN 30 HB1 ASN 30 3.872 7.668 -4.026 252 HD21 ASN 30 HD21 ASN 30 5.100 8.124 -2.289 253 HD22 ASN 30 HD22 ASN 30 6.595 7.342 -1.919 254 H ILE 31 HN ILE 31 1.849 6.055 -4.516 255 HA ILE 31 HA ILE 31 2.229 4.217 -2.445 256 HB ILE 31 HB ILE 31 -0.253 5.277 -3.735 257 HG12 ILE 31 HG12 ILE 31 0.869 5.549 -0.949 258 HG13 ILE 31 HG11 ILE 31 1.210 6.670 -2.260 259 HG21 ILE 31 HG21 ILE 31 -1.671 3.992 -2.520 260 HG22 ILE 31 HG22 ILE 31 -0.506 3.732 -1.221 261 HG23 ILE 31 HG23 ILE 31 -0.369 2.821 -2.725 262 HD11 ILE 31 HD11 ILE 31 -0.555 7.394 -0.664 263 HD12 ILE 31 HD12 ILE 31 -1.552 6.075 -1.272 264 HD13 ILE 31 HD13 ILE 31 -1.043 7.367 -2.358 265 H LEU 32 HN LEU 32 0.870 3.797 -5.703 266 HA LEU 32 HA LEU 32 0.376 1.026 -5.390 267 HB2 LEU 32 HB2 LEU 32 0.632 2.777 -7.815 268 HB3 LEU 32 HB1 LEU 32 0.298 1.058 -7.929 269 HG LEU 32 HG LEU 32 -1.446 2.966 -6.360 270 HD11 LEU 32 HD11 LEU 32 -2.961 2.970 -8.243 271 HD12 LEU 32 HD12 LEU 32 -1.869 1.939 -9.167 272 HD13 LEU 32 HD13 LEU 32 -1.390 3.585 -8.754 273 HD21 LEU 32 HD21 LEU 32 -2.797 0.691 -7.359 274 HD22 LEU 32 HD22 LEU 32 -2.454 1.117 -5.683 275 HD23 LEU 32 HD23 LEU 32 -1.309 0.136 -6.595 276 H GLU 33 HN GLU 33 3.192 2.801 -6.544 277 HA GLU 33 HA GLU 33 4.574 0.534 -7.551 278 HB2 GLU 33 HB2 GLU 33 5.552 3.264 -6.735 279 HB3 GLU 33 HB1 GLU 33 6.609 2.025 -7.398 280 HG2 GLU 33 HG2 GLU 33 5.274 1.979 -9.442 281 HG3 GLU 33 HG1 GLU 33 4.209 3.212 -8.766 282 H LYS 34 HN LYS 34 4.516 2.039 -4.345 283 HA LYS 34 HA LYS 34 6.544 0.081 -3.498 284 HB2 LYS 34 HB2 LYS 34 5.751 2.772 -2.455 285 HB3 LYS 34 HB1 LYS 34 6.535 1.619 -1.385 286 HG2 LYS 34 HG2 LYS 34 7.684 2.513 -4.018 287 HG3 LYS 34 HG1 LYS 34 8.069 3.259 -2.466 288 HD2 LYS 34 HD2 LYS 34 8.468 0.327 -3.054 289 HD3 LYS 34 HD1 LYS 34 9.724 1.546 -3.276 290 HE2 LYS 34 HE2 LYS 34 9.499 2.150 -0.886 291 HE3 LYS 34 HE1 LYS 34 8.331 0.845 -0.692 292 HZ1 LYS 34 HZ1 LYS 34 11.166 0.524 -1.520 293 HZ2 LYS 34 HZ2 LYS 34 10.046 -0.732 -1.348 294 HZ3 LYS 34 HZ3 LYS 34 10.532 0.158 0.006 295 H GLU 35 HN GLU 35 3.557 1.578 -2.235 296 HA GLU 35 HA GLU 35 3.234 -0.266 -0.122 297 HB2 GLU 35 HB2 GLU 35 1.295 1.607 -1.486 298 HB3 GLU 35 HB1 GLU 35 0.850 0.616 -0.100 299 HG2 GLU 35 HG2 GLU 35 3.014 2.710 -0.153 300 HG3 GLU 35 HG1 GLU 35 1.419 2.882 0.574 301 H PHE 36 HN PHE 36 1.934 -0.220 -3.425 302 HA PHE 36 HA PHE 36 0.890 -2.925 -2.900 303 HB2 PHE 36 HB2 PHE 36 -0.183 -0.856 -4.813 304 HB3 PHE 36 HB1 PHE 36 -0.762 -2.513 -4.714 305 HD1 PHE 36 HD1 PHE 36 -0.747 0.763 -3.142 306 HD2 PHE 36 HD2 PHE 36 -1.999 -3.285 -2.761 307 HE1 PHE 36 HE1 PHE 36 -2.293 1.415 -1.343 308 HE2 PHE 36 HE2 PHE 36 -3.550 -2.639 -0.964 309 HZ PHE 36 HZ PHE 36 -3.696 -0.288 -0.253 310 H LYS 37 HN LYS 37 3.578 -2.197 -3.832 311 HA LYS 37 HA LYS 37 4.064 -2.559 -6.506 312 HB2 LYS 37 HB2 LYS 37 5.808 -2.100 -4.829 313 HB3 LYS 37 HB1 LYS 37 5.650 -3.742 -4.217 314 HG2 LYS 37 HG2 LYS 37 6.346 -4.577 -6.458 315 HG3 LYS 37 HG1 LYS 37 6.643 -2.904 -6.935 316 HD2 LYS 37 HD2 LYS 37 7.955 -4.216 -4.559 317 HD3 LYS 37 HD1 LYS 37 8.669 -4.185 -6.172 318 HE2 LYS 37 HE2 LYS 37 8.583 -1.717 -6.122 319 HE3 LYS 37 HE1 LYS 37 7.954 -1.793 -4.478 320 HZ1 LYS 37 HZ1 LYS 37 10.311 -1.400 -4.440 321 HZ2 LYS 37 HZ2 LYS 37 10.607 -2.765 -5.393 322 HZ3 LYS 37 HZ3 LYS 37 10.003 -2.946 -3.824 323 H GLY 38 HN GLY 38 3.624 -4.094 -7.924 324 HA2 GLY 38 HA2 GLY 38 3.573 -6.218 -8.848 325 HA3 GLY 38 HA1 GLY 38 3.946 -6.884 -7.270 326 H VAL 39 HN VAL 39 1.338 -4.900 -6.754 327 HA VAL 39 HA VAL 39 -0.454 -7.193 -7.155 328 HB VAL 39 HB VAL 39 -0.862 -4.915 -5.205 329 HG11 VAL 39 HG11 VAL 39 -2.554 -6.435 -4.213 330 HG12 VAL 39 HG12 VAL 39 -2.309 -7.539 -5.568 331 HG13 VAL 39 HG13 VAL 39 -2.955 -5.922 -5.854 332 HG21 VAL 39 HG21 VAL 39 1.122 -6.435 -4.754 333 HG22 VAL 39 HG22 VAL 39 -0.054 -7.728 -4.510 334 HG23 VAL 39 HG23 VAL 39 -0.078 -6.306 -3.466 335 H TYR 40 HN TYR 40 -0.300 -3.650 -7.513 336 HA TYR 40 HA TYR 40 -2.659 -3.933 -9.223 337 HB2 TYR 40 HB2 TYR 40 -1.822 -1.699 -7.410 338 HB3 TYR 40 HB1 TYR 40 -2.775 -1.313 -8.830 339 HD1 TYR 40 HD1 TYR 40 -2.793 -3.298 -5.690 340 HD2 TYR 40 HD2 TYR 40 -5.083 -1.559 -8.823 341 HE1 TYR 40 HE1 TYR 40 -4.854 -3.726 -4.418 342 HE2 TYR 40 HE2 TYR 40 -7.145 -1.989 -7.567 343 HH TYR 40 HH TYR 40 -8.022 -3.108 -5.816 344 H ALA 41 HN ALA 41 -2.718 -3.006 -11.222 345 HA ALA 41 HA ALA 41 -0.158 -1.971 -12.238 346 HB1 ALA 41 HB1 ALA 41 -2.467 -2.880 -13.940 347 HB2 ALA 41 HB2 ALA 41 -1.303 -4.029 -13.278 348 HB3 ALA 41 HB3 ALA 41 -0.761 -2.754 -14.372 349 H LEU 42 HN LEU 42 -0.051 0.177 -12.656 350 HA LEU 42 HA LEU 42 -2.534 1.693 -12.532 351 HB2 LEU 42 HB2 LEU 42 -0.713 2.409 -11.084 352 HB3 LEU 42 HB1 LEU 42 0.341 2.609 -12.469 353 HG LEU 42 HG LEU 42 -1.104 4.437 -13.292 354 HD11 LEU 42 HD11 LEU 42 -2.662 5.372 -11.414 355 HD12 LEU 42 HD12 LEU 42 -2.692 3.692 -10.878 356 HD13 LEU 42 HD13 LEU 42 -3.239 4.109 -12.501 357 HD21 LEU 42 HD21 LEU 42 0.867 4.702 -11.655 358 HD22 LEU 42 HD22 LEU 42 -0.376 5.048 -10.452 359 HD23 LEU 42 HD23 LEU 42 -0.228 6.065 -11.887 360 H LYS 43 HN LYS 43 -3.479 2.608 -14.177 361 HA LYS 43 HA LYS 43 -2.017 2.960 -16.701 362 HB2 LYS 43 HB2 LYS 43 -4.386 1.364 -16.164 363 HB3 LYS 43 HB1 LYS 43 -4.721 2.625 -17.343 364 HG2 LYS 43 HG2 LYS 43 -4.044 1.001 -18.754 365 HG3 LYS 43 HG1 LYS 43 -2.470 1.714 -18.399 366 HD2 LYS 43 HD2 LYS 43 -1.922 -0.011 -16.886 367 HD3 LYS 43 HD1 LYS 43 -3.593 -0.577 -16.807 368 HE2 LYS 43 HE2 LYS 43 -2.415 -2.122 -18.169 369 HE3 LYS 43 HE1 LYS 43 -3.409 -1.142 -19.247 370 HZ1 LYS 43 HZ1 LYS 43 -1.617 -0.253 -20.228 371 HZ2 LYS 43 HZ2 LYS 43 -0.805 -1.608 -19.622 372 HZ3 LYS 43 HZ3 LYS 43 -0.731 -0.137 -18.790 373 H VAL 44 HN VAL 44 -1.737 5.059 -16.792 374 HA VAL 44 HA VAL 44 -3.840 6.904 -15.904 375 HB VAL 44 HB VAL 44 -0.982 7.370 -16.760 376 HG11 VAL 44 HG11 VAL 44 -2.068 9.375 -17.298 377 HG12 VAL 44 HG12 VAL 44 -1.435 9.658 -15.678 378 HG13 VAL 44 HG13 VAL 44 -3.141 9.271 -15.902 379 HG21 VAL 44 HG21 VAL 44 -1.849 6.308 -14.423 380 HG22 VAL 44 HG22 VAL 44 -1.819 8.028 -14.030 381 HG23 VAL 44 HG23 VAL 44 -0.357 7.230 -14.610 382 H ILE 45 HN ILE 45 -5.117 7.936 -17.172 383 HA ILE 45 HA ILE 45 -4.734 7.710 -20.080 384 HB ILE 45 HB ILE 45 -7.258 8.181 -18.492 385 HG12 ILE 45 HG12 ILE 45 -6.385 5.966 -18.009 386 HG13 ILE 45 HG11 ILE 45 -7.841 5.840 -18.985 387 HG21 ILE 45 HG21 ILE 45 -7.279 9.023 -20.837 388 HG22 ILE 45 HG22 ILE 45 -8.486 7.771 -20.517 389 HG23 ILE 45 HG23 ILE 45 -7.000 7.370 -21.386 390 HD11 ILE 45 HD11 ILE 45 -5.020 5.569 -19.987 391 HD12 ILE 45 HD12 ILE 45 -6.486 5.405 -20.955 392 HD13 ILE 45 HD13 ILE 45 -6.142 4.246 -19.668 393 H ASP 46 HN ASP 46 -4.018 9.631 -20.932 394 HA ASP 46 HA ASP 46 -4.542 12.114 -19.538 395 HB2 ASP 46 HB2 ASP 46 -2.352 11.578 -20.689 396 HB3 ASP 46 HB1 ASP 46 -3.199 11.776 -22.221 397 H VAL 47 HN VAL 47 -6.611 12.775 -19.742 398 HA VAL 47 HA VAL 47 -8.240 12.232 -21.979 399 HB VAL 47 HB VAL 47 -9.896 13.689 -20.964 400 HG11 VAL 47 HG11 VAL 47 -9.374 12.611 -18.471 401 HG12 VAL 47 HG12 VAL 47 -8.518 11.536 -19.577 402 HG13 VAL 47 HG13 VAL 47 -10.245 11.824 -19.786 403 HG21 VAL 47 HG21 VAL 47 -8.346 15.485 -20.247 404 HG22 VAL 47 HG22 VAL 47 -7.779 14.436 -18.947 405 HG23 VAL 47 HG23 VAL 47 -9.458 14.979 -18.973 406 H LEU 48 HN LEU 48 -6.200 15.038 -21.271 407 HA LEU 48 HA LEU 48 -7.419 16.711 -23.228 408 HB2 LEU 48 HB2 LEU 48 -4.748 16.877 -21.863 409 HB3 LEU 48 HB1 LEU 48 -5.287 18.059 -23.040 410 HG LEU 48 HG LEU 48 -6.713 17.435 -20.451 411 HD11 LEU 48 HD11 LEU 48 -4.919 19.734 -21.214 412 HD12 LEU 48 HD12 LEU 48 -4.598 18.500 -19.995 413 HD13 LEU 48 HD13 LEU 48 -5.904 19.659 -19.753 414 HD21 LEU 48 HD21 LEU 48 -7.661 19.811 -21.187 415 HD22 LEU 48 HD22 LEU 48 -8.408 18.297 -21.692 416 HD23 LEU 48 HD23 LEU 48 -7.322 19.153 -22.787 417 H LYS 49 HN LYS 49 -4.600 14.551 -23.350 418 HA LYS 49 HA LYS 49 -3.863 15.343 -25.990 419 HB2 LYS 49 HB2 LYS 49 -3.124 12.924 -24.353 420 HB3 LYS 49 HB1 LYS 49 -2.515 13.199 -25.979 421 HG2 LYS 49 HG2 LYS 49 -1.642 15.416 -25.150 422 HG3 LYS 49 HG1 LYS 49 -2.036 14.863 -23.522 423 HD2 LYS 49 HD2 LYS 49 -0.247 13.361 -25.425 424 HD3 LYS 49 HD1 LYS 49 0.344 14.494 -24.208 425 HE2 LYS 49 HE2 LYS 49 -0.713 13.115 -22.456 426 HE3 LYS 49 HE1 LYS 49 -1.223 11.967 -23.693 427 HZ1 LYS 49 HZ1 LYS 49 0.714 10.964 -23.377 428 HZ2 LYS 49 HZ2 LYS 49 1.298 12.215 -22.402 429 HZ3 LYS 49 HZ3 LYS 49 1.476 12.300 -24.082 430 H ASN 50 HN ASN 50 -5.912 12.790 -24.691 431 HA ASN 50 HA ASN 50 -6.758 12.227 -27.455 432 HB2 ASN 50 HB2 ASN 50 -6.521 10.231 -25.195 433 HB3 ASN 50 HB1 ASN 50 -7.193 9.886 -26.783 434 HD21 ASN 50 HD21 ASN 50 -5.597 10.685 -28.598 435 HD22 ASN 50 HD22 ASN 50 -3.975 10.129 -28.402 436 HA PRO 51 HA PRO 51 -10.375 13.842 -25.135 437 HB2 PRO 51 HB2 PRO 51 -11.060 14.557 -27.939 438 HB3 PRO 51 HB1 PRO 51 -11.113 15.557 -26.481 439 HG2 PRO 51 HG2 PRO 51 -9.180 15.928 -28.260 440 HG3 PRO 51 HG1 PRO 51 -8.805 15.959 -26.527 441 HD2 PRO 51 HD2 PRO 51 -8.412 13.740 -28.504 442 HD3 PRO 51 HD1 PRO 51 -7.285 14.366 -27.276 443 H GLN 52 HN GLN 52 -10.107 11.916 -28.052 444 HA GLN 52 HA GLN 52 -12.773 11.007 -28.226 445 HB2 GLN 52 HB2 GLN 52 -10.175 9.749 -29.129 446 HB3 GLN 52 HB1 GLN 52 -11.762 9.104 -29.528 447 HG2 GLN 52 HG2 GLN 52 -11.445 10.318 -31.398 448 HG3 GLN 52 HG1 GLN 52 -12.100 11.609 -30.390 449 HE21 GLN 52 HE21 GLN 52 -10.425 11.965 -32.644 450 HE22 GLN 52 HE22 GLN 52 -8.956 12.692 -32.099 451 H LEU 53 HN LEU 53 -9.943 9.759 -26.523 452 HA LEU 53 HA LEU 53 -11.278 7.396 -25.688 453 HB2 LEU 53 HB2 LEU 53 -8.735 8.704 -24.733 454 HB3 LEU 53 HB1 LEU 53 -9.331 7.190 -24.076 455 HG LEU 53 HG LEU 53 -8.703 7.619 -26.994 456 HD11 LEU 53 HD11 LEU 53 -6.655 7.829 -25.722 457 HD12 LEU 53 HD12 LEU 53 -6.680 6.272 -26.549 458 HD13 LEU 53 HD13 LEU 53 -7.029 6.359 -24.822 459 HD21 LEU 53 HD21 LEU 53 -8.541 4.965 -26.552 460 HD22 LEU 53 HD22 LEU 53 -9.995 5.790 -27.116 461 HD23 LEU 53 HD23 LEU 53 -9.806 5.405 -25.405 462 H ALA 54 HN ALA 54 -10.771 10.601 -24.345 463 HA ALA 54 HA ALA 54 -11.737 10.095 -21.743 464 HB1 ALA 54 HB1 ALA 54 -11.825 12.431 -21.463 465 HB2 ALA 54 HB2 ALA 54 -12.016 12.710 -23.194 466 HB3 ALA 54 HB3 ALA 54 -10.472 12.145 -22.560 467 H GLU 55 HN GLU 55 -13.247 11.096 -24.754 468 HA GLU 55 HA GLU 55 -15.887 11.417 -23.742 469 HB2 GLU 55 HB2 GLU 55 -15.124 12.414 -25.876 470 HB3 GLU 55 HB1 GLU 55 -14.992 10.803 -26.567 471 HG2 GLU 55 HG2 GLU 55 -17.391 10.474 -26.290 472 HG3 GLU 55 HG1 GLU 55 -17.534 12.075 -25.569 473 H GLU 56 HN GLU 56 -14.124 8.694 -25.130 474 HA GLU 56 HA GLU 56 -16.293 6.935 -25.419 475 HB2 GLU 56 HB2 GLU 56 -13.375 6.370 -24.846 476 HB3 GLU 56 HB1 GLU 56 -14.550 5.121 -25.228 477 HG2 GLU 56 HG2 GLU 56 -14.954 6.244 -27.409 478 HG3 GLU 56 HG1 GLU 56 -13.657 7.383 -27.016 479 H ASP 57 HN ASP 57 -14.166 7.561 -22.633 480 HA ASP 57 HA ASP 57 -15.874 5.804 -21.037 481 HB2 ASP 57 HB2 ASP 57 -13.180 7.085 -20.453 482 HB3 ASP 57 HB1 ASP 57 -14.125 6.274 -19.207 483 H LYS 58 HN LYS 58 -16.271 8.712 -22.041 484 HA LYS 58 HA LYS 58 -17.324 10.601 -21.367 485 HB2 LYS 58 HB2 LYS 58 -18.602 8.601 -19.507 486 HB3 LYS 58 HB1 LYS 58 -19.197 10.239 -19.752 487 HG2 LYS 58 HG2 LYS 58 -19.538 9.757 -22.132 488 HG3 LYS 58 HG1 LYS 58 -18.955 8.111 -21.874 489 HD2 LYS 58 HD2 LYS 58 -20.802 7.687 -20.333 490 HD3 LYS 58 HD1 LYS 58 -21.373 9.342 -20.548 491 HE2 LYS 58 HE2 LYS 58 -22.679 7.827 -21.916 492 HE3 LYS 58 HE1 LYS 58 -21.718 8.891 -22.941 493 HZ1 LYS 58 HZ1 LYS 58 -20.181 7.147 -23.361 494 HZ2 LYS 58 HZ2 LYS 58 -21.727 6.518 -23.629 495 HZ3 LYS 58 HZ3 LYS 58 -20.895 6.137 -22.207 496 H ILE 59 HN ILE 59 -14.884 10.749 -20.388 497 HA ILE 59 HA ILE 59 -14.968 11.229 -17.519 498 HB ILE 59 HB ILE 59 -12.712 11.682 -19.480 499 HG12 ILE 59 HG12 ILE 59 -13.376 9.335 -19.442 500 HG13 ILE 59 HG11 ILE 59 -11.818 9.541 -18.643 501 HG21 ILE 59 HG21 ILE 59 -12.815 11.654 -16.470 502 HG22 ILE 59 HG22 ILE 59 -12.300 12.969 -17.529 503 HG23 ILE 59 HG23 ILE 59 -11.316 11.513 -17.386 504 HD11 ILE 59 HD11 ILE 59 -12.785 8.201 -17.116 505 HD12 ILE 59 HD12 ILE 59 -14.421 8.698 -17.549 506 HD13 ILE 59 HD13 ILE 59 -13.428 9.730 -16.520 507 H LEU 60 HN LEU 60 -16.000 13.042 -16.941 508 HA LEU 60 HA LEU 60 -15.517 15.498 -18.481 509 HB2 LEU 60 HB2 LEU 60 -17.706 14.866 -16.501 510 HB3 LEU 60 HB1 LEU 60 -17.536 16.375 -17.378 511 HG LEU 60 HG LEU 60 -18.059 13.677 -18.637 512 HD11 LEU 60 HD11 LEU 60 -19.886 16.034 -18.190 513 HD12 LEU 60 HD12 LEU 60 -19.980 14.469 -17.381 514 HD13 LEU 60 HD13 LEU 60 -20.284 14.585 -19.114 515 HD21 LEU 60 HD21 LEU 60 -16.920 14.903 -20.260 516 HD22 LEU 60 HD22 LEU 60 -17.652 16.427 -19.760 517 HD23 LEU 60 HD23 LEU 60 -18.617 15.226 -20.616 518 H ALA 61 HN ALA 61 -14.285 14.008 -15.854 519 HA ALA 61 HA ALA 61 -13.462 16.550 -14.676 520 HB1 ALA 61 HB1 ALA 61 -15.481 15.590 -13.433 521 HB2 ALA 61 HB2 ALA 61 -14.069 16.031 -12.473 522 HB3 ALA 61 HB3 ALA 61 -14.378 14.338 -12.863 523 H THR 62 HN THR 62 -11.500 16.457 -13.547 524 HA THR 62 HA THR 62 -10.029 13.957 -13.444 525 HB THR 62 HB THR 62 -8.026 15.048 -14.501 526 HG1 THR 62 HG1 THR 62 -9.245 17.217 -14.279 527 HG21 THR 62 HG21 THR 62 -8.729 14.746 -16.821 528 HG22 THR 62 HG22 THR 62 -10.423 14.796 -16.322 529 HG23 THR 62 HG23 THR 62 -9.388 13.469 -15.795 530 HA PRO 63 HA PRO 63 -8.108 13.317 -12.896 531 HB2 PRO 63 HB2 PRO 63 -7.039 12.182 -10.720 532 HB3 PRO 63 HB1 PRO 63 -6.171 13.398 -11.663 533 HG2 PRO 63 HG2 PRO 63 -7.638 13.696 -9.079 534 HG3 PRO 63 HG1 PRO 63 -6.095 14.405 -9.589 535 HD2 PRO 63 HD2 PRO 63 -8.503 15.741 -9.629 536 HD3 PRO 63 HD1 PRO 63 -7.114 16.150 -10.654 537 H THR 64 HN THR 64 -8.981 11.267 -12.791 538 HA THR 64 HA THR 64 -11.073 10.798 -10.777 539 HB THR 64 HB THR 64 -11.301 10.091 -13.714 540 HG1 THR 64 HG1 THR 64 -12.010 12.125 -13.685 541 HG21 THR 64 HG21 THR 64 -12.297 8.417 -12.137 542 HG22 THR 64 HG22 THR 64 -13.462 9.185 -13.216 543 HG23 THR 64 HG23 THR 64 -13.346 9.700 -11.534 544 H LEU 65 HN LEU 65 -10.932 8.894 -9.782 545 HA LEU 65 HA LEU 65 -8.879 6.982 -10.693 546 HB2 LEU 65 HB2 LEU 65 -8.784 8.100 -8.400 547 HB3 LEU 65 HB1 LEU 65 -10.197 7.156 -7.986 548 HG LEU 65 HG LEU 65 -7.858 5.640 -9.007 549 HD11 LEU 65 HD11 LEU 65 -6.951 5.650 -6.628 550 HD12 LEU 65 HD12 LEU 65 -7.879 7.133 -6.406 551 HD13 LEU 65 HD13 LEU 65 -6.612 7.061 -7.630 552 HD21 LEU 65 HD21 LEU 65 -10.065 4.673 -8.224 553 HD22 LEU 65 HD22 LEU 65 -9.589 5.159 -6.597 554 HD23 LEU 65 HD23 LEU 65 -8.612 3.995 -7.490 555 H ALA 66 HN ALA 66 -9.626 5.176 -11.672 556 HA ALA 66 HA ALA 66 -12.089 3.966 -10.622 557 HB1 ALA 66 HB1 ALA 66 -13.181 3.801 -12.661 558 HB2 ALA 66 HB2 ALA 66 -11.709 4.078 -13.590 559 HB3 ALA 66 HB3 ALA 66 -12.484 5.420 -12.743 560 H LYS 67 HN LYS 67 -12.134 1.849 -10.553 561 HA LYS 67 HA LYS 67 -9.736 0.432 -11.451 562 HB2 LYS 67 HB2 LYS 67 -10.190 0.088 -9.114 563 HB3 LYS 67 HB1 LYS 67 -11.886 -0.241 -9.429 564 HG2 LYS 67 HG2 LYS 67 -10.964 -2.254 -10.801 565 HG3 LYS 67 HG1 LYS 67 -9.513 -2.006 -9.830 566 HD2 LYS 67 HD2 LYS 67 -12.012 -2.011 -8.294 567 HD3 LYS 67 HD1 LYS 67 -11.652 -3.538 -9.100 568 HE2 LYS 67 HE2 LYS 67 -9.388 -3.474 -8.063 569 HE3 LYS 67 HE1 LYS 67 -9.885 -2.042 -7.164 570 HZ1 LYS 67 HZ1 LYS 67 -11.401 -4.577 -7.014 571 HZ2 LYS 67 HZ2 LYS 67 -11.447 -3.263 -5.951 572 HZ3 LYS 67 HZ3 LYS 67 -10.086 -4.266 -5.995 573 H VAL 68 HN VAL 68 -10.057 -0.242 -13.510 574 HA VAL 68 HA VAL 68 -12.694 -0.959 -14.418 575 HB VAL 68 HB VAL 68 -11.535 -1.422 -16.593 576 HG11 VAL 68 HG11 VAL 68 -11.307 0.870 -17.154 577 HG12 VAL 68 HG12 VAL 68 -10.919 1.305 -15.490 578 HG13 VAL 68 HG13 VAL 68 -12.548 0.776 -15.904 579 HG21 VAL 68 HG21 VAL 68 -9.259 -1.559 -15.052 580 HG22 VAL 68 HG22 VAL 68 -9.126 0.020 -15.824 581 HG23 VAL 68 HG23 VAL 68 -9.305 -1.430 -16.810 582 H LEU 69 HN LEU 69 -9.829 -2.595 -13.328 583 HA LEU 69 HA LEU 69 -11.265 -5.158 -13.615 584 HB2 LEU 69 HB2 LEU 69 -8.431 -4.602 -14.462 585 HB3 LEU 69 HB1 LEU 69 -8.933 -6.210 -14.003 586 HG LEU 69 HG LEU 69 -9.051 -6.277 -16.305 587 HD11 LEU 69 HD11 LEU 69 -11.371 -6.391 -16.936 588 HD12 LEU 69 HD12 LEU 69 -11.830 -5.408 -15.544 589 HD13 LEU 69 HD13 LEU 69 -11.156 -7.022 -15.303 590 HD21 LEU 69 HD21 LEU 69 -10.024 -4.494 -17.708 591 HD22 LEU 69 HD22 LEU 69 -8.606 -3.973 -16.797 592 HD23 LEU 69 HD23 LEU 69 -10.221 -3.506 -16.261 593 HA PRO 70 HA PRO 70 -11.243 -7.183 -12.882 594 HB2 PRO 70 HB2 PRO 70 -12.415 -7.989 -10.328 595 HB3 PRO 70 HB1 PRO 70 -11.466 -8.948 -11.465 596 HG2 PRO 70 HG2 PRO 70 -10.502 -8.231 -9.051 597 HG3 PRO 70 HG1 PRO 70 -9.457 -8.373 -10.479 598 HD2 PRO 70 HD2 PRO 70 -10.660 -5.904 -9.255 599 HD3 PRO 70 HD1 PRO 70 -8.993 -6.181 -9.811 600 HA PRO 71 HA PRO 71 -15.088 -4.943 -12.989 601 HB2 PRO 71 HB2 PRO 71 -16.761 -6.821 -14.001 602 HB3 PRO 71 HB1 PRO 71 -15.517 -6.032 -14.980 603 HG2 PRO 71 HG2 PRO 71 -15.436 -8.702 -13.612 604 HG3 PRO 71 HG1 PRO 71 -14.950 -8.283 -15.267 605 HD2 PRO 71 HD2 PRO 71 -13.144 -8.539 -13.291 606 HD3 PRO 71 HD1 PRO 71 -12.958 -7.332 -14.576 607 HA PRO 72 HA PRO 72 -17.469 -4.583 -13.152 608 HB2 PRO 72 HB2 PRO 72 -18.945 -2.966 -11.585 609 HB3 PRO 72 HB1 PRO 72 -19.540 -4.537 -12.136 610 HG2 PRO 72 HG2 PRO 72 -18.312 -3.799 -9.501 611 HG3 PRO 72 HG1 PRO 72 -19.763 -4.769 -9.821 612 HD2 PRO 72 HD2 PRO 72 -17.358 -5.887 -9.264 613 HD3 PRO 72 HD1 PRO 72 -18.540 -6.655 -10.343 614 H VAL 73 HN VAL 73 -17.201 -2.265 -13.491 615 HA VAL 73 HA VAL 73 -14.666 -1.351 -12.579 616 HB VAL 73 HB VAL 73 -16.812 0.123 -14.125 617 HG11 VAL 73 HG11 VAL 73 -13.970 0.827 -13.467 618 HG12 VAL 73 HG12 VAL 73 -15.426 1.807 -13.293 619 HG13 VAL 73 HG13 VAL 73 -14.773 1.476 -14.898 620 HG21 VAL 73 HG21 VAL 73 -16.265 -1.256 -15.785 621 HG22 VAL 73 HG22 VAL 73 -14.925 -1.941 -14.866 622 HG23 VAL 73 HG23 VAL 73 -14.686 -0.471 -15.811 623 H ARG 74 HN ARG 74 -14.178 -0.192 -10.855 624 HA ARG 74 HA ARG 74 -16.347 1.088 -9.326 625 HB2 ARG 74 HB2 ARG 74 -15.261 -0.575 -8.006 626 HB3 ARG 74 HB1 ARG 74 -13.670 -0.026 -8.504 627 HG2 ARG 74 HG2 ARG 74 -14.087 0.628 -6.227 628 HG3 ARG 74 HG1 ARG 74 -14.015 2.061 -7.252 629 HD2 ARG 74 HD2 ARG 74 -15.846 2.279 -5.695 630 HD3 ARG 74 HD1 ARG 74 -16.487 2.089 -7.326 631 HE ARG 74 HE ARG 74 -16.316 -0.423 -6.034 632 HH11 ARG 74 HH11 ARG 74 -18.172 2.524 -6.052 633 HH12 ARG 74 HH12 ARG 74 -19.626 1.769 -5.492 634 HH21 ARG 74 HH21 ARG 74 -18.220 -1.433 -5.294 635 HH22 ARG 74 HH22 ARG 74 -19.653 -0.488 -5.057 636 H ARG 75 HN ARG 75 -16.493 3.203 -9.523 637 HA ARG 75 HA ARG 75 -14.067 4.697 -10.209 638 HB2 ARG 75 HB2 ARG 75 -16.971 5.465 -10.469 639 HB3 ARG 75 HB1 ARG 75 -15.619 6.530 -10.824 640 HG2 ARG 75 HG2 ARG 75 -14.854 4.949 -12.547 641 HG3 ARG 75 HG1 ARG 75 -16.280 3.956 -12.231 642 HD2 ARG 75 HD2 ARG 75 -16.349 6.838 -13.092 643 HD3 ARG 75 HD1 ARG 75 -16.521 5.466 -14.186 644 HE ARG 75 HE ARG 75 -18.425 5.139 -12.205 645 HH11 ARG 75 HH11 ARG 75 -17.674 7.466 -14.685 646 HH12 ARG 75 HH12 ARG 75 -19.320 7.961 -14.904 647 HH21 ARG 75 HH21 ARG 75 -20.597 5.779 -12.480 648 HH22 ARG 75 HH22 ARG 75 -20.986 6.999 -13.647 649 H ILE 76 HN ILE 76 -13.132 5.892 -8.751 650 HA ILE 76 HA ILE 76 -14.604 6.532 -6.277 651 HB ILE 76 HB ILE 76 -11.622 6.274 -6.656 652 HG12 ILE 76 HG12 ILE 76 -13.628 4.411 -5.357 653 HG13 ILE 76 HG11 ILE 76 -12.766 4.120 -6.868 654 HG21 ILE 76 HG21 ILE 76 -12.046 7.816 -4.892 655 HG22 ILE 76 HG22 ILE 76 -11.640 6.275 -4.138 656 HG23 ILE 76 HG23 ILE 76 -13.322 6.798 -4.223 657 HD11 ILE 76 HD11 ILE 76 -11.129 4.660 -4.484 658 HD12 ILE 76 HD12 ILE 76 -10.858 3.556 -5.832 659 HD13 ILE 76 HD13 ILE 76 -11.985 3.120 -4.546 660 H ILE 77 HN ILE 77 -15.117 8.622 -6.036 661 HA ILE 77 HA ILE 77 -13.446 10.638 -7.382 662 HB ILE 77 HB ILE 77 -16.388 10.864 -6.755 663 HG12 ILE 77 HG12 ILE 77 -15.980 11.007 -9.525 664 HG13 ILE 77 HG11 ILE 77 -14.985 9.658 -8.985 665 HG21 ILE 77 HG21 ILE 77 -14.667 12.669 -8.445 666 HG22 ILE 77 HG22 ILE 77 -15.089 12.994 -6.763 667 HG23 ILE 77 HG23 ILE 77 -16.353 12.915 -7.991 668 HD11 ILE 77 HD11 ILE 77 -16.884 8.572 -8.017 669 HD12 ILE 77 HD12 ILE 77 -17.265 9.012 -9.683 670 HD13 ILE 77 HD13 ILE 77 -17.907 9.971 -8.349 671 H GLY 78 HN GLY 78 -12.442 12.056 -6.098 672 HA2 GLY 78 HA2 GLY 78 -13.495 13.377 -3.905 673 HA3 GLY 78 HA1 GLY 78 -12.712 11.937 -3.269 674 H ASP 79 HN ASP 79 -11.381 13.624 -2.170 675 HA ASP 79 HA ASP 79 -9.491 15.069 -3.821 676 HB2 ASP 79 HB2 ASP 79 -10.343 16.027 -1.692 677 HB3 ASP 79 HB1 ASP 79 -9.573 14.715 -0.810 678 H LEU 80 HN LEU 80 -8.070 13.772 -4.849 679 HA LEU 80 HA LEU 80 -6.952 11.461 -3.490 680 HB2 LEU 80 HB2 LEU 80 -6.490 12.509 -6.285 681 HB3 LEU 80 HB1 LEU 80 -5.860 11.000 -5.657 682 HG LEU 80 HG LEU 80 -8.788 11.644 -6.024 683 HD11 LEU 80 HD11 LEU 80 -8.707 10.701 -8.064 684 HD12 LEU 80 HD12 LEU 80 -7.509 9.502 -7.575 685 HD13 LEU 80 HD13 LEU 80 -6.998 11.137 -7.993 686 HD21 LEU 80 HD21 LEU 80 -9.000 9.153 -5.669 687 HD22 LEU 80 HD22 LEU 80 -8.585 10.096 -4.237 688 HD23 LEU 80 HD23 LEU 80 -7.337 9.179 -5.082 689 H SER 81 HN SER 81 -6.161 14.681 -3.589 690 HA SER 81 HA SER 81 -3.347 14.521 -3.974 691 HB2 SER 81 HB2 SER 81 -4.982 16.622 -2.525 692 HB3 SER 81 HB1 SER 81 -3.292 16.792 -3.016 693 HG SER 81 HG SER 81 -3.903 17.159 -4.996 694 H ASN 82 HN ASN 82 -5.434 13.790 -1.370 695 HA ASN 82 HA ASN 82 -3.352 13.858 0.649 696 HB2 ASN 82 HB2 ASN 82 -5.674 14.476 1.235 697 HB3 ASN 82 HB1 ASN 82 -6.193 12.853 0.809 698 HD21 ASN 82 HD21 ASN 82 -6.971 13.329 3.145 699 HD22 ASN 82 HD22 ASN 82 -5.943 12.721 4.393 700 H ARG 83 HN ARG 83 -1.977 12.248 0.893 701 HA ARG 83 HA ARG 83 -2.080 9.908 -0.607 702 HB2 ARG 83 HB2 ARG 83 -0.456 10.586 1.849 703 HB3 ARG 83 HB1 ARG 83 -0.246 9.082 0.967 704 HG2 ARG 83 HG2 ARG 83 0.232 10.461 -1.076 705 HG3 ARG 83 HG1 ARG 83 0.251 11.877 -0.024 706 HD2 ARG 83 HD2 ARG 83 2.013 9.452 0.311 707 HD3 ARG 83 HD1 ARG 83 2.506 10.954 -0.467 708 HE ARG 83 HE ARG 83 2.133 10.493 2.375 709 HH11 ARG 83 HH11 ARG 83 2.602 12.812 -0.186 710 HH12 ARG 83 HH12 ARG 83 3.178 14.057 0.871 711 HH21 ARG 83 HH21 ARG 83 2.889 12.123 3.775 712 HH22 ARG 83 HH22 ARG 83 3.341 13.664 3.128 713 H GLU 84 HN GLU 84 -3.209 10.501 2.685 714 HA GLU 84 HA GLU 84 -3.614 7.817 3.428 715 HB2 GLU 84 HB2 GLU 84 -4.936 10.369 4.291 716 HB3 GLU 84 HB1 GLU 84 -5.391 8.806 4.958 717 HG2 GLU 84 HG2 GLU 84 -3.227 8.454 5.842 718 HG3 GLU 84 HG1 GLU 84 -2.575 9.849 4.983 719 H LYS 85 HN LYS 85 -5.852 10.059 1.731 720 HA LYS 85 HA LYS 85 -7.955 8.153 1.714 721 HB2 LYS 85 HB2 LYS 85 -7.427 10.551 -0.062 722 HB3 LYS 85 HB1 LYS 85 -8.849 9.532 -0.250 723 HG2 LYS 85 HG2 LYS 85 -9.563 10.108 2.009 724 HG3 LYS 85 HG1 LYS 85 -8.138 11.128 2.204 725 HD2 LYS 85 HD2 LYS 85 -8.889 12.463 0.243 726 HD3 LYS 85 HD1 LYS 85 -10.346 11.477 0.178 727 HE2 LYS 85 HE2 LYS 85 -9.498 13.170 2.526 728 HE3 LYS 85 HE1 LYS 85 -10.721 13.616 1.336 729 HZ1 LYS 85 HZ1 LYS 85 -12.096 12.696 2.834 730 HZ2 LYS 85 HZ2 LYS 85 -10.888 11.762 3.559 731 HZ3 LYS 85 HZ3 LYS 85 -11.621 11.234 2.128 732 H VAL 86 HN VAL 86 -5.367 8.836 -0.571 733 HA VAL 86 HA VAL 86 -6.215 7.021 -2.547 734 HB VAL 86 HB VAL 86 -3.438 8.027 -1.879 735 HG11 VAL 86 HG11 VAL 86 -4.371 6.065 -3.899 736 HG12 VAL 86 HG12 VAL 86 -2.815 6.196 -3.079 737 HG13 VAL 86 HG13 VAL 86 -3.197 7.273 -4.421 738 HG21 VAL 86 HG21 VAL 86 -4.402 9.877 -2.728 739 HG22 VAL 86 HG22 VAL 86 -5.709 8.973 -3.492 740 HG23 VAL 86 HG23 VAL 86 -4.133 9.073 -4.275 741 H LEU 87 HN LEU 87 -4.106 6.609 0.276 742 HA LEU 87 HA LEU 87 -3.506 3.868 -0.231 743 HB2 LEU 87 HB2 LEU 87 -2.961 5.841 1.820 744 HB3 LEU 87 HB1 LEU 87 -3.343 4.284 2.528 745 HG LEU 87 HG LEU 87 -1.215 4.675 0.434 746 HD11 LEU 87 HD11 LEU 87 -1.153 5.645 3.028 747 HD12 LEU 87 HD12 LEU 87 0.241 5.330 1.990 748 HD13 LEU 87 HD13 LEU 87 -0.306 4.099 3.127 749 HD21 LEU 87 HD21 LEU 87 -1.085 2.436 2.323 750 HD22 LEU 87 HD22 LEU 87 -0.839 2.461 0.577 751 HD23 LEU 87 HD23 LEU 87 -2.475 2.382 1.236 752 H ILE 88 HN ILE 88 -5.873 5.428 1.915 753 HA ILE 88 HA ILE 88 -6.868 3.052 3.028 754 HB ILE 88 HB ILE 88 -8.103 5.773 2.695 755 HG12 ILE 88 HG12 ILE 88 -7.186 4.332 5.185 756 HG13 ILE 88 HG11 ILE 88 -6.104 5.320 4.211 757 HG21 ILE 88 HG21 ILE 88 -9.968 4.268 2.764 758 HG22 ILE 88 HG22 ILE 88 -9.808 5.012 4.358 759 HG23 ILE 88 HG23 ILE 88 -9.249 3.359 4.096 760 HD11 ILE 88 HD11 ILE 88 -8.054 6.101 6.187 761 HD12 ILE 88 HD12 ILE 88 -8.270 6.963 4.664 762 HD13 ILE 88 HD13 ILE 88 -6.711 7.014 5.493 763 H ALA 89 HN ALA 89 -8.021 4.919 0.211 764 HA ALA 89 HA ALA 89 -10.180 3.195 -0.395 765 HB1 ALA 89 HB1 ALA 89 -9.087 4.427 -2.761 766 HB2 ALA 89 HB2 ALA 89 -9.157 5.580 -1.428 767 HB3 ALA 89 HB3 ALA 89 -10.618 4.736 -1.940 768 H LEU 90 HN LEU 90 -6.800 3.202 -1.435 769 HA LEU 90 HA LEU 90 -7.080 1.090 -3.321 770 HB2 LEU 90 HB2 LEU 90 -4.847 2.576 -2.089 771 HB3 LEU 90 HB1 LEU 90 -4.461 0.952 -2.614 772 HG LEU 90 HG LEU 90 -4.925 1.456 -4.877 773 HD11 LEU 90 HD11 LEU 90 -6.900 2.662 -4.946 774 HD12 LEU 90 HD12 LEU 90 -5.703 3.865 -5.429 775 HD13 LEU 90 HD13 LEU 90 -6.329 3.856 -3.781 776 HD21 LEU 90 HD21 LEU 90 -3.336 3.141 -5.351 777 HD22 LEU 90 HD22 LEU 90 -2.817 2.381 -3.845 778 HD23 LEU 90 HD23 LEU 90 -3.626 3.949 -3.810 779 H ARG 91 HN ARG 91 -6.233 1.164 0.137 780 HA ARG 91 HA ARG 91 -5.533 -1.589 0.346 781 HB2 ARG 91 HB2 ARG 91 -6.481 0.412 2.392 782 HB3 ARG 91 HB1 ARG 91 -6.037 -1.240 2.797 783 HG2 ARG 91 HG2 ARG 91 -3.780 -0.861 2.007 784 HG3 ARG 91 HG1 ARG 91 -4.213 0.774 1.501 785 HD2 ARG 91 HD2 ARG 91 -3.058 0.854 3.625 786 HD3 ARG 91 HD1 ARG 91 -4.741 1.335 3.839 787 HE ARG 91 HE ARG 91 -4.421 -1.439 4.328 788 HH11 ARG 91 HH11 ARG 91 -3.804 1.686 5.734 789 HH12 ARG 91 HH12 ARG 91 -3.875 1.114 7.367 790 HH21 ARG 91 HH21 ARG 91 -4.520 -2.210 6.470 791 HH22 ARG 91 HH22 ARG 91 -4.283 -1.110 7.787 792 H LEU 92 HN LEU 92 -8.604 0.147 0.824 793 HA LEU 92 HA LEU 92 -10.074 -2.100 1.668 794 HB2 LEU 92 HB2 LEU 92 -10.944 0.443 0.294 795 HB3 LEU 92 HB1 LEU 92 -12.075 -0.767 0.867 796 HG LEU 92 HG LEU 92 -10.112 0.679 2.648 797 HD11 LEU 92 HD11 LEU 92 -11.597 2.337 1.854 798 HD12 LEU 92 HD12 LEU 92 -12.191 1.864 3.446 799 HD13 LEU 92 HD13 LEU 92 -12.989 1.263 1.993 800 HD21 LEU 92 HD21 LEU 92 -10.669 -1.272 3.765 801 HD22 LEU 92 HD22 LEU 92 -12.304 -1.307 3.103 802 HD23 LEU 92 HD23 LEU 92 -11.885 -0.139 4.356 803 H LEU 93 HN LEU 93 -9.402 -0.829 -1.552 804 HA LEU 93 HA LEU 93 -11.140 -2.606 -2.940 805 HB2 LEU 93 HB2 LEU 93 -8.701 -1.075 -3.836 806 HB3 LEU 93 HB1 LEU 93 -9.678 -2.043 -4.921 807 HG LEU 93 HG LEU 93 -10.735 0.304 -3.343 808 HD11 LEU 93 HD11 LEU 93 -9.434 1.454 -4.790 809 HD12 LEU 93 HD12 LEU 93 -10.783 1.144 -5.881 810 HD13 LEU 93 HD13 LEU 93 -9.345 0.126 -5.945 811 HD21 LEU 93 HD21 LEU 93 -12.088 -0.561 -5.789 812 HD22 LEU 93 HD22 LEU 93 -12.754 -0.135 -4.212 813 HD23 LEU 93 HD23 LEU 93 -12.119 -1.757 -4.494 814 H ALA 94 HN ALA 94 -7.743 -2.726 -1.999 815 HA ALA 94 HA ALA 94 -7.051 -5.076 -3.372 816 HB1 ALA 94 HB1 ALA 94 -5.803 -4.167 -0.788 817 HB2 ALA 94 HB2 ALA 94 -5.469 -3.402 -2.343 818 HB3 ALA 94 HB3 ALA 94 -5.059 -5.100 -2.088 819 H GLU 95 HN GLU 95 -8.439 -4.572 -0.167 820 HA GLU 95 HA GLU 95 -8.183 -7.204 0.790 821 HB2 GLU 95 HB2 GLU 95 -10.183 -5.020 1.377 822 HB3 GLU 95 HB1 GLU 95 -10.162 -6.555 2.236 823 HG2 GLU 95 HG2 GLU 95 -7.984 -6.107 3.117 824 HG3 GLU 95 HG1 GLU 95 -7.822 -4.669 2.110 825 H GLU 96 HN GLU 96 -10.606 -5.629 -1.205 826 HA GLU 96 HA GLU 96 -12.524 -7.685 -1.260 827 HB2 GLU 96 HB2 GLU 96 -11.811 -5.518 -3.249 828 HB3 GLU 96 HB1 GLU 96 -13.184 -6.600 -3.463 829 HG2 GLU 96 HG2 GLU 96 -14.243 -5.758 -1.492 830 HG3 GLU 96 HG1 GLU 96 -12.812 -4.823 -1.064 831 H ILE 97 HN ILE 97 -9.691 -7.024 -3.243 832 HA ILE 97 HA ILE 97 -10.096 -9.121 -5.118 833 HB ILE 97 HB ILE 97 -7.576 -7.623 -4.384 834 HG12 ILE 97 HG12 ILE 97 -9.461 -7.235 -6.708 835 HG13 ILE 97 HG11 ILE 97 -9.542 -6.305 -5.213 836 HG21 ILE 97 HG21 ILE 97 -8.190 -9.408 -6.741 837 HG22 ILE 97 HG22 ILE 97 -6.974 -9.681 -5.494 838 HG23 ILE 97 HG23 ILE 97 -6.782 -8.345 -6.634 839 HD11 ILE 97 HD11 ILE 97 -7.671 -5.130 -5.675 840 HD12 ILE 97 HD12 ILE 97 -8.272 -5.416 -7.309 841 HD13 ILE 97 HD13 ILE 97 -6.968 -6.413 -6.661 842 H GLY 98 HN GLY 98 -8.167 -8.807 -2.160 843 HA2 GLY 98 HA2 GLY 98 -6.856 -11.292 -2.274 844 HA3 GLY 98 HA1 GLY 98 -7.169 -10.376 -0.809 845 H ASP 99 HN ASP 99 -10.030 -10.416 -1.049 846 HA ASP 99 HA ASP 99 -10.623 -12.803 0.312 847 HB2 ASP 99 HB2 ASP 99 -11.926 -10.702 0.530 848 HB3 ASP 99 HB1 ASP 99 -12.556 -10.949 -1.096 849 H TYR 100 HN TYR 100 -11.053 -11.890 -3.079 850 HA TYR 100 HA TYR 100 -12.263 -14.476 -3.674 851 HB2 TYR 100 HB2 TYR 100 -13.247 -12.470 -4.703 852 HB3 TYR 100 HB1 TYR 100 -11.704 -12.094 -5.463 853 HD1 TYR 100 HD1 TYR 100 -14.394 -14.665 -5.361 854 HD2 TYR 100 HD2 TYR 100 -11.181 -12.963 -7.576 855 HE1 TYR 100 HE1 TYR 100 -15.041 -16.004 -7.319 856 HE2 TYR 100 HE2 TYR 100 -11.822 -14.298 -9.539 857 HH TYR 100 HH TYR 100 -13.698 -16.913 -9.454 858 H LYS 101 HN LYS 101 -10.891 -16.109 -3.921 859 HA LYS 101 HA LYS 101 -8.342 -15.604 -5.299 860 HB2 LYS 101 HB2 LYS 101 -9.098 -17.786 -3.347 861 HB3 LYS 101 HB1 LYS 101 -7.568 -17.720 -4.212 862 HG2 LYS 101 HG2 LYS 101 -7.045 -15.592 -3.126 863 HG3 LYS 101 HG1 LYS 101 -8.577 -15.664 -2.255 864 HD2 LYS 101 HD2 LYS 101 -7.867 -17.725 -1.157 865 HD3 LYS 101 HD1 LYS 101 -6.347 -17.689 -2.052 866 HE2 LYS 101 HE2 LYS 101 -6.013 -16.838 0.193 867 HE3 LYS 101 HE1 LYS 101 -5.791 -15.545 -0.985 868 HZ1 LYS 101 HZ1 LYS 101 -7.777 -14.543 -0.392 869 HZ2 LYS 101 HZ2 LYS 101 -7.183 -15.084 1.102 870 HZ3 LYS 101 HZ3 LYS 101 -8.404 -15.950 0.319 871 H ASP 102 HN ASP 102 -7.854 -16.690 -7.129 872 HA ASP 102 HA ASP 102 -9.868 -18.601 -8.115 873 HB2 ASP 102 HB2 ASP 102 -9.621 -16.478 -9.425 874 HB3 ASP 102 HB1 ASP 102 -7.955 -16.933 -9.764 875 H ASP 103 HN ASP 103 -9.148 -20.610 -7.770 876 HA ASP 103 HA ASP 103 -6.658 -21.444 -8.972 877 HB2 ASP 103 HB2 ASP 103 -6.173 -20.641 -6.553 878 HB3 ASP 103 HB1 ASP 103 -7.015 -22.106 -6.055 879 H ASP 104 HN ASP 104 -6.509 -23.740 -9.196 880 HA ASP 104 HA ASP 104 -9.026 -25.019 -9.552 881 HB2 ASP 104 HB2 ASP 104 -6.977 -25.452 -10.941 882 HB3 ASP 104 HB1 ASP 104 -6.299 -26.324 -9.571 883 H ASP 105 HN ASP 105 -6.647 -25.038 -7.010 884 HA ASP 105 HA ASP 105 -7.917 -27.286 -5.659 885 HB2 ASP 105 HB2 ASP 105 -5.434 -27.081 -5.684 886 HB3 ASP 105 HB1 ASP 105 -5.576 -25.589 -4.760 887 H LYS 106 HN LYS 106 -9.784 -26.773 -4.707 888 HA LYS 106 HA LYS 106 -11.334 -25.784 -3.379 889 HB2 LYS 106 HB2 LYS 106 -8.835 -24.900 -1.935 890 HB3 LYS 106 HB1 LYS 106 -10.458 -24.650 -1.305 891 HG2 LYS 106 HG2 LYS 106 -10.824 -27.068 -1.285 892 HG3 LYS 106 HG1 LYS 106 -9.195 -27.318 -1.920 893 HD2 LYS 106 HD2 LYS 106 -8.256 -26.261 0.078 894 HD3 LYS 106 HD1 LYS 106 -9.884 -26.005 0.710 895 HE2 LYS 106 HE2 LYS 106 -10.251 -28.424 0.745 896 HE3 LYS 106 HE1 LYS 106 -8.629 -28.682 0.104 897 HZ1 LYS 106 HZ1 LYS 106 -8.839 -28.956 2.553 898 HZ2 LYS 106 HZ2 LYS 106 -9.171 -27.301 2.671 899 HZ3 LYS 106 HZ3 LYS 106 -7.674 -27.822 2.083 Start of MODEL 6 1 H1 MET 1 HT1 MET 1 -12.803 -5.765 -21.523 2 H2 MET 1 HT2 MET 1 -12.608 -7.444 -21.523 3 H3 MET 1 HT3 MET 1 -11.566 -6.472 -20.610 4 HA MET 1 HA MET 1 -13.224 -5.903 -19.078 5 HB2 MET 1 HB2 MET 1 -15.104 -7.199 -21.056 6 HB3 MET 1 HB1 MET 1 -15.573 -6.784 -19.413 7 HG2 MET 1 HG2 MET 1 -15.177 -4.448 -19.838 8 HG3 MET 1 HG1 MET 1 -14.550 -4.814 -21.445 9 HE1 MET 1 HE1 MET 1 -17.973 -6.243 -19.639 10 HE2 MET 1 HE2 MET 1 -18.908 -4.809 -20.061 11 HE3 MET 1 HE3 MET 1 -17.458 -4.654 -19.068 12 H ALA 2 HN ALA 2 -11.631 -8.382 -20.113 13 HA ALA 2 HA ALA 2 -12.869 -10.610 -18.811 14 HB1 ALA 2 HB1 ALA 2 -9.972 -10.389 -19.589 15 HB2 ALA 2 HB2 ALA 2 -11.254 -10.741 -20.747 16 HB3 ALA 2 HB3 ALA 2 -10.942 -11.850 -19.411 17 HA PRO 3 HA PRO 3 -11.689 -9.456 -14.646 18 HB2 PRO 3 HB2 PRO 3 -12.276 -12.333 -14.173 19 HB3 PRO 3 HB1 PRO 3 -12.906 -10.907 -13.339 20 HG2 PRO 3 HG2 PRO 3 -14.447 -12.231 -15.039 21 HG3 PRO 3 HG1 PRO 3 -14.459 -10.455 -15.022 22 HD2 PRO 3 HD2 PRO 3 -13.081 -12.321 -16.927 23 HD3 PRO 3 HD1 PRO 3 -13.991 -10.832 -17.268 24 H LEU 4 HN LEU 4 -9.874 -9.597 -13.449 25 HA LEU 4 HA LEU 4 -7.880 -11.599 -14.271 26 HB2 LEU 4 HB2 LEU 4 -7.369 -8.841 -13.148 27 HB3 LEU 4 HB1 LEU 4 -6.157 -9.979 -13.702 28 HG LEU 4 HG LEU 4 -8.209 -8.593 -15.428 29 HD11 LEU 4 HD11 LEU 4 -6.145 -7.574 -16.436 30 HD12 LEU 4 HD12 LEU 4 -5.250 -8.210 -15.055 31 HD13 LEU 4 HD13 LEU 4 -6.541 -7.034 -14.805 32 HD21 LEU 4 HD21 LEU 4 -6.660 -9.593 -17.248 33 HD22 LEU 4 HD22 LEU 4 -7.903 -10.607 -16.513 34 HD23 LEU 4 HD23 LEU 4 -6.222 -10.753 -15.994 35 H ARG 5 HN ARG 5 -6.534 -12.489 -12.634 36 HA ARG 5 HA ARG 5 -7.769 -12.396 -9.972 37 HB2 ARG 5 HB2 ARG 5 -5.922 -14.469 -11.178 38 HB3 ARG 5 HB1 ARG 5 -6.623 -14.546 -9.568 39 HG2 ARG 5 HG2 ARG 5 -8.257 -14.458 -12.091 40 HG3 ARG 5 HG1 ARG 5 -7.767 -15.950 -11.286 41 HD2 ARG 5 HD2 ARG 5 -8.924 -15.198 -9.245 42 HD3 ARG 5 HD1 ARG 5 -9.450 -13.748 -10.095 43 HE ARG 5 HE ARG 5 -10.483 -16.439 -10.420 44 HH11 ARG 5 HH11 ARG 5 -10.339 -13.183 -11.651 45 HH12 ARG 5 HH12 ARG 5 -11.791 -13.332 -12.583 46 HH21 ARG 5 HH21 ARG 5 -12.397 -16.649 -11.638 47 HH22 ARG 5 HH22 ARG 5 -12.964 -15.307 -12.576 48 H LYS 6 HN LYS 6 -6.673 -11.747 -8.227 49 HA LYS 6 HA LYS 6 -5.061 -10.899 -6.887 50 HB2 LYS 6 HB2 LYS 6 -3.381 -12.403 -8.823 51 HB3 LYS 6 HB1 LYS 6 -2.596 -11.266 -7.734 52 HG2 LYS 6 HG2 LYS 6 -4.050 -12.553 -5.932 53 HG3 LYS 6 HG1 LYS 6 -3.949 -13.835 -7.141 54 HD2 LYS 6 HD2 LYS 6 -1.510 -13.645 -7.133 55 HD3 LYS 6 HD1 LYS 6 -1.619 -12.360 -5.929 56 HE2 LYS 6 HE2 LYS 6 -1.097 -14.373 -4.768 57 HE3 LYS 6 HE1 LYS 6 -2.782 -13.985 -4.422 58 HZ1 LYS 6 HZ1 LYS 6 -1.772 -16.350 -5.455 59 HZ2 LYS 6 HZ2 LYS 6 -2.629 -15.621 -6.717 60 HZ3 LYS 6 HZ3 LYS 6 -3.397 -15.931 -5.243 61 H THR 7 HN THR 7 -3.680 -10.391 -10.111 62 HA THR 7 HA THR 7 -3.013 -7.683 -9.432 63 HB THR 7 HB THR 7 -2.602 -7.675 -12.068 64 HG1 THR 7 HG1 THR 7 -3.520 -9.846 -12.217 65 HG21 THR 7 HG21 THR 7 -0.984 -8.581 -9.767 66 HG22 THR 7 HG22 THR 7 -0.677 -7.293 -10.935 67 HG23 THR 7 HG23 THR 7 -0.354 -8.974 -11.367 68 H ALA 8 HN ALA 8 -4.156 -5.955 -9.686 69 HA ALA 8 HA ALA 8 -6.568 -6.039 -11.381 70 HB1 ALA 8 HB1 ALA 8 -7.621 -4.517 -9.856 71 HB2 ALA 8 HB2 ALA 8 -6.126 -4.336 -8.934 72 HB3 ALA 8 HB3 ALA 8 -6.982 -5.879 -8.932 73 H VAL 9 HN VAL 9 -7.174 -4.060 -12.445 74 HA VAL 9 HA VAL 9 -4.804 -2.433 -13.074 75 HB VAL 9 HB VAL 9 -7.224 -2.972 -14.798 76 HG11 VAL 9 HG11 VAL 9 -6.597 -0.879 -15.530 77 HG12 VAL 9 HG12 VAL 9 -5.548 -1.885 -16.526 78 HG13 VAL 9 HG13 VAL 9 -4.907 -1.106 -15.079 79 HG21 VAL 9 HG21 VAL 9 -6.059 -4.578 -15.877 80 HG22 VAL 9 HG22 VAL 9 -5.184 -4.676 -14.349 81 HG23 VAL 9 HG23 VAL 9 -4.521 -3.738 -15.688 82 H LEU 10 HN LEU 10 -4.862 -0.402 -12.478 83 HA LEU 10 HA LEU 10 -7.456 0.842 -11.810 84 HB2 LEU 10 HB2 LEU 10 -5.046 0.585 -10.306 85 HB3 LEU 10 HB1 LEU 10 -5.248 2.278 -10.693 86 HG LEU 10 HG LEU 10 -6.175 1.854 -8.517 87 HD11 LEU 10 HD11 LEU 10 -7.395 3.502 -9.696 88 HD12 LEU 10 HD12 LEU 10 -8.578 2.472 -8.885 89 HD13 LEU 10 HD13 LEU 10 -8.284 2.289 -10.615 90 HD21 LEU 10 HD21 LEU 10 -6.570 -0.487 -8.593 91 HD22 LEU 10 HD22 LEU 10 -7.773 -0.306 -9.868 92 HD23 LEU 10 HD23 LEU 10 -8.106 0.305 -8.246 93 H LYS 11 HN LYS 11 -7.971 2.715 -12.953 94 HA LYS 11 HA LYS 11 -5.811 3.730 -14.675 95 HB2 LYS 11 HB2 LYS 11 -8.755 3.481 -15.303 96 HB3 LYS 11 HB1 LYS 11 -7.652 4.475 -16.245 97 HG2 LYS 11 HG2 LYS 11 -6.322 2.484 -16.769 98 HG3 LYS 11 HG1 LYS 11 -7.461 1.496 -15.856 99 HD2 LYS 11 HD2 LYS 11 -9.257 2.146 -17.376 100 HD3 LYS 11 HD1 LYS 11 -8.135 3.170 -18.276 101 HE2 LYS 11 HE2 LYS 11 -6.809 1.204 -18.862 102 HE3 LYS 11 HE1 LYS 11 -7.918 0.178 -17.954 103 HZ1 LYS 11 HZ1 LYS 11 -8.111 0.884 -20.608 104 HZ2 LYS 11 HZ2 LYS 11 -9.326 1.770 -19.835 105 HZ3 LYS 11 HZ3 LYS 11 -9.282 0.087 -19.682 106 H LEU 12 HN LEU 12 -5.342 5.790 -14.545 107 HA LEU 12 HA LEU 12 -7.065 7.472 -12.867 108 HB2 LEU 12 HB2 LEU 12 -4.306 6.985 -12.794 109 HB3 LEU 12 HB1 LEU 12 -4.461 8.600 -13.455 110 HG LEU 12 HG LEU 12 -5.590 7.664 -10.814 111 HD11 LEU 12 HD11 LEU 12 -3.297 9.522 -11.431 112 HD12 LEU 12 HD12 LEU 12 -3.149 7.871 -10.829 113 HD13 LEU 12 HD13 LEU 12 -3.905 9.111 -9.828 114 HD21 LEU 12 HD21 LEU 12 -7.058 9.333 -11.457 115 HD22 LEU 12 HD22 LEU 12 -5.817 10.229 -12.332 116 HD23 LEU 12 HD23 LEU 12 -5.830 10.236 -10.568 117 H TYR 13 HN TYR 13 -8.139 9.153 -13.901 118 HA TYR 13 HA TYR 13 -7.320 9.764 -16.656 119 HB2 TYR 13 HB2 TYR 13 -9.859 10.391 -15.126 120 HB3 TYR 13 HB1 TYR 13 -9.555 10.803 -16.810 121 HD1 TYR 13 HD1 TYR 13 -10.397 8.125 -14.475 122 HD2 TYR 13 HD2 TYR 13 -9.501 9.053 -18.530 123 HE1 TYR 13 HE1 TYR 13 -11.270 5.932 -15.164 124 HE2 TYR 13 HE2 TYR 13 -10.374 6.861 -19.229 125 HH TYR 13 HH TYR 13 -11.475 5.018 -18.581 126 H VAL 14 HN VAL 14 -6.074 11.540 -16.869 127 HA VAL 14 HA VAL 14 -6.405 13.716 -14.902 128 HB VAL 14 HB VAL 14 -3.984 14.172 -15.084 129 HG11 VAL 14 HG11 VAL 14 -3.274 12.114 -13.767 130 HG12 VAL 14 HG12 VAL 14 -4.907 11.506 -14.035 131 HG13 VAL 14 HG13 VAL 14 -4.663 13.010 -13.146 132 HG21 VAL 14 HG21 VAL 14 -3.605 13.074 -17.260 133 HG22 VAL 14 HG22 VAL 14 -3.865 11.504 -16.499 134 HG23 VAL 14 HG23 VAL 14 -2.490 12.500 -16.019 135 H ALA 15 HN ALA 15 -5.656 15.820 -15.659 136 HA ALA 15 HA ALA 15 -5.978 16.111 -18.567 137 HB1 ALA 15 HB1 ALA 15 -7.759 17.034 -16.693 138 HB2 ALA 15 HB2 ALA 15 -7.586 17.653 -18.337 139 HB3 ALA 15 HB3 ALA 15 -6.753 18.450 -17.001 140 H GLY 16 HN GLY 16 -3.858 16.336 -19.126 141 HA2 GLY 16 HA2 GLY 16 -1.905 17.472 -19.507 142 HA3 GLY 16 HA1 GLY 16 -2.646 18.863 -18.734 143 H ASN 17 HN ASN 17 -0.769 19.451 -17.680 144 HA ASN 17 HA ASN 17 0.127 17.606 -15.567 145 HB2 ASN 17 HB2 ASN 17 1.706 19.829 -16.890 146 HB3 ASN 17 HB1 ASN 17 2.297 18.762 -15.622 147 HD21 ASN 17 HD21 ASN 17 1.831 16.333 -16.256 148 HD22 ASN 17 HD22 ASN 17 2.395 15.904 -17.831 149 H THR 18 HN THR 18 -2.111 19.107 -15.125 150 HA THR 18 HA THR 18 -1.552 21.575 -13.802 151 HB THR 18 HB THR 18 -3.835 21.355 -12.870 152 HG1 THR 18 HG1 THR 18 -4.632 19.200 -14.284 153 HG21 THR 18 HG21 THR 18 -3.832 20.616 -15.788 154 HG22 THR 18 HG22 THR 18 -3.391 22.215 -15.187 155 HG23 THR 18 HG23 THR 18 -5.017 21.589 -14.916 156 HA PRO 19 HA PRO 19 -0.054 20.323 -9.900 157 HB2 PRO 19 HB2 PRO 19 -1.756 21.701 -8.179 158 HB3 PRO 19 HB1 PRO 19 -0.308 22.372 -8.933 159 HG2 PRO 19 HG2 PRO 19 -3.168 22.606 -9.779 160 HG3 PRO 19 HG1 PRO 19 -1.893 23.837 -9.792 161 HD2 PRO 19 HD2 PRO 19 -2.629 22.616 -12.033 162 HD3 PRO 19 HD1 PRO 19 -0.918 22.977 -11.719 163 H ASN 20 HN ASN 20 -3.558 20.212 -10.270 164 HA ASN 20 HA ASN 20 -4.011 18.379 -8.134 165 HB2 ASN 20 HB2 ASN 20 -5.708 18.860 -10.615 166 HB3 ASN 20 HB1 ASN 20 -6.207 17.946 -9.199 167 HD21 ASN 20 HD21 ASN 20 -5.798 19.240 -7.080 168 HD22 ASN 20 HD22 ASN 20 -6.400 20.859 -7.104 169 H SER 21 HN SER 21 -3.555 18.032 -11.626 170 HA SER 21 HA SER 21 -3.755 15.203 -11.820 171 HB2 SER 21 HB2 SER 21 -3.951 16.690 -13.771 172 HB3 SER 21 HB1 SER 21 -2.282 17.209 -13.552 173 HG SER 21 HG SER 21 -2.160 15.640 -15.055 174 H VAL 22 HN VAL 22 -0.944 17.335 -11.495 175 HA VAL 22 HA VAL 22 0.933 15.222 -11.519 176 HB VAL 22 HB VAL 22 1.120 18.050 -10.454 177 HG11 VAL 22 HG11 VAL 22 3.262 15.943 -10.588 178 HG12 VAL 22 HG12 VAL 22 2.698 16.833 -9.171 179 HG13 VAL 22 HG13 VAL 22 3.598 17.668 -10.439 180 HG21 VAL 22 HG21 VAL 22 1.844 16.692 -13.006 181 HG22 VAL 22 HG22 VAL 22 2.783 18.087 -12.474 182 HG23 VAL 22 HG23 VAL 22 1.046 18.243 -12.740 183 H ARG 23 HN ARG 23 -0.691 16.916 -8.876 184 HA ARG 23 HA ARG 23 0.678 15.702 -6.742 185 HB2 ARG 23 HB2 ARG 23 -1.149 17.651 -6.950 186 HB3 ARG 23 HB1 ARG 23 -2.212 16.332 -6.464 187 HG2 ARG 23 HG2 ARG 23 -1.717 17.039 -4.402 188 HG3 ARG 23 HG1 ARG 23 -0.249 16.084 -4.630 189 HD2 ARG 23 HD2 ARG 23 0.947 18.052 -5.381 190 HD3 ARG 23 HD1 ARG 23 -0.525 19.016 -5.271 191 HE ARG 23 HE ARG 23 1.152 18.114 -3.069 192 HH11 ARG 23 HH11 ARG 23 -1.831 19.601 -4.089 193 HH12 ARG 23 HH12 ARG 23 -2.138 20.344 -2.555 194 HH21 ARG 23 HH21 ARG 23 0.761 19.086 -1.047 195 HH22 ARG 23 HH22 ARG 23 -0.659 20.050 -0.820 196 H ALA 24 HN ALA 24 -2.391 14.899 -8.327 197 HA ALA 24 HA ALA 24 -3.002 12.652 -6.750 198 HB1 ALA 24 HB1 ALA 24 -4.268 14.038 -8.747 199 HB2 ALA 24 HB2 ALA 24 -4.861 12.564 -7.979 200 HB3 ALA 24 HB3 ALA 24 -3.964 12.468 -9.494 201 H LEU 25 HN LEU 25 -1.298 12.974 -9.832 202 HA LEU 25 HA LEU 25 -0.944 10.243 -10.394 203 HB2 LEU 25 HB2 LEU 25 -0.604 11.986 -12.060 204 HB3 LEU 25 HB1 LEU 25 0.752 12.624 -11.153 205 HG LEU 25 HG LEU 25 2.009 10.550 -11.586 206 HD11 LEU 25 HD11 LEU 25 0.453 8.850 -11.859 207 HD12 LEU 25 HD12 LEU 25 1.019 9.127 -13.505 208 HD13 LEU 25 HD13 LEU 25 -0.529 9.791 -12.982 209 HD21 LEU 25 HD21 LEU 25 2.347 12.410 -13.067 210 HD22 LEU 25 HD22 LEU 25 0.919 11.975 -14.007 211 HD23 LEU 25 HD23 LEU 25 2.336 10.924 -14.016 212 H LYS 26 HN LYS 26 1.225 12.512 -8.684 213 HA LYS 26 HA LYS 26 3.262 10.611 -8.217 214 HB2 LYS 26 HB2 LYS 26 2.536 13.156 -6.769 215 HB3 LYS 26 HB1 LYS 26 3.931 12.177 -6.336 216 HG2 LYS 26 HG2 LYS 26 4.843 12.489 -8.589 217 HG3 LYS 26 HG1 LYS 26 3.450 13.490 -9.005 218 HD2 LYS 26 HD2 LYS 26 4.067 15.080 -7.251 219 HD3 LYS 26 HD1 LYS 26 5.452 14.075 -6.821 220 HE2 LYS 26 HE2 LYS 26 5.005 15.382 -9.503 221 HE3 LYS 26 HE1 LYS 26 6.077 15.988 -8.242 222 HZ1 LYS 26 HZ1 LYS 26 6.986 13.508 -8.494 223 HZ2 LYS 26 HZ2 LYS 26 7.587 14.805 -9.396 224 HZ3 LYS 26 HZ3 LYS 26 6.441 13.763 -10.075 225 H THR 27 HN THR 27 0.406 11.537 -6.350 226 HA THR 27 HA THR 27 0.992 10.060 -4.017 227 HB THR 27 HB THR 27 -1.676 10.941 -5.142 228 HG1 THR 27 HG1 THR 27 -0.502 12.761 -4.753 229 HG21 THR 27 HG21 THR 27 -2.299 9.454 -3.490 230 HG22 THR 27 HG22 THR 27 -2.160 10.957 -2.575 231 HG23 THR 27 HG23 THR 27 -0.858 9.764 -2.520 232 H LEU 28 HN LEU 28 -0.940 9.272 -6.909 233 HA LEU 28 HA LEU 28 -1.757 6.716 -5.954 234 HB2 LEU 28 HB2 LEU 28 -2.183 8.338 -8.281 235 HB3 LEU 28 HB1 LEU 28 -1.767 6.714 -8.788 236 HG LEU 28 HG LEU 28 -4.107 6.725 -8.701 237 HD11 LEU 28 HD11 LEU 28 -2.680 5.102 -6.957 238 HD12 LEU 28 HD12 LEU 28 -4.316 4.840 -7.561 239 HD13 LEU 28 HD13 LEU 28 -4.066 5.662 -6.022 240 HD21 LEU 28 HD21 LEU 28 -4.855 8.604 -7.672 241 HD22 LEU 28 HD22 LEU 28 -3.710 8.468 -6.338 242 HD23 LEU 28 HD23 LEU 28 -5.151 7.452 -6.370 243 H ALA 29 HN ALA 29 0.773 7.714 -8.292 244 HA ALA 29 HA ALA 29 1.580 5.129 -8.994 245 HB1 ALA 29 HB1 ALA 29 2.506 6.486 -10.498 246 HB2 ALA 29 HB2 ALA 29 3.836 6.618 -9.348 247 HB3 ALA 29 HB3 ALA 29 2.569 7.845 -9.375 248 H ASN 30 HN ASN 30 2.869 7.272 -6.430 249 HA ASN 30 HA ASN 30 5.019 5.499 -5.800 250 HB2 ASN 30 HB2 ASN 30 3.752 7.773 -4.265 251 HB3 ASN 30 HB1 ASN 30 5.083 6.822 -3.613 252 HD21 ASN 30 HD21 ASN 30 5.183 9.584 -4.077 253 HD22 ASN 30 HD22 ASN 30 6.359 9.884 -5.306 254 H ILE 31 HN ILE 31 1.756 5.825 -4.512 255 HA ILE 31 HA ILE 31 2.122 3.993 -2.423 256 HB ILE 31 HB ILE 31 -0.339 4.949 -3.834 257 HG12 ILE 31 HG12 ILE 31 0.642 5.292 -1.000 258 HG13 ILE 31 HG11 ILE 31 0.962 6.428 -2.307 259 HG21 ILE 31 HG21 ILE 31 -0.275 2.483 -2.645 260 HG22 ILE 31 HG22 ILE 31 -1.710 3.488 -2.858 261 HG23 ILE 31 HG23 ILE 31 -0.823 3.528 -1.334 262 HD11 ILE 31 HD11 ILE 31 -1.851 5.721 -1.860 263 HD12 ILE 31 HD12 ILE 31 -1.109 7.273 -2.250 264 HD13 ILE 31 HD13 ILE 31 -1.066 6.666 -0.596 265 H LEU 32 HN LEU 32 0.945 3.603 -5.732 266 HA LEU 32 HA LEU 32 0.485 0.818 -5.518 267 HB2 LEU 32 HB2 LEU 32 0.721 2.675 -7.863 268 HB3 LEU 32 HB1 LEU 32 0.399 0.960 -8.050 269 HG LEU 32 HG LEU 32 -1.354 2.799 -6.401 270 HD11 LEU 32 HD11 LEU 32 -2.851 2.925 -8.253 271 HD12 LEU 32 HD12 LEU 32 -1.871 1.811 -9.205 272 HD13 LEU 32 HD13 LEU 32 -1.263 3.424 -8.833 273 HD21 LEU 32 HD21 LEU 32 -2.649 0.509 -7.485 274 HD22 LEU 32 HD22 LEU 32 -2.383 0.941 -5.796 275 HD23 LEU 32 HD23 LEU 32 -1.177 -0.008 -6.662 276 H GLU 33 HN GLU 33 3.347 2.681 -6.368 277 HA GLU 33 HA GLU 33 4.710 0.304 -7.375 278 HB2 GLU 33 HB2 GLU 33 5.751 3.118 -7.003 279 HB3 GLU 33 HB1 GLU 33 6.621 1.803 -7.780 280 HG2 GLU 33 HG2 GLU 33 4.806 1.697 -9.480 281 HG3 GLU 33 HG1 GLU 33 4.098 3.131 -8.727 282 H LYS 34 HN LYS 34 4.105 1.445 -4.335 283 HA LYS 34 HA LYS 34 6.552 0.146 -3.343 284 HB2 LYS 34 HB2 LYS 34 5.411 2.798 -2.574 285 HB3 LYS 34 HB1 LYS 34 6.213 1.837 -1.340 286 HG2 LYS 34 HG2 LYS 34 7.483 2.598 -3.960 287 HG3 LYS 34 HG1 LYS 34 7.661 3.525 -2.470 288 HD2 LYS 34 HD2 LYS 34 8.392 0.610 -2.714 289 HD3 LYS 34 HD1 LYS 34 9.537 1.926 -2.977 290 HE2 LYS 34 HE2 LYS 34 9.061 2.739 -0.687 291 HE3 LYS 34 HE1 LYS 34 8.019 1.340 -0.438 292 HZ1 LYS 34 HZ1 LYS 34 9.926 -0.100 -0.794 293 HZ2 LYS 34 HZ2 LYS 34 10.219 0.974 0.479 294 HZ3 LYS 34 HZ3 LYS 34 10.927 1.243 -1.033 295 H GLU 35 HN GLU 35 3.477 1.440 -2.107 296 HA GLU 35 HA GLU 35 3.265 -0.384 0.030 297 HB2 GLU 35 HB2 GLU 35 1.246 1.376 -1.367 298 HB3 GLU 35 HB1 GLU 35 0.842 0.396 0.041 299 HG2 GLU 35 HG2 GLU 35 2.922 2.574 -0.062 300 HG3 GLU 35 HG1 GLU 35 1.322 2.699 0.665 301 H PHE 36 HN PHE 36 1.843 -0.428 -3.233 302 HA PHE 36 HA PHE 36 1.045 -3.213 -2.708 303 HB2 PHE 36 HB2 PHE 36 -0.459 -1.134 -4.299 304 HB3 PHE 36 HB1 PHE 36 -0.880 -2.843 -4.248 305 HD1 PHE 36 HD1 PHE 36 -0.874 0.308 -2.415 306 HD2 PHE 36 HD2 PHE 36 -1.794 -3.841 -2.227 307 HE1 PHE 36 HE1 PHE 36 -2.191 0.698 -0.375 308 HE2 PHE 36 HE2 PHE 36 -3.115 -3.459 -0.187 309 HZ PHE 36 HZ PHE 36 -3.312 -1.186 0.741 310 H LYS 37 HN LYS 37 3.524 -2.249 -3.912 311 HA LYS 37 HA LYS 37 3.490 -2.426 -6.709 312 HB2 LYS 37 HB2 LYS 37 5.418 -1.573 -5.435 313 HB3 LYS 37 HB1 LYS 37 5.730 -3.194 -4.829 314 HG2 LYS 37 HG2 LYS 37 6.289 -3.982 -7.015 315 HG3 LYS 37 HG1 LYS 37 5.761 -2.468 -7.751 316 HD2 LYS 37 HD2 LYS 37 8.163 -2.480 -7.642 317 HD3 LYS 37 HD1 LYS 37 7.550 -1.293 -6.489 318 HE2 LYS 37 HE2 LYS 37 7.866 -2.857 -4.669 319 HE3 LYS 37 HE1 LYS 37 8.390 -4.106 -5.798 320 HZ1 LYS 37 HZ1 LYS 37 10.349 -2.905 -6.285 321 HZ2 LYS 37 HZ2 LYS 37 10.205 -2.891 -4.600 322 HZ3 LYS 37 HZ3 LYS 37 9.797 -1.514 -5.494 323 H GLY 38 HN GLY 38 3.322 -4.057 -8.093 324 HA2 GLY 38 HA2 GLY 38 3.623 -6.244 -8.894 325 HA3 GLY 38 HA1 GLY 38 3.946 -6.777 -7.251 326 H VAL 39 HN VAL 39 1.318 -5.006 -6.771 327 HA VAL 39 HA VAL 39 -0.432 -7.315 -7.224 328 HB VAL 39 HB VAL 39 -0.835 -5.039 -5.263 329 HG11 VAL 39 HG11 VAL 39 -2.882 -6.263 -6.219 330 HG12 VAL 39 HG12 VAL 39 -2.741 -6.126 -4.465 331 HG13 VAL 39 HG13 VAL 39 -2.327 -7.641 -5.267 332 HG21 VAL 39 HG21 VAL 39 -0.143 -7.891 -4.600 333 HG22 VAL 39 HG22 VAL 39 -0.148 -6.490 -3.528 334 HG23 VAL 39 HG23 VAL 39 1.075 -6.631 -4.790 335 H TYR 40 HN TYR 40 -0.265 -3.782 -7.598 336 HA TYR 40 HA TYR 40 -2.600 -4.065 -9.344 337 HB2 TYR 40 HB2 TYR 40 -1.782 -1.783 -7.568 338 HB3 TYR 40 HB1 TYR 40 -2.817 -1.490 -8.953 339 HD1 TYR 40 HD1 TYR 40 -2.582 -3.279 -5.724 340 HD2 TYR 40 HD2 TYR 40 -5.101 -1.949 -8.876 341 HE1 TYR 40 HE1 TYR 40 -4.559 -3.779 -4.350 342 HE2 TYR 40 HE2 TYR 40 -7.082 -2.451 -7.517 343 HH TYR 40 HH TYR 40 -7.805 -2.976 -5.477 344 H ALA 41 HN ALA 41 -2.645 -3.101 -11.323 345 HA ALA 41 HA ALA 41 -0.074 -2.070 -12.309 346 HB1 ALA 41 HB1 ALA 41 -1.298 -4.090 -13.388 347 HB2 ALA 41 HB2 ALA 41 -0.644 -2.835 -14.441 348 HB3 ALA 41 HB3 ALA 41 -2.369 -2.867 -14.073 349 H LEU 42 HN LEU 42 0.049 0.096 -12.676 350 HA LEU 42 HA LEU 42 -2.435 1.613 -12.530 351 HB2 LEU 42 HB2 LEU 42 -0.679 2.325 -11.027 352 HB3 LEU 42 HB1 LEU 42 0.442 2.503 -12.364 353 HG LEU 42 HG LEU 42 -0.957 4.342 -13.264 354 HD11 LEU 42 HD11 LEU 42 -3.118 3.997 -12.508 355 HD12 LEU 42 HD12 LEU 42 -2.568 5.346 -11.515 356 HD13 LEU 42 HD13 LEU 42 -2.602 3.716 -10.844 357 HD21 LEU 42 HD21 LEU 42 -0.474 5.275 -10.529 358 HD22 LEU 42 HD22 LEU 42 0.181 5.848 -12.064 359 HD23 LEU 42 HD23 LEU 42 0.886 4.437 -11.275 360 H LYS 43 HN LYS 43 -3.363 2.558 -14.151 361 HA LYS 43 HA LYS 43 -1.841 3.046 -16.625 362 HB2 LYS 43 HB2 LYS 43 -4.323 1.555 -16.192 363 HB3 LYS 43 HB1 LYS 43 -4.504 2.842 -17.374 364 HG2 LYS 43 HG2 LYS 43 -3.883 1.157 -18.748 365 HG3 LYS 43 HG1 LYS 43 -2.288 1.792 -18.342 366 HD2 LYS 43 HD2 LYS 43 -1.844 0.038 -16.859 367 HD3 LYS 43 HD1 LYS 43 -3.549 -0.402 -16.731 368 HE2 LYS 43 HE2 LYS 43 -2.508 -2.055 -18.083 369 HE3 LYS 43 HE1 LYS 43 -3.469 -1.036 -19.155 370 HZ1 LYS 43 HZ1 LYS 43 -0.796 -1.645 -19.407 371 HZ2 LYS 43 HZ2 LYS 43 -0.824 -0.033 -18.899 372 HZ3 LYS 43 HZ3 LYS 43 -1.663 -0.494 -20.294 373 H VAL 44 HN VAL 44 -2.066 5.019 -17.519 374 HA VAL 44 HA VAL 44 -3.922 6.916 -16.202 375 HB VAL 44 HB VAL 44 -1.735 7.536 -15.491 376 HG11 VAL 44 HG11 VAL 44 -0.039 8.150 -17.408 377 HG12 VAL 44 HG12 VAL 44 -0.948 6.918 -18.283 378 HG13 VAL 44 HG13 VAL 44 -0.147 6.511 -16.764 379 HG21 VAL 44 HG21 VAL 44 -1.548 9.755 -16.263 380 HG22 VAL 44 HG22 VAL 44 -3.259 9.339 -16.369 381 HG23 VAL 44 HG23 VAL 44 -2.262 9.346 -17.824 382 H ILE 45 HN ILE 45 -5.235 8.005 -17.380 383 HA ILE 45 HA ILE 45 -4.973 7.787 -20.296 384 HB ILE 45 HB ILE 45 -7.456 8.220 -18.642 385 HG12 ILE 45 HG12 ILE 45 -6.553 6.014 -18.173 386 HG13 ILE 45 HG11 ILE 45 -8.026 5.871 -19.123 387 HG21 ILE 45 HG21 ILE 45 -7.508 9.059 -20.997 388 HG22 ILE 45 HG22 ILE 45 -8.718 7.824 -20.641 389 HG23 ILE 45 HG23 ILE 45 -7.257 7.399 -21.537 390 HD11 ILE 45 HD11 ILE 45 -5.232 5.668 -20.217 391 HD12 ILE 45 HD12 ILE 45 -6.733 5.407 -21.105 392 HD13 ILE 45 HD13 ILE 45 -6.272 4.302 -19.809 393 H ASP 46 HN ASP 46 -3.989 9.692 -20.839 394 HA ASP 46 HA ASP 46 -4.608 12.178 -19.554 395 HB2 ASP 46 HB2 ASP 46 -2.414 11.618 -20.694 396 HB3 ASP 46 HB1 ASP 46 -3.250 11.839 -22.229 397 H VAL 47 HN VAL 47 -6.657 12.904 -19.795 398 HA VAL 47 HA VAL 47 -8.268 12.345 -22.051 399 HB VAL 47 HB VAL 47 -9.935 13.804 -21.056 400 HG11 VAL 47 HG11 VAL 47 -9.427 12.718 -18.554 401 HG12 VAL 47 HG12 VAL 47 -8.598 11.632 -19.671 402 HG13 VAL 47 HG13 VAL 47 -10.322 11.955 -19.868 403 HG21 VAL 47 HG21 VAL 47 -8.396 15.597 -20.315 404 HG22 VAL 47 HG22 VAL 47 -7.841 14.544 -19.012 405 HG23 VAL 47 HG23 VAL 47 -9.519 15.086 -19.054 406 H LEU 48 HN LEU 48 -6.222 15.133 -21.314 407 HA LEU 48 HA LEU 48 -7.410 16.820 -23.275 408 HB2 LEU 48 HB2 LEU 48 -4.753 16.964 -21.882 409 HB3 LEU 48 HB1 LEU 48 -5.271 18.152 -23.063 410 HG LEU 48 HG LEU 48 -6.724 17.530 -20.488 411 HD11 LEU 48 HD11 LEU 48 -4.639 18.594 -19.977 412 HD12 LEU 48 HD12 LEU 48 -5.928 19.785 -19.815 413 HD13 LEU 48 HD13 LEU 48 -4.890 19.798 -21.241 414 HD21 LEU 48 HD21 LEU 48 -7.312 19.250 -22.829 415 HD22 LEU 48 HD22 LEU 48 -7.665 19.907 -21.232 416 HD23 LEU 48 HD23 LEU 48 -8.408 18.393 -21.745 417 H LYS 49 HN LYS 49 -4.630 14.614 -23.385 418 HA LYS 49 HA LYS 49 -3.842 15.422 -26.003 419 HB2 LYS 49 HB2 LYS 49 -3.184 12.961 -24.395 420 HB3 LYS 49 HB1 LYS 49 -2.547 13.245 -26.009 421 HG2 LYS 49 HG2 LYS 49 -1.632 15.428 -25.136 422 HG3 LYS 49 HG1 LYS 49 -2.056 14.856 -23.521 423 HD2 LYS 49 HD2 LYS 49 -0.280 13.349 -25.433 424 HD3 LYS 49 HD1 LYS 49 0.321 14.444 -24.188 425 HE2 LYS 49 HE2 LYS 49 -0.787 13.055 -22.477 426 HE3 LYS 49 HE1 LYS 49 -1.306 11.943 -23.742 427 HZ1 LYS 49 HZ1 LYS 49 0.593 10.893 -23.262 428 HZ2 LYS 49 HZ2 LYS 49 1.280 12.235 -22.496 429 HZ3 LYS 49 HZ3 LYS 49 1.340 12.101 -24.180 430 H ASN 50 HN ASN 50 -5.974 12.891 -24.778 431 HA ASN 50 HA ASN 50 -6.838 12.460 -27.560 432 HB2 ASN 50 HB2 ASN 50 -5.438 10.545 -26.531 433 HB3 ASN 50 HB1 ASN 50 -6.854 10.252 -25.522 434 HD21 ASN 50 HD21 ASN 50 -5.400 8.970 -27.984 435 HD22 ASN 50 HD22 ASN 50 -6.729 8.477 -28.971 436 HA PRO 51 HA PRO 51 -10.409 13.855 -25.082 437 HB2 PRO 51 HB2 PRO 51 -11.242 14.674 -27.813 438 HB3 PRO 51 HB1 PRO 51 -11.227 15.613 -26.315 439 HG2 PRO 51 HG2 PRO 51 -9.399 16.077 -28.188 440 HG3 PRO 51 HG1 PRO 51 -8.938 16.068 -26.475 441 HD2 PRO 51 HD2 PRO 51 -8.598 13.912 -28.531 442 HD3 PRO 51 HD1 PRO 51 -7.428 14.525 -27.340 443 H GLN 52 HN GLN 52 -10.159 11.954 -27.996 444 HA GLN 52 HA GLN 52 -12.825 11.057 -28.203 445 HB2 GLN 52 HB2 GLN 52 -11.087 10.808 -29.988 446 HB3 GLN 52 HB1 GLN 52 -10.309 9.574 -29.002 447 HG2 GLN 52 HG2 GLN 52 -12.308 8.187 -29.145 448 HG3 GLN 52 HG1 GLN 52 -13.101 9.422 -30.122 449 HE21 GLN 52 HE21 GLN 52 -12.145 6.550 -30.551 450 HE22 GLN 52 HE22 GLN 52 -11.306 6.629 -32.059 451 H LEU 53 HN LEU 53 -10.018 9.806 -26.460 452 HA LEU 53 HA LEU 53 -11.389 7.452 -25.635 453 HB2 LEU 53 HB2 LEU 53 -8.842 8.719 -24.629 454 HB3 LEU 53 HB1 LEU 53 -9.468 7.197 -24.016 455 HG LEU 53 HG LEU 53 -8.739 7.705 -26.896 456 HD11 LEU 53 HD11 LEU 53 -6.623 7.213 -26.431 457 HD12 LEU 53 HD12 LEU 53 -7.101 5.769 -25.539 458 HD13 LEU 53 HD13 LEU 53 -7.023 7.327 -24.717 459 HD21 LEU 53 HD21 LEU 53 -8.708 5.029 -26.564 460 HD22 LEU 53 HD22 LEU 53 -10.094 5.942 -27.160 461 HD23 LEU 53 HD23 LEU 53 -10.008 5.478 -25.460 462 H ALA 54 HN ALA 54 -10.896 10.663 -24.308 463 HA ALA 54 HA ALA 54 -11.862 10.151 -21.704 464 HB1 ALA 54 HB1 ALA 54 -10.592 12.196 -22.466 465 HB2 ALA 54 HB2 ALA 54 -11.998 12.505 -21.448 466 HB3 ALA 54 HB3 ALA 54 -12.100 12.756 -23.191 467 H GLU 55 HN GLU 55 -13.361 11.168 -24.723 468 HA GLU 55 HA GLU 55 -16.005 11.457 -23.717 469 HB2 GLU 55 HB2 GLU 55 -15.236 12.480 -25.840 470 HB3 GLU 55 HB1 GLU 55 -15.103 10.875 -26.546 471 HG2 GLU 55 HG2 GLU 55 -17.500 10.541 -26.282 472 HG3 GLU 55 HG1 GLU 55 -17.648 12.129 -25.531 473 H GLU 56 HN GLU 56 -14.222 8.756 -25.124 474 HA GLU 56 HA GLU 56 -16.386 6.995 -25.446 475 HB2 GLU 56 HB2 GLU 56 -13.469 6.420 -24.867 476 HB3 GLU 56 HB1 GLU 56 -14.642 5.179 -25.280 477 HG2 GLU 56 HG2 GLU 56 -15.035 6.358 -27.440 478 HG3 GLU 56 HG1 GLU 56 -13.725 7.469 -27.016 479 H ASP 57 HN ASP 57 -14.282 7.600 -22.638 480 HA ASP 57 HA ASP 57 -15.999 5.820 -21.074 481 HB2 ASP 57 HB2 ASP 57 -13.317 7.099 -20.453 482 HB3 ASP 57 HB1 ASP 57 -14.270 6.272 -19.226 483 H LYS 58 HN LYS 58 -16.391 8.743 -22.047 484 HA LYS 58 HA LYS 58 -17.452 10.621 -21.357 485 HB2 LYS 58 HB2 LYS 58 -18.730 8.602 -19.518 486 HB3 LYS 58 HB1 LYS 58 -19.327 10.239 -19.749 487 HG2 LYS 58 HG2 LYS 58 -19.665 9.780 -22.133 488 HG3 LYS 58 HG1 LYS 58 -19.077 8.134 -21.890 489 HD2 LYS 58 HD2 LYS 58 -20.922 7.687 -20.356 490 HD3 LYS 58 HD1 LYS 58 -21.501 9.341 -20.557 491 HE2 LYS 58 HE2 LYS 58 -22.799 7.833 -21.940 492 HE3 LYS 58 HE1 LYS 58 -21.842 8.914 -22.953 493 HZ1 LYS 58 HZ1 LYS 58 -21.844 6.540 -23.659 494 HZ2 LYS 58 HZ2 LYS 58 -20.995 6.160 -22.246 495 HZ3 LYS 58 HZ3 LYS 58 -20.301 7.185 -23.399 496 H ILE 59 HN ILE 59 -15.016 10.767 -20.375 497 HA ILE 59 HA ILE 59 -15.073 11.188 -17.502 498 HB ILE 59 HB ILE 59 -12.863 11.734 -19.491 499 HG12 ILE 59 HG12 ILE 59 -13.476 9.373 -19.476 500 HG13 ILE 59 HG11 ILE 59 -11.910 9.600 -18.704 501 HG21 ILE 59 HG21 ILE 59 -12.783 11.511 -16.482 502 HG22 ILE 59 HG22 ILE 59 -12.602 12.994 -17.418 503 HG23 ILE 59 HG23 ILE 59 -11.387 11.722 -17.538 504 HD11 ILE 59 HD11 ILE 59 -13.472 9.724 -16.546 505 HD12 ILE 59 HD12 ILE 59 -12.825 8.213 -17.184 506 HD13 ILE 59 HD13 ILE 59 -14.477 8.697 -17.568 507 H LEU 60 HN LEU 60 -16.120 12.962 -16.844 508 HA LEU 60 HA LEU 60 -15.706 15.475 -18.314 509 HB2 LEU 60 HB2 LEU 60 -17.870 14.737 -16.342 510 HB3 LEU 60 HB1 LEU 60 -17.734 16.276 -17.171 511 HG LEU 60 HG LEU 60 -18.215 13.611 -18.513 512 HD11 LEU 60 HD11 LEU 60 -20.460 14.498 -18.949 513 HD12 LEU 60 HD12 LEU 60 -20.082 15.916 -17.972 514 HD13 LEU 60 HD13 LEU 60 -20.144 14.321 -17.224 515 HD21 LEU 60 HD21 LEU 60 -17.109 14.911 -20.101 516 HD22 LEU 60 HD22 LEU 60 -17.870 16.404 -19.550 517 HD23 LEU 60 HD23 LEU 60 -18.814 15.208 -20.439 518 H ALA 61 HN ALA 61 -14.412 13.924 -15.763 519 HA ALA 61 HA ALA 61 -13.708 16.445 -14.452 520 HB1 ALA 61 HB1 ALA 61 -15.593 15.107 -13.251 521 HB2 ALA 61 HB2 ALA 61 -14.264 15.782 -12.310 522 HB3 ALA 61 HB3 ALA 61 -14.268 14.068 -12.727 523 H THR 62 HN THR 62 -11.685 16.461 -13.463 524 HA THR 62 HA THR 62 -10.021 14.087 -13.539 525 HB THR 62 HB THR 62 -8.164 15.419 -14.643 526 HG1 THR 62 HG1 THR 62 -9.556 17.433 -14.393 527 HG21 THR 62 HG21 THR 62 -9.500 13.647 -15.814 528 HG22 THR 62 HG22 THR 62 -8.813 14.878 -16.879 529 HG23 THR 62 HG23 THR 62 -10.526 14.933 -16.453 530 HA PRO 63 HA PRO 63 -8.152 13.469 -12.999 531 HB2 PRO 63 HB2 PRO 63 -7.013 12.355 -10.850 532 HB3 PRO 63 HB1 PRO 63 -6.189 13.585 -11.814 533 HG2 PRO 63 HG2 PRO 63 -7.588 13.856 -9.193 534 HG3 PRO 63 HG1 PRO 63 -6.075 14.597 -9.746 535 HD2 PRO 63 HD2 PRO 63 -8.519 15.875 -9.715 536 HD3 PRO 63 HD1 PRO 63 -7.162 16.329 -10.763 537 H THR 64 HN THR 64 -8.976 11.397 -12.857 538 HA THR 64 HA THR 64 -11.018 10.895 -10.799 539 HB THR 64 HB THR 64 -11.302 10.194 -13.731 540 HG1 THR 64 HG1 THR 64 -12.050 12.212 -13.675 541 HG21 THR 64 HG21 THR 64 -13.469 9.286 -13.166 542 HG22 THR 64 HG22 THR 64 -13.238 9.710 -11.470 543 HG23 THR 64 HG23 THR 64 -12.229 8.469 -12.213 544 H LEU 65 HN LEU 65 -10.814 8.985 -9.814 545 HA LEU 65 HA LEU 65 -8.764 7.108 -10.815 546 HB2 LEU 65 HB2 LEU 65 -8.445 8.128 -8.568 547 HB3 LEU 65 HB1 LEU 65 -9.953 7.400 -8.056 548 HG LEU 65 HG LEU 65 -8.962 5.154 -8.478 549 HD11 LEU 65 HD11 LEU 65 -7.293 5.627 -10.098 550 HD12 LEU 65 HD12 LEU 65 -6.453 5.092 -8.642 551 HD13 LEU 65 HD13 LEU 65 -6.513 6.808 -9.046 552 HD21 LEU 65 HD21 LEU 65 -8.971 5.924 -6.233 553 HD22 LEU 65 HD22 LEU 65 -7.612 7.008 -6.528 554 HD23 LEU 65 HD23 LEU 65 -7.365 5.262 -6.535 555 H ALA 66 HN ALA 66 -9.566 5.327 -11.805 556 HA ALA 66 HA ALA 66 -11.986 4.105 -10.660 557 HB1 ALA 66 HB1 ALA 66 -11.688 4.264 -13.642 558 HB2 ALA 66 HB2 ALA 66 -12.470 5.568 -12.744 559 HB3 ALA 66 HB3 ALA 66 -13.129 3.933 -12.683 560 H LYS 67 HN LYS 67 -11.972 1.994 -10.537 561 HA LYS 67 HA LYS 67 -9.602 0.600 -11.518 562 HB2 LYS 67 HB2 LYS 67 -10.035 0.236 -9.178 563 HB3 LYS 67 HB1 LYS 67 -11.725 -0.106 -9.488 564 HG2 LYS 67 HG2 LYS 67 -11.249 -2.227 -10.388 565 HG3 LYS 67 HG1 LYS 67 -9.532 -1.861 -10.551 566 HD2 LYS 67 HD2 LYS 67 -9.410 -3.094 -8.651 567 HD3 LYS 67 HD1 LYS 67 -9.788 -1.543 -7.903 568 HE2 LYS 67 HE2 LYS 67 -11.153 -3.390 -7.010 569 HE3 LYS 67 HE1 LYS 67 -12.133 -2.138 -7.762 570 HZ1 LYS 67 HZ1 LYS 67 -11.414 -4.136 -9.649 571 HZ2 LYS 67 HZ2 LYS 67 -12.953 -3.610 -9.186 572 HZ3 LYS 67 HZ3 LYS 67 -12.179 -4.833 -8.311 573 H VAL 68 HN VAL 68 -9.934 -0.049 -13.578 574 HA VAL 68 HA VAL 68 -12.571 -0.728 -14.499 575 HB VAL 68 HB VAL 68 -11.479 -1.161 -16.669 576 HG11 VAL 68 HG11 VAL 68 -10.487 1.460 -15.610 577 HG12 VAL 68 HG12 VAL 68 -12.211 1.132 -15.782 578 HG13 VAL 68 HG13 VAL 68 -11.161 1.089 -17.197 579 HG21 VAL 68 HG21 VAL 68 -9.268 -1.373 -16.952 580 HG22 VAL 68 HG22 VAL 68 -9.201 -1.589 -15.204 581 HG23 VAL 68 HG23 VAL 68 -8.915 0.002 -15.906 582 H LEU 69 HN LEU 69 -9.751 -2.451 -13.391 583 HA LEU 69 HA LEU 69 -11.268 -4.950 -13.784 584 HB2 LEU 69 HB2 LEU 69 -8.355 -4.584 -14.496 585 HB3 LEU 69 HB1 LEU 69 -9.180 -6.128 -14.439 586 HG LEU 69 HG LEU 69 -9.945 -3.878 -16.303 587 HD11 LEU 69 HD11 LEU 69 -8.962 -5.715 -17.947 588 HD12 LEU 69 HD12 LEU 69 -7.961 -6.070 -16.539 589 HD13 LEU 69 HD13 LEU 69 -7.955 -4.451 -17.241 590 HD21 LEU 69 HD21 LEU 69 -11.813 -5.283 -15.971 591 HD22 LEU 69 HD22 LEU 69 -10.821 -6.742 -16.022 592 HD23 LEU 69 HD23 LEU 69 -11.083 -5.802 -17.491 593 HA PRO 70 HA PRO 70 -11.246 -7.060 -13.187 594 HB2 PRO 70 HB2 PRO 70 -12.510 -7.851 -10.657 595 HB3 PRO 70 HB1 PRO 70 -11.649 -8.847 -11.833 596 HG2 PRO 70 HG2 PRO 70 -10.603 -8.307 -9.421 597 HG3 PRO 70 HG1 PRO 70 -9.585 -8.437 -10.870 598 HD2 PRO 70 HD2 PRO 70 -10.613 -5.970 -9.495 599 HD3 PRO 70 HD1 PRO 70 -8.979 -6.316 -10.103 600 HA PRO 71 HA PRO 71 -14.947 -4.590 -13.345 601 HB2 PRO 71 HB2 PRO 71 -16.629 -6.301 -14.611 602 HB3 PRO 71 HB1 PRO 71 -15.298 -5.488 -15.443 603 HG2 PRO 71 HG2 PRO 71 -15.409 -8.267 -14.321 604 HG3 PRO 71 HG1 PRO 71 -14.792 -7.724 -15.895 605 HD2 PRO 71 HD2 PRO 71 -13.150 -8.241 -13.822 606 HD3 PRO 71 HD1 PRO 71 -12.810 -6.947 -14.988 607 HA PRO 72 HA PRO 72 -17.336 -4.134 -13.628 608 HB2 PRO 72 HB2 PRO 72 -18.828 -2.575 -12.015 609 HB3 PRO 72 HB1 PRO 72 -19.452 -4.074 -12.716 610 HG2 PRO 72 HG2 PRO 72 -18.334 -3.590 -9.974 611 HG3 PRO 72 HG1 PRO 72 -19.802 -4.471 -10.439 612 HD2 PRO 72 HD2 PRO 72 -17.479 -5.730 -9.852 613 HD3 PRO 72 HD1 PRO 72 -18.626 -6.360 -11.052 614 H VAL 73 HN VAL 73 -17.021 -1.793 -13.757 615 HA VAL 73 HA VAL 73 -14.480 -1.031 -12.733 616 HB VAL 73 HB VAL 73 -16.561 0.632 -14.171 617 HG11 VAL 73 HG11 VAL 73 -14.503 1.996 -14.809 618 HG12 VAL 73 HG12 VAL 73 -13.689 1.176 -13.477 619 HG13 VAL 73 HG13 VAL 73 -15.107 2.174 -13.162 620 HG21 VAL 73 HG21 VAL 73 -14.804 -1.456 -15.071 621 HG22 VAL 73 HG22 VAL 73 -14.389 0.071 -15.851 622 HG23 VAL 73 HG23 VAL 73 -16.030 -0.561 -15.969 623 H ARG 74 HN ARG 74 -13.981 -0.035 -10.917 624 HA ARG 74 HA ARG 74 -16.119 1.126 -9.256 625 HB2 ARG 74 HB2 ARG 74 -14.721 -0.688 -8.284 626 HB3 ARG 74 HB1 ARG 74 -13.298 0.299 -8.546 627 HG2 ARG 74 HG2 ARG 74 -13.875 0.435 -6.249 628 HG3 ARG 74 HG1 ARG 74 -14.243 1.990 -6.993 629 HD2 ARG 74 HD2 ARG 74 -16.608 1.359 -7.139 630 HD3 ARG 74 HD1 ARG 74 -16.241 -0.202 -6.407 631 HE ARG 74 HE ARG 74 -16.078 0.820 -4.347 632 HH11 ARG 74 HH11 ARG 74 -16.357 3.228 -6.843 633 HH12 ARG 74 HH12 ARG 74 -16.606 4.536 -5.739 634 HH21 ARG 74 HH21 ARG 74 -16.410 2.526 -2.880 635 HH22 ARG 74 HH22 ARG 74 -16.639 4.136 -3.477 636 H ARG 75 HN ARG 75 -16.331 3.273 -9.451 637 HA ARG 75 HA ARG 75 -13.951 4.828 -10.156 638 HB2 ARG 75 HB2 ARG 75 -16.873 5.562 -10.272 639 HB3 ARG 75 HB1 ARG 75 -15.549 6.647 -10.668 640 HG2 ARG 75 HG2 ARG 75 -14.843 5.009 -12.420 641 HG3 ARG 75 HG1 ARG 75 -16.347 4.137 -12.110 642 HD2 ARG 75 HD2 ARG 75 -16.137 7.022 -12.952 643 HD3 ARG 75 HD1 ARG 75 -16.524 5.678 -14.022 644 HE ARG 75 HE ARG 75 -18.265 6.904 -12.049 645 HH11 ARG 75 HH11 ARG 75 -17.723 4.246 -14.236 646 HH12 ARG 75 HH12 ARG 75 -19.391 3.783 -14.296 647 HH21 ARG 75 HH21 ARG 75 -20.462 6.306 -12.118 648 HH22 ARG 75 HH22 ARG 75 -20.952 4.958 -13.089 649 H ILE 76 HN ILE 76 -12.950 5.957 -8.695 650 HA ILE 76 HA ILE 76 -14.307 6.508 -6.139 651 HB ILE 76 HB ILE 76 -11.350 6.408 -6.731 652 HG12 ILE 76 HG12 ILE 76 -13.127 4.459 -5.240 653 HG13 ILE 76 HG11 ILE 76 -12.482 4.211 -6.862 654 HG21 ILE 76 HG21 ILE 76 -12.912 7.294 -4.401 655 HG22 ILE 76 HG22 ILE 76 -11.261 7.691 -4.878 656 HG23 ILE 76 HG23 ILE 76 -11.596 6.178 -4.036 657 HD11 ILE 76 HD11 ILE 76 -10.329 3.913 -6.094 658 HD12 ILE 76 HD12 ILE 76 -11.314 3.096 -4.879 659 HD13 ILE 76 HD13 ILE 76 -10.665 4.704 -4.555 660 H ILE 77 HN ILE 77 -14.953 8.557 -5.844 661 HA ILE 77 HA ILE 77 -13.493 10.706 -7.236 662 HB ILE 77 HB ILE 77 -16.402 10.697 -6.431 663 HG12 ILE 77 HG12 ILE 77 -15.989 9.180 -8.311 664 HG13 ILE 77 HG11 ILE 77 -16.880 10.601 -8.843 665 HG21 ILE 77 HG21 ILE 77 -15.223 12.690 -8.304 666 HG22 ILE 77 HG22 ILE 77 -14.969 12.897 -6.570 667 HG23 ILE 77 HG23 ILE 77 -16.608 12.839 -7.219 668 HD11 ILE 77 HD11 ILE 77 -15.298 10.235 -10.510 669 HD12 ILE 77 HD12 ILE 77 -14.018 9.883 -9.349 670 HD13 ILE 77 HD13 ILE 77 -14.606 11.535 -9.540 671 H GLY 78 HN GLY 78 -12.506 12.158 -5.979 672 HA2 GLY 78 HA2 GLY 78 -13.476 13.430 -3.748 673 HA3 GLY 78 HA1 GLY 78 -12.676 11.990 -3.130 674 H ASP 79 HN ASP 79 -11.336 13.718 -2.066 675 HA ASP 79 HA ASP 79 -9.471 15.116 -3.788 676 HB2 ASP 79 HB2 ASP 79 -10.279 16.142 -1.670 677 HB3 ASP 79 HB1 ASP 79 -9.487 14.854 -0.768 678 H LEU 80 HN LEU 80 -8.076 13.794 -4.800 679 HA LEU 80 HA LEU 80 -6.959 11.504 -3.416 680 HB2 LEU 80 HB2 LEU 80 -6.519 12.511 -6.231 681 HB3 LEU 80 HB1 LEU 80 -5.886 11.009 -5.590 682 HG LEU 80 HG LEU 80 -8.820 11.655 -5.907 683 HD11 LEU 80 HD11 LEU 80 -8.834 10.339 -7.835 684 HD12 LEU 80 HD12 LEU 80 -7.248 9.649 -7.487 685 HD13 LEU 80 HD13 LEU 80 -7.384 11.328 -8.005 686 HD21 LEU 80 HD21 LEU 80 -9.018 9.161 -5.537 687 HD22 LEU 80 HD22 LEU 80 -8.591 10.120 -4.120 688 HD23 LEU 80 HD23 LEU 80 -7.349 9.201 -4.969 689 H SER 81 HN SER 81 -6.154 14.713 -3.535 690 HA SER 81 HA SER 81 -3.340 14.569 -3.909 691 HB2 SER 81 HB2 SER 81 -4.996 16.624 -2.414 692 HB3 SER 81 HB1 SER 81 -3.298 16.815 -2.851 693 HG SER 81 HG SER 81 -5.547 17.092 -4.391 694 H ASN 82 HN ASN 82 -5.426 13.781 -1.318 695 HA ASN 82 HA ASN 82 -3.342 13.812 0.701 696 HB2 ASN 82 HB2 ASN 82 -5.660 14.433 1.301 697 HB3 ASN 82 HB1 ASN 82 -6.188 12.821 0.848 698 HD21 ASN 82 HD21 ASN 82 -6.965 13.244 3.187 699 HD22 ASN 82 HD22 ASN 82 -5.936 12.618 4.427 700 H ARG 83 HN ARG 83 -1.957 12.205 0.875 701 HA ARG 83 HA ARG 83 -2.095 9.873 -0.634 702 HB2 ARG 83 HB2 ARG 83 -0.428 10.572 1.784 703 HB3 ARG 83 HB1 ARG 83 -0.252 9.036 0.947 704 HG2 ARG 83 HG2 ARG 83 1.202 10.020 -0.403 705 HG3 ARG 83 HG1 ARG 83 -0.129 10.980 -1.055 706 HD2 ARG 83 HD2 ARG 83 1.169 11.856 1.479 707 HD3 ARG 83 HD1 ARG 83 2.014 12.127 -0.045 708 HE ARG 83 HE ARG 83 -0.459 13.094 -0.540 709 HH11 ARG 83 HH11 ARG 83 1.849 13.657 2.008 710 HH12 ARG 83 HH12 ARG 83 1.342 15.290 2.284 711 HH21 ARG 83 HH21 ARG 83 -1.136 15.232 -0.198 712 HH22 ARG 83 HH22 ARG 83 -0.363 16.190 1.025 713 H GLU 84 HN GLU 84 -3.171 10.455 2.685 714 HA GLU 84 HA GLU 84 -3.564 7.770 3.419 715 HB2 GLU 84 HB2 GLU 84 -4.876 10.318 4.311 716 HB3 GLU 84 HB1 GLU 84 -5.320 8.751 4.978 717 HG2 GLU 84 HG2 GLU 84 -3.146 8.401 5.835 718 HG3 GLU 84 HG1 GLU 84 -2.506 9.797 4.969 719 H LYS 85 HN LYS 85 -5.835 10.018 1.771 720 HA LYS 85 HA LYS 85 -7.935 8.106 1.784 721 HB2 LYS 85 HB2 LYS 85 -7.443 10.509 0.005 722 HB3 LYS 85 HB1 LYS 85 -8.870 9.494 -0.156 723 HG2 LYS 85 HG2 LYS 85 -9.539 10.073 2.116 724 HG3 LYS 85 HG1 LYS 85 -8.106 11.089 2.283 725 HD2 LYS 85 HD2 LYS 85 -8.888 12.425 0.335 726 HD3 LYS 85 HD1 LYS 85 -10.352 11.446 0.300 727 HE2 LYS 85 HE2 LYS 85 -9.451 13.136 2.629 728 HE3 LYS 85 HE1 LYS 85 -10.694 13.587 1.463 729 HZ1 LYS 85 HZ1 LYS 85 -12.038 12.679 3.001 730 HZ2 LYS 85 HZ2 LYS 85 -10.823 11.720 3.682 731 HZ3 LYS 85 HZ3 LYS 85 -11.601 11.219 2.267 732 H VAL 86 HN VAL 86 -5.401 8.802 -0.551 733 HA VAL 86 HA VAL 86 -6.298 6.970 -2.505 734 HB VAL 86 HB VAL 86 -3.518 8.023 -1.945 735 HG11 VAL 86 HG11 VAL 86 -3.999 7.086 -4.639 736 HG12 VAL 86 HG12 VAL 86 -4.161 5.782 -3.463 737 HG13 VAL 86 HG13 VAL 86 -2.669 6.720 -3.543 738 HG21 VAL 86 HG21 VAL 86 -5.876 9.040 -3.297 739 HG22 VAL 86 HG22 VAL 86 -4.466 9.003 -4.355 740 HG23 VAL 86 HG23 VAL 86 -4.397 9.876 -2.824 741 H LEU 87 HN LEU 87 -4.121 6.620 0.269 742 HA LEU 87 HA LEU 87 -3.433 3.896 -0.251 743 HB2 LEU 87 HB2 LEU 87 -2.849 5.906 1.729 744 HB3 LEU 87 HB1 LEU 87 -3.252 4.396 2.522 745 HG LEU 87 HG LEU 87 -1.134 4.645 0.391 746 HD11 LEU 87 HD11 LEU 87 -0.163 4.154 3.059 747 HD12 LEU 87 HD12 LEU 87 -1.054 5.677 2.987 748 HD13 LEU 87 HD13 LEU 87 0.311 5.398 1.903 749 HD21 LEU 87 HD21 LEU 87 -2.437 2.417 1.357 750 HD22 LEU 87 HD22 LEU 87 -0.981 2.489 2.353 751 HD23 LEU 87 HD23 LEU 87 -0.845 2.432 0.596 752 H ILE 88 HN ILE 88 -5.810 5.401 1.925 753 HA ILE 88 HA ILE 88 -6.733 2.998 3.050 754 HB ILE 88 HB ILE 88 -8.035 5.691 2.729 755 HG12 ILE 88 HG12 ILE 88 -7.067 4.272 5.213 756 HG13 ILE 88 HG11 ILE 88 -6.013 5.282 4.229 757 HG21 ILE 88 HG21 ILE 88 -9.640 4.802 4.515 758 HG22 ILE 88 HG22 ILE 88 -9.134 3.196 3.990 759 HG23 ILE 88 HG23 ILE 88 -9.913 4.292 2.848 760 HD11 ILE 88 HD11 ILE 88 -6.645 6.959 5.522 761 HD12 ILE 88 HD12 ILE 88 -7.973 6.022 6.218 762 HD13 ILE 88 HD13 ILE 88 -8.205 6.883 4.697 763 H ALA 89 HN ALA 89 -7.928 4.851 0.248 764 HA ALA 89 HA ALA 89 -10.044 3.091 -0.394 765 HB1 ALA 89 HB1 ALA 89 -8.739 4.504 -2.630 766 HB2 ALA 89 HB2 ALA 89 -9.301 5.517 -1.299 767 HB3 ALA 89 HB3 ALA 89 -10.435 4.463 -2.147 768 H LEU 90 HN LEU 90 -6.654 3.186 -1.358 769 HA LEU 90 HA LEU 90 -6.781 1.112 -3.295 770 HB2 LEU 90 HB2 LEU 90 -4.877 2.916 -2.499 771 HB3 LEU 90 HB1 LEU 90 -4.247 1.430 -1.824 772 HG LEU 90 HG LEU 90 -3.347 2.026 -4.066 773 HD11 LEU 90 HD11 LEU 90 -2.993 -0.179 -3.561 774 HD12 LEU 90 HD12 LEU 90 -3.932 -0.313 -5.052 775 HD13 LEU 90 HD13 LEU 90 -4.718 -0.555 -3.491 776 HD21 LEU 90 HD21 LEU 90 -4.618 2.221 -5.926 777 HD22 LEU 90 HD22 LEU 90 -5.831 2.714 -4.746 778 HD23 LEU 90 HD23 LEU 90 -5.823 1.062 -5.365 779 H ARG 91 HN ARG 91 -6.090 1.163 0.182 780 HA ARG 91 HA ARG 91 -5.343 -1.556 0.462 781 HB2 ARG 91 HB2 ARG 91 -4.865 0.187 2.143 782 HB3 ARG 91 HB1 ARG 91 -6.584 0.319 2.482 783 HG2 ARG 91 HG2 ARG 91 -6.628 -1.953 3.315 784 HG3 ARG 91 HG1 ARG 91 -4.928 -2.164 2.894 785 HD2 ARG 91 HD2 ARG 91 -5.110 -1.716 5.254 786 HD3 ARG 91 HD1 ARG 91 -4.356 -0.335 4.458 787 HE ARG 91 HE ARG 91 -7.154 0.043 4.653 788 HH11 ARG 91 HH11 ARG 91 -4.248 0.061 6.571 789 HH12 ARG 91 HH12 ARG 91 -4.864 1.185 7.736 790 HH21 ARG 91 HH21 ARG 91 -7.982 1.522 6.177 791 HH22 ARG 91 HH22 ARG 91 -6.994 2.019 7.511 792 H LEU 92 HN LEU 92 -8.471 0.104 0.881 793 HA LEU 92 HA LEU 92 -9.912 -2.181 1.666 794 HB2 LEU 92 HB2 LEU 92 -10.809 0.380 0.349 795 HB3 LEU 92 HB1 LEU 92 -11.926 -0.857 0.891 796 HG LEU 92 HG LEU 92 -9.985 0.571 2.710 797 HD11 LEU 92 HD11 LEU 92 -12.867 1.133 2.059 798 HD12 LEU 92 HD12 LEU 92 -11.489 2.230 1.961 799 HD13 LEU 92 HD13 LEU 92 -12.086 1.704 3.535 800 HD21 LEU 92 HD21 LEU 92 -11.738 -0.313 4.400 801 HD22 LEU 92 HD22 LEU 92 -10.518 -1.421 3.770 802 HD23 LEU 92 HD23 LEU 92 -12.156 -1.449 3.117 803 H LEU 93 HN LEU 93 -9.257 -0.853 -1.546 804 HA LEU 93 HA LEU 93 -11.017 -2.585 -2.947 805 HB2 LEU 93 HB2 LEU 93 -8.536 -1.116 -3.827 806 HB3 LEU 93 HB1 LEU 93 -9.522 -2.067 -4.921 807 HG LEU 93 HG LEU 93 -10.548 0.300 -3.354 808 HD11 LEU 93 HD11 LEU 93 -9.081 0.109 -5.892 809 HD12 LEU 93 HD12 LEU 93 -9.284 1.473 -4.794 810 HD13 LEU 93 HD13 LEU 93 -10.557 1.073 -5.948 811 HD21 LEU 93 HD21 LEU 93 -11.907 -1.766 -4.630 812 HD22 LEU 93 HD22 LEU 93 -11.945 -0.430 -5.780 813 HD23 LEU 93 HD23 LEU 93 -12.569 -0.205 -4.145 814 H ALA 94 HN ALA 94 -7.621 -2.810 -2.020 815 HA ALA 94 HA ALA 94 -7.009 -5.165 -3.430 816 HB1 ALA 94 HB1 ALA 94 -4.983 -5.204 -2.268 817 HB2 ALA 94 HB2 ALA 94 -5.671 -4.393 -0.860 818 HB3 ALA 94 HB3 ALA 94 -5.406 -3.495 -2.356 819 H GLU 95 HN GLU 95 -8.329 -4.667 -0.187 820 HA GLU 95 HA GLU 95 -8.082 -7.316 0.723 821 HB2 GLU 95 HB2 GLU 95 -10.022 -5.105 1.399 822 HB3 GLU 95 HB1 GLU 95 -10.007 -6.653 2.235 823 HG2 GLU 95 HG2 GLU 95 -7.796 -6.260 3.060 824 HG3 GLU 95 HG1 GLU 95 -7.632 -4.813 2.066 825 H GLU 96 HN GLU 96 -10.542 -5.658 -1.163 826 HA GLU 96 HA GLU 96 -12.484 -7.695 -1.198 827 HB2 GLU 96 HB2 GLU 96 -11.833 -5.480 -3.158 828 HB3 GLU 96 HB1 GLU 96 -13.231 -6.538 -3.330 829 HG2 GLU 96 HG2 GLU 96 -12.687 -4.689 -1.014 830 HG3 GLU 96 HG1 GLU 96 -13.847 -4.418 -2.313 831 H ILE 97 HN ILE 97 -9.734 -6.998 -3.292 832 HA ILE 97 HA ILE 97 -10.264 -9.050 -5.192 833 HB ILE 97 HB ILE 97 -7.700 -7.568 -4.592 834 HG12 ILE 97 HG12 ILE 97 -9.787 -7.114 -6.730 835 HG13 ILE 97 HG11 ILE 97 -9.674 -6.197 -5.229 836 HG21 ILE 97 HG21 ILE 97 -6.796 -8.376 -6.597 837 HG22 ILE 97 HG22 ILE 97 -8.366 -8.928 -7.184 838 HG23 ILE 97 HG23 ILE 97 -7.558 -9.797 -5.881 839 HD11 ILE 97 HD11 ILE 97 -7.238 -6.324 -6.857 840 HD12 ILE 97 HD12 ILE 97 -7.937 -4.993 -5.931 841 HD13 ILE 97 HD13 ILE 97 -8.590 -5.404 -7.517 842 H GLY 98 HN GLY 98 -8.101 -8.800 -2.388 843 HA2 GLY 98 HA2 GLY 98 -6.839 -11.303 -2.663 844 HA3 GLY 98 HA1 GLY 98 -6.986 -10.394 -1.166 845 H ASP 99 HN ASP 99 -9.859 -10.392 -1.108 846 HA ASP 99 HA ASP 99 -10.337 -12.776 0.299 847 HB2 ASP 99 HB2 ASP 99 -11.586 -10.661 0.653 848 HB3 ASP 99 HB1 ASP 99 -12.387 -10.899 -0.897 849 H TYR 100 HN TYR 100 -11.106 -11.850 -3.026 850 HA TYR 100 HA TYR 100 -12.522 -14.322 -3.518 851 HB2 TYR 100 HB2 TYR 100 -13.251 -12.231 -4.607 852 HB3 TYR 100 HB1 TYR 100 -11.698 -12.122 -5.429 853 HD1 TYR 100 HD1 TYR 100 -14.746 -14.226 -5.126 854 HD2 TYR 100 HD2 TYR 100 -11.355 -13.209 -7.486 855 HE1 TYR 100 HE1 TYR 100 -15.647 -15.559 -6.985 856 HE2 TYR 100 HE2 TYR 100 -12.248 -14.539 -9.352 857 HH TYR 100 HH TYR 100 -15.389 -15.569 -9.537 858 H LYS 101 HN LYS 101 -11.401 -16.115 -3.734 859 HA LYS 101 HA LYS 101 -8.819 -16.032 -5.142 860 HB2 LYS 101 HB2 LYS 101 -9.846 -18.025 -3.113 861 HB3 LYS 101 HB1 LYS 101 -8.304 -18.149 -3.949 862 HG2 LYS 101 HG2 LYS 101 -7.591 -16.035 -2.924 863 HG3 LYS 101 HG1 LYS 101 -9.127 -15.948 -2.062 864 HD2 LYS 101 HD2 LYS 101 -7.170 -18.229 -1.801 865 HD3 LYS 101 HD1 LYS 101 -7.221 -16.844 -0.709 866 HE2 LYS 101 HE2 LYS 101 -9.500 -18.757 -1.216 867 HE3 LYS 101 HE1 LYS 101 -8.432 -18.792 0.186 868 HZ1 LYS 101 HZ1 LYS 101 -10.547 -17.665 0.633 869 HZ2 LYS 101 HZ2 LYS 101 -10.188 -16.509 -0.549 870 HZ3 LYS 101 HZ3 LYS 101 -9.226 -16.627 0.836 871 H ASP 102 HN ASP 102 -8.382 -17.546 -6.753 872 HA ASP 102 HA ASP 102 -10.748 -18.632 -8.049 873 HB2 ASP 102 HB2 ASP 102 -9.025 -17.382 -9.355 874 HB3 ASP 102 HB1 ASP 102 -7.872 -18.662 -8.993 875 H ASP 103 HN ASP 103 -11.385 -20.472 -7.039 876 HA ASP 103 HA ASP 103 -9.417 -22.663 -6.930 877 HB2 ASP 103 HB2 ASP 103 -10.074 -21.772 -4.658 878 HB3 ASP 103 HB1 ASP 103 -11.719 -22.299 -5.000 879 H ASP 104 HN ASP 104 -9.927 -24.069 -8.471 880 HA ASP 104 HA ASP 104 -12.456 -24.245 -9.721 881 HB2 ASP 104 HB2 ASP 104 -10.270 -24.900 -10.763 882 HB3 ASP 104 HB1 ASP 104 -10.276 -26.340 -9.750 883 H ASP 105 HN ASP 105 -11.071 -25.888 -6.976 884 HA ASP 105 HA ASP 105 -13.177 -27.900 -6.937 885 HB2 ASP 105 HB2 ASP 105 -10.851 -28.509 -6.302 886 HB3 ASP 105 HB1 ASP 105 -10.954 -27.395 -4.942 887 H LYS 106 HN LYS 106 -15.101 -27.130 -6.337 888 HA LYS 106 HA LYS 106 -16.765 -26.196 -5.111 889 HB2 LYS 106 HB2 LYS 106 -14.736 -26.564 -2.904 890 HB3 LYS 106 HB1 LYS 106 -16.402 -26.074 -2.627 891 HG2 LYS 106 HG2 LYS 106 -17.186 -28.170 -3.610 892 HG3 LYS 106 HG1 LYS 106 -15.515 -28.661 -3.893 893 HD2 LYS 106 HD2 LYS 106 -15.083 -28.609 -1.490 894 HD3 LYS 106 HD1 LYS 106 -16.742 -28.080 -1.196 895 HE2 LYS 106 HE2 LYS 106 -16.545 -30.459 -0.786 896 HE3 LYS 106 HE1 LYS 106 -17.565 -30.172 -2.195 897 HZ1 LYS 106 HZ1 LYS 106 -15.182 -31.674 -2.014 898 HZ2 LYS 106 HZ2 LYS 106 -14.966 -30.422 -3.131 899 HZ3 LYS 106 HZ3 LYS 106 -16.241 -31.517 -3.325 Start of MODEL 7 1 H1 MET 1 HT1 MET 1 -20.084 -12.211 -16.526 2 H2 MET 1 HT2 MET 1 -19.064 -11.250 -17.471 3 H3 MET 1 HT3 MET 1 -18.575 -11.738 -15.926 4 HA MET 1 HA MET 1 -18.625 -14.067 -16.665 5 HB2 MET 1 HB2 MET 1 -19.007 -12.782 -19.379 6 HB3 MET 1 HB1 MET 1 -18.680 -14.486 -19.095 7 HG2 MET 1 HG2 MET 1 -20.792 -14.717 -17.921 8 HG3 MET 1 HG1 MET 1 -21.114 -12.997 -18.135 9 HE1 MET 1 HE1 MET 1 -23.705 -14.798 -20.462 10 HE2 MET 1 HE2 MET 1 -23.531 -13.303 -19.544 11 HE3 MET 1 HE3 MET 1 -23.235 -14.856 -18.763 12 H ALA 2 HN ALA 2 -17.138 -11.153 -16.997 13 HA ALA 2 HA ALA 2 -14.774 -11.895 -18.415 14 HB1 ALA 2 HB1 ALA 2 -15.674 -9.535 -16.864 15 HB2 ALA 2 HB2 ALA 2 -14.993 -9.632 -18.487 16 HB3 ALA 2 HB3 ALA 2 -13.938 -9.755 -17.078 17 HA PRO 3 HA PRO 3 -12.795 -14.292 -15.208 18 HB2 PRO 3 HB2 PRO 3 -10.345 -13.472 -16.688 19 HB3 PRO 3 HB1 PRO 3 -10.895 -15.089 -16.229 20 HG2 PRO 3 HG2 PRO 3 -11.094 -14.296 -18.748 21 HG3 PRO 3 HG1 PRO 3 -12.417 -15.212 -17.994 22 HD2 PRO 3 HD2 PRO 3 -12.209 -12.263 -18.512 23 HD3 PRO 3 HD1 PRO 3 -13.594 -13.353 -18.740 24 H LEU 4 HN LEU 4 -11.766 -13.891 -13.304 25 HA LEU 4 HA LEU 4 -10.836 -11.137 -12.868 26 HB2 LEU 4 HB2 LEU 4 -11.691 -13.111 -10.754 27 HB3 LEU 4 HB1 LEU 4 -11.415 -11.391 -10.556 28 HG LEU 4 HG LEU 4 -13.401 -11.527 -12.498 29 HD11 LEU 4 HD11 LEU 4 -14.001 -13.511 -10.308 30 HD12 LEU 4 HD12 LEU 4 -13.710 -13.906 -12.002 31 HD13 LEU 4 HD13 LEU 4 -15.121 -12.951 -11.549 32 HD21 LEU 4 HD21 LEU 4 -13.895 -9.869 -11.084 33 HD22 LEU 4 HD22 LEU 4 -13.097 -10.663 -9.727 34 HD23 LEU 4 HD23 LEU 4 -14.754 -11.093 -10.152 35 H ARG 5 HN ARG 5 -8.844 -10.753 -11.978 36 HA ARG 5 HA ARG 5 -7.143 -13.091 -11.438 37 HB2 ARG 5 HB2 ARG 5 -6.375 -10.622 -12.979 38 HB3 ARG 5 HB1 ARG 5 -5.259 -11.885 -12.476 39 HG2 ARG 5 HG2 ARG 5 -6.688 -13.502 -13.783 40 HG3 ARG 5 HG1 ARG 5 -7.510 -12.088 -14.452 41 HD2 ARG 5 HD2 ARG 5 -5.357 -11.238 -15.247 42 HD3 ARG 5 HD1 ARG 5 -4.570 -12.675 -14.602 43 HE ARG 5 HE ARG 5 -5.401 -13.912 -16.369 44 HH11 ARG 5 HH11 ARG 5 -6.772 -10.707 -16.391 45 HH12 ARG 5 HH12 ARG 5 -7.435 -10.859 -17.984 46 HH21 ARG 5 HH21 ARG 5 -6.266 -14.123 -18.466 47 HH22 ARG 5 HH22 ARG 5 -7.146 -12.807 -19.165 48 H LYS 6 HN LYS 6 -5.250 -12.618 -10.096 49 HA LYS 6 HA LYS 6 -5.906 -11.165 -7.787 50 HB2 LYS 6 HB2 LYS 6 -3.294 -12.311 -8.752 51 HB3 LYS 6 HB1 LYS 6 -3.462 -11.519 -7.192 52 HG2 LYS 6 HG2 LYS 6 -5.160 -13.858 -8.017 53 HG3 LYS 6 HG1 LYS 6 -3.615 -14.034 -7.182 54 HD2 LYS 6 HD2 LYS 6 -4.469 -12.658 -5.335 55 HD3 LYS 6 HD1 LYS 6 -6.019 -12.509 -6.167 56 HE2 LYS 6 HE2 LYS 6 -4.801 -15.148 -5.377 57 HE3 LYS 6 HE1 LYS 6 -5.922 -14.250 -4.354 58 HZ1 LYS 6 HZ1 LYS 6 -6.619 -16.064 -6.241 59 HZ2 LYS 6 HZ2 LYS 6 -6.873 -14.595 -7.038 60 HZ3 LYS 6 HZ3 LYS 6 -7.656 -14.903 -5.566 61 H THR 7 HN THR 7 -3.894 -10.345 -10.543 62 HA THR 7 HA THR 7 -3.114 -7.817 -9.403 63 HB THR 7 HB THR 7 -2.486 -7.485 -11.986 64 HG1 THR 7 HG1 THR 7 -3.235 -9.392 -12.806 65 HG21 THR 7 HG21 THR 7 -0.326 -8.872 -11.323 66 HG22 THR 7 HG22 THR 7 -1.081 -8.813 -9.730 67 HG23 THR 7 HG23 THR 7 -0.695 -7.314 -10.581 68 H ALA 8 HN ALA 8 -4.377 -6.135 -9.331 69 HA ALA 8 HA ALA 8 -6.676 -5.965 -11.135 70 HB1 ALA 8 HB1 ALA 8 -6.822 -5.808 -8.570 71 HB2 ALA 8 HB2 ALA 8 -7.722 -4.638 -9.540 72 HB3 ALA 8 HB3 ALA 8 -6.195 -4.172 -8.788 73 H VAL 9 HN VAL 9 -7.202 -3.991 -12.193 74 HA VAL 9 HA VAL 9 -4.808 -2.385 -12.790 75 HB VAL 9 HB VAL 9 -7.185 -2.926 -14.571 76 HG11 VAL 9 HG11 VAL 9 -4.862 -1.074 -14.793 77 HG12 VAL 9 HG12 VAL 9 -6.525 -0.871 -15.343 78 HG13 VAL 9 HG13 VAL 9 -5.416 -1.894 -16.255 79 HG21 VAL 9 HG21 VAL 9 -5.242 -4.682 -14.052 80 HG22 VAL 9 HG22 VAL 9 -4.439 -3.748 -15.313 81 HG23 VAL 9 HG23 VAL 9 -5.984 -4.529 -15.644 82 H LEU 10 HN LEU 10 -4.873 -0.327 -12.265 83 HA LEU 10 HA LEU 10 -7.479 0.934 -11.663 84 HB2 LEU 10 HB2 LEU 10 -5.517 0.545 -9.871 85 HB3 LEU 10 HB1 LEU 10 -4.929 2.036 -10.571 86 HG LEU 10 HG LEU 10 -6.162 2.503 -8.544 87 HD11 LEU 10 HD11 LEU 10 -8.171 3.800 -9.710 88 HD12 LEU 10 HD12 LEU 10 -7.203 3.440 -11.142 89 HD13 LEU 10 HD13 LEU 10 -6.493 4.342 -9.802 90 HD21 LEU 10 HD21 LEU 10 -8.787 2.074 -8.870 91 HD22 LEU 10 HD22 LEU 10 -7.707 0.939 -8.055 92 HD23 LEU 10 HD23 LEU 10 -8.146 0.680 -9.744 93 H LYS 11 HN LYS 11 -7.975 2.750 -12.887 94 HA LYS 11 HA LYS 11 -5.779 3.723 -14.589 95 HB2 LYS 11 HB2 LYS 11 -8.718 3.502 -15.252 96 HB3 LYS 11 HB1 LYS 11 -7.588 4.463 -16.197 97 HG2 LYS 11 HG2 LYS 11 -6.282 2.444 -16.665 98 HG3 LYS 11 HG1 LYS 11 -7.450 1.489 -15.753 99 HD2 LYS 11 HD2 LYS 11 -9.211 2.136 -17.308 100 HD3 LYS 11 HD1 LYS 11 -8.068 3.138 -18.204 101 HE2 LYS 11 HE2 LYS 11 -6.753 1.155 -18.749 102 HE3 LYS 11 HE1 LYS 11 -7.882 0.148 -17.844 103 HZ1 LYS 11 HZ1 LYS 11 -9.267 1.720 -19.750 104 HZ2 LYS 11 HZ2 LYS 11 -9.204 0.037 -19.603 105 HZ3 LYS 11 HZ3 LYS 11 -8.031 0.850 -20.512 106 H LEU 12 HN LEU 12 -5.254 5.760 -14.408 107 HA LEU 12 HA LEU 12 -6.985 7.486 -12.784 108 HB2 LEU 12 HB2 LEU 12 -4.333 6.930 -12.480 109 HB3 LEU 12 HB1 LEU 12 -4.250 8.388 -13.447 110 HG LEU 12 HG LEU 12 -5.363 8.047 -10.675 111 HD11 LEU 12 HD11 LEU 12 -3.593 10.265 -11.550 112 HD12 LEU 12 HD12 LEU 12 -2.896 8.654 -11.390 113 HD13 LEU 12 HD13 LEU 12 -3.673 9.419 -10.005 114 HD21 LEU 12 HD21 LEU 12 -6.046 10.122 -12.702 115 HD22 LEU 12 HD22 LEU 12 -5.870 10.593 -11.011 116 HD23 LEU 12 HD23 LEU 12 -7.058 9.371 -11.467 117 H TYR 13 HN TYR 13 -8.058 9.121 -13.890 118 HA TYR 13 HA TYR 13 -7.162 9.707 -16.627 119 HB2 TYR 13 HB2 TYR 13 -9.771 10.253 -15.190 120 HB3 TYR 13 HB1 TYR 13 -9.416 10.713 -16.852 121 HD1 TYR 13 HD1 TYR 13 -10.042 7.872 -14.591 122 HD2 TYR 13 HD2 TYR 13 -9.449 9.088 -18.625 123 HE1 TYR 13 HE1 TYR 13 -10.814 5.671 -15.362 124 HE2 TYR 13 HE2 TYR 13 -10.218 6.887 -19.405 125 HH TYR 13 HH TYR 13 -11.949 4.921 -17.951 126 H VAL 14 HN VAL 14 -6.002 11.522 -16.865 127 HA VAL 14 HA VAL 14 -6.428 13.710 -14.931 128 HB VAL 14 HB VAL 14 -4.022 14.273 -15.149 129 HG11 VAL 14 HG11 VAL 14 -3.235 12.396 -13.680 130 HG12 VAL 14 HG12 VAL 14 -4.772 11.589 -13.993 131 HG13 VAL 14 HG13 VAL 14 -4.747 13.149 -13.164 132 HG21 VAL 14 HG21 VAL 14 -3.997 12.574 -17.270 133 HG22 VAL 14 HG22 VAL 14 -3.302 11.557 -16.009 134 HG23 VAL 14 HG23 VAL 14 -2.558 13.108 -16.400 135 H ALA 15 HN ALA 15 -5.740 15.832 -15.726 136 HA ALA 15 HA ALA 15 -6.103 16.043 -18.638 137 HB1 ALA 15 HB1 ALA 15 -7.817 17.444 -18.362 138 HB2 ALA 15 HB2 ALA 15 -6.869 18.458 -17.275 139 HB3 ALA 15 HB3 ALA 15 -7.772 17.084 -16.636 140 H GLY 16 HN GLY 16 -4.021 16.299 -19.288 141 HA2 GLY 16 HA2 GLY 16 -2.090 17.452 -19.732 142 HA3 GLY 16 HA1 GLY 16 -2.797 18.827 -18.896 143 H ASN 17 HN ASN 17 -0.801 19.335 -17.963 144 HA ASN 17 HA ASN 17 0.077 17.477 -15.852 145 HB2 ASN 17 HB2 ASN 17 1.660 19.474 -17.478 146 HB3 ASN 17 HB1 ASN 17 2.276 18.767 -15.990 147 HD21 ASN 17 HD21 ASN 17 3.484 18.509 -18.513 148 HD22 ASN 17 HD22 ASN 17 3.445 16.840 -18.958 149 H THR 18 HN THR 18 -2.064 19.090 -15.364 150 HA THR 18 HA THR 18 -1.330 21.568 -14.146 151 HB THR 18 HB THR 18 -3.602 21.577 -13.219 152 HG1 THR 18 HG1 THR 18 -4.942 19.678 -13.930 153 HG21 THR 18 HG21 THR 18 -4.087 20.512 -15.942 154 HG22 THR 18 HG22 THR 18 -2.983 21.880 -15.795 155 HG23 THR 18 HG23 THR 18 -4.637 22.013 -15.197 156 HA PRO 19 HA PRO 19 0.143 20.407 -10.186 157 HB2 PRO 19 HB2 PRO 19 -2.048 22.079 -9.008 158 HB3 PRO 19 HB1 PRO 19 -0.314 22.100 -8.667 159 HG2 PRO 19 HG2 PRO 19 -1.352 23.994 -10.181 160 HG3 PRO 19 HG1 PRO 19 0.188 23.245 -10.648 161 HD2 PRO 19 HD2 PRO 19 -2.558 22.770 -11.747 162 HD3 PRO 19 HD1 PRO 19 -1.007 22.903 -12.604 163 H ASN 20 HN ASN 20 -3.388 20.325 -10.498 164 HA ASN 20 HA ASN 20 -3.843 18.548 -8.320 165 HB2 ASN 20 HB2 ASN 20 -5.540 18.982 -10.808 166 HB3 ASN 20 HB1 ASN 20 -6.041 18.090 -9.380 167 HD21 ASN 20 HD21 ASN 20 -5.657 19.402 -7.280 168 HD22 ASN 20 HD22 ASN 20 -6.244 21.025 -7.327 169 H SER 21 HN SER 21 -3.475 18.019 -11.827 170 HA SER 21 HA SER 21 -3.672 15.183 -11.770 171 HB2 SER 21 HB2 SER 21 -2.353 17.043 -13.762 172 HB3 SER 21 HB1 SER 21 -2.638 15.325 -14.026 173 HG SER 21 HG SER 21 -4.348 17.413 -14.283 174 H VAL 22 HN VAL 22 -0.868 17.362 -11.676 175 HA VAL 22 HA VAL 22 1.035 15.272 -11.696 176 HB VAL 22 HB VAL 22 1.222 18.124 -10.695 177 HG11 VAL 22 HG11 VAL 22 3.723 17.733 -10.811 178 HG12 VAL 22 HG12 VAL 22 3.353 16.008 -10.816 179 HG13 VAL 22 HG13 VAL 22 2.874 17.010 -9.443 180 HG21 VAL 22 HG21 VAL 22 2.793 18.178 -12.766 181 HG22 VAL 22 HG22 VAL 22 1.045 18.238 -12.992 182 HG23 VAL 22 HG23 VAL 22 1.915 16.723 -13.240 183 H ARG 23 HN ARG 23 -0.478 17.074 -9.055 184 HA ARG 23 HA ARG 23 0.911 15.894 -6.907 185 HB2 ARG 23 HB2 ARG 23 -0.560 17.955 -6.900 186 HB3 ARG 23 HB1 ARG 23 -1.940 16.858 -6.908 187 HG2 ARG 23 HG2 ARG 23 -1.550 16.122 -4.772 188 HG3 ARG 23 HG1 ARG 23 0.142 16.631 -4.783 189 HD2 ARG 23 HD2 ARG 23 -2.221 18.508 -4.837 190 HD3 ARG 23 HD1 ARG 23 -1.331 18.065 -3.379 191 HE ARG 23 HE ARG 23 0.514 19.020 -5.228 192 HH11 ARG 23 HH11 ARG 23 -2.208 20.202 -3.405 193 HH12 ARG 23 HH12 ARG 23 -1.615 21.828 -3.321 194 HH21 ARG 23 HH21 ARG 23 1.310 21.154 -5.127 195 HH22 ARG 23 HH22 ARG 23 0.391 22.370 -4.304 196 H ALA 24 HN ALA 24 -2.192 15.106 -8.436 197 HA ALA 24 HA ALA 24 -2.826 12.956 -6.744 198 HB1 ALA 24 HB1 ALA 24 -4.722 12.913 -7.910 199 HB2 ALA 24 HB2 ALA 24 -3.871 12.602 -9.423 200 HB3 ALA 24 HB3 ALA 24 -4.070 14.258 -8.848 201 H LEU 25 HN LEU 25 -1.168 13.108 -9.859 202 HA LEU 25 HA LEU 25 -0.845 10.352 -10.311 203 HB2 LEU 25 HB2 LEU 25 -0.511 12.022 -12.050 204 HB3 LEU 25 HB1 LEU 25 0.861 12.685 -11.186 205 HG LEU 25 HG LEU 25 2.099 10.588 -11.546 206 HD11 LEU 25 HD11 LEU 25 1.065 9.100 -13.402 207 HD12 LEU 25 HD12 LEU 25 -0.467 9.785 -12.860 208 HD13 LEU 25 HD13 LEU 25 0.543 8.881 -11.731 209 HD21 LEU 25 HD21 LEU 25 2.393 12.405 -13.112 210 HD22 LEU 25 HD22 LEU 25 0.987 11.875 -14.035 211 HD23 LEU 25 HD23 LEU 25 2.433 10.865 -13.971 212 H LYS 26 HN LYS 26 1.329 12.674 -8.709 213 HA LYS 26 HA LYS 26 3.398 10.828 -8.195 214 HB2 LYS 26 HB2 LYS 26 2.692 13.540 -7.315 215 HB3 LYS 26 HB1 LYS 26 3.603 12.615 -6.128 216 HG2 LYS 26 HG2 LYS 26 5.099 13.921 -7.506 217 HG3 LYS 26 HG1 LYS 26 5.348 12.199 -7.800 218 HD2 LYS 26 HD2 LYS 26 4.461 12.295 -9.919 219 HD3 LYS 26 HD1 LYS 26 3.444 13.689 -9.545 220 HE2 LYS 26 HE2 LYS 26 5.252 14.304 -11.063 221 HE3 LYS 26 HE1 LYS 26 5.418 15.126 -9.513 222 HZ1 LYS 26 HZ1 LYS 26 7.037 12.936 -10.632 223 HZ2 LYS 26 HZ2 LYS 26 6.947 13.142 -8.956 224 HZ3 LYS 26 HZ3 LYS 26 7.544 14.388 -9.929 225 H THR 27 HN THR 27 0.558 11.783 -6.324 226 HA THR 27 HA THR 27 1.137 10.345 -3.965 227 HB THR 27 HB THR 27 -1.532 11.172 -5.125 228 HG1 THR 27 HG1 THR 27 -0.368 13.011 -4.767 229 HG21 THR 27 HG21 THR 27 -2.230 9.786 -3.453 230 HG22 THR 27 HG22 THR 27 -1.943 11.243 -2.501 231 HG23 THR 27 HG23 THR 27 -0.733 9.958 -2.537 232 H LEU 28 HN LEU 28 -0.740 9.486 -6.867 233 HA LEU 28 HA LEU 28 -1.549 6.952 -5.850 234 HB2 LEU 28 HB2 LEU 28 -2.197 8.543 -8.038 235 HB3 LEU 28 HB1 LEU 28 -1.491 7.108 -8.748 236 HG LEU 28 HG LEU 28 -4.051 7.427 -7.272 237 HD11 LEU 28 HD11 LEU 28 -3.522 5.344 -9.308 238 HD12 LEU 28 HD12 LEU 28 -3.491 7.028 -9.834 239 HD13 LEU 28 HD13 LEU 28 -4.937 6.369 -9.070 240 HD21 LEU 28 HD21 LEU 28 -2.183 5.155 -6.888 241 HD22 LEU 28 HD22 LEU 28 -3.887 4.778 -7.145 242 HD23 LEU 28 HD23 LEU 28 -3.408 5.814 -5.803 243 H ALA 29 HN ALA 29 0.946 7.902 -8.263 244 HA ALA 29 HA ALA 29 1.750 5.304 -8.922 245 HB1 ALA 29 HB1 ALA 29 4.004 6.786 -9.315 246 HB2 ALA 29 HB2 ALA 29 2.730 8.007 -9.379 247 HB3 ALA 29 HB3 ALA 29 2.674 6.615 -10.463 248 H ASN 30 HN ASN 30 3.054 7.517 -6.438 249 HA ASN 30 HA ASN 30 5.232 5.804 -5.776 250 HB2 ASN 30 HB2 ASN 30 5.266 8.190 -5.182 251 HB3 ASN 30 HB1 ASN 30 3.894 7.954 -4.106 252 HD21 ASN 30 HD21 ASN 30 7.243 6.999 -4.662 253 HD22 ASN 30 HD22 ASN 30 7.623 6.719 -3.000 254 H ILE 31 HN ILE 31 1.997 6.156 -4.426 255 HA ILE 31 HA ILE 31 2.388 4.310 -2.358 256 HB ILE 31 HB ILE 31 -0.105 5.316 -3.678 257 HG12 ILE 31 HG12 ILE 31 0.976 5.630 -0.879 258 HG13 ILE 31 HG11 ILE 31 1.301 6.757 -2.192 259 HG21 ILE 31 HG21 ILE 31 -0.382 2.930 -2.858 260 HG22 ILE 31 HG22 ILE 31 -1.494 4.133 -2.203 261 HG23 ILE 31 HG23 ILE 31 -0.129 3.571 -1.234 262 HD11 ILE 31 HD11 ILE 31 -1.475 6.082 -1.319 263 HD12 ILE 31 HD12 ILE 31 -0.924 7.450 -2.284 264 HD13 ILE 31 HD13 ILE 31 -0.531 7.364 -0.567 265 H LEU 32 HN LEU 32 1.105 3.917 -5.645 266 HA LEU 32 HA LEU 32 0.637 1.139 -5.388 267 HB2 LEU 32 HB2 LEU 32 0.879 2.934 -7.775 268 HB3 LEU 32 HB1 LEU 32 0.589 1.212 -7.930 269 HG LEU 32 HG LEU 32 -1.225 3.049 -6.352 270 HD11 LEU 32 HD11 LEU 32 -1.811 1.984 -9.095 271 HD12 LEU 32 HD12 LEU 32 -1.000 3.534 -8.870 272 HD13 LEU 32 HD13 LEU 32 -2.615 3.280 -8.210 273 HD21 LEU 32 HD21 LEU 32 -2.703 0.945 -7.188 274 HD22 LEU 32 HD22 LEU 32 -1.898 1.041 -5.623 275 HD23 LEU 32 HD23 LEU 32 -1.132 0.177 -6.956 276 H GLU 33 HN GLU 33 3.454 2.978 -6.456 277 HA GLU 33 HA GLU 33 4.835 0.708 -7.507 278 HB2 GLU 33 HB2 GLU 33 6.615 2.144 -7.981 279 HB3 GLU 33 HB1 GLU 33 5.191 3.166 -8.123 280 HG2 GLU 33 HG2 GLU 33 5.596 3.986 -5.853 281 HG3 GLU 33 HG1 GLU 33 7.078 3.038 -5.806 282 H LYS 34 HN LYS 34 4.433 1.885 -4.292 283 HA LYS 34 HA LYS 34 6.635 0.112 -3.433 284 HB2 LYS 34 HB2 LYS 34 5.600 2.544 -1.964 285 HB3 LYS 34 HB1 LYS 34 6.902 1.492 -1.430 286 HG2 LYS 34 HG2 LYS 34 6.937 3.213 -3.899 287 HG3 LYS 34 HG1 LYS 34 7.736 3.582 -2.373 288 HD2 LYS 34 HD2 LYS 34 9.096 1.546 -2.611 289 HD3 LYS 34 HD1 LYS 34 8.319 1.222 -4.162 290 HE2 LYS 34 HE2 LYS 34 9.185 3.346 -5.029 291 HE3 LYS 34 HE1 LYS 34 9.972 3.653 -3.482 292 HZ1 LYS 34 HZ1 LYS 34 10.546 1.253 -5.122 293 HZ2 LYS 34 HZ2 LYS 34 11.433 1.851 -3.812 294 HZ3 LYS 34 HZ3 LYS 34 11.416 2.696 -5.277 295 H GLU 35 HN GLU 35 3.689 1.582 -2.088 296 HA GLU 35 HA GLU 35 3.273 -0.391 -0.120 297 HB2 GLU 35 HB2 GLU 35 1.451 1.682 -1.349 298 HB3 GLU 35 HB1 GLU 35 0.940 0.623 -0.035 299 HG2 GLU 35 HG2 GLU 35 3.225 2.584 0.057 300 HG3 GLU 35 HG1 GLU 35 1.638 2.800 0.795 301 H PHE 36 HN PHE 36 1.997 -0.050 -3.402 302 HA PHE 36 HA PHE 36 0.650 -2.651 -3.067 303 HB2 PHE 36 HB2 PHE 36 -0.309 -0.186 -4.024 304 HB3 PHE 36 HB1 PHE 36 -0.185 -1.241 -5.427 305 HD1 PHE 36 HD1 PHE 36 -2.683 -0.051 -4.124 306 HD2 PHE 36 HD2 PHE 36 -0.730 -3.807 -3.737 307 HE1 PHE 36 HE1 PHE 36 -4.824 -1.102 -3.534 308 HE2 PHE 36 HE2 PHE 36 -2.868 -4.860 -3.143 309 HZ PHE 36 HZ PHE 36 -4.915 -3.500 -3.050 310 H LYS 37 HN LYS 37 3.504 -2.028 -3.920 311 HA LYS 37 HA LYS 37 3.805 -2.488 -6.665 312 HB2 LYS 37 HB2 LYS 37 5.598 -1.666 -5.179 313 HB3 LYS 37 HB1 LYS 37 5.699 -3.259 -4.442 314 HG2 LYS 37 HG2 LYS 37 6.397 -4.217 -6.563 315 HG3 LYS 37 HG1 LYS 37 6.247 -2.639 -7.339 316 HD2 LYS 37 HD2 LYS 37 7.963 -1.754 -5.800 317 HD3 LYS 37 HD1 LYS 37 8.150 -3.372 -5.116 318 HE2 LYS 37 HE2 LYS 37 8.607 -2.632 -8.002 319 HE3 LYS 37 HE1 LYS 37 9.874 -2.850 -6.797 320 HZ1 LYS 37 HZ1 LYS 37 9.892 -4.957 -7.473 321 HZ2 LYS 37 HZ2 LYS 37 8.414 -4.821 -8.284 322 HZ3 LYS 37 HZ3 LYS 37 8.439 -5.146 -6.625 323 H GLY 38 HN GLY 38 3.535 -4.210 -7.900 324 HA2 GLY 38 HA2 GLY 38 3.770 -6.458 -8.521 325 HA3 GLY 38 HA1 GLY 38 3.988 -6.879 -6.834 326 H VAL 39 HN VAL 39 1.347 -5.038 -6.621 327 HA VAL 39 HA VAL 39 -0.405 -7.352 -7.123 328 HB VAL 39 HB VAL 39 -0.930 -5.146 -5.135 329 HG11 VAL 39 HG11 VAL 39 -2.571 -6.788 -4.229 330 HG12 VAL 39 HG12 VAL 39 -2.252 -7.810 -5.630 331 HG13 VAL 39 HG13 VAL 39 -2.957 -6.208 -5.850 332 HG21 VAL 39 HG21 VAL 39 1.108 -6.654 -4.697 333 HG22 VAL 39 HG22 VAL 39 -0.075 -7.927 -4.404 334 HG23 VAL 39 HG23 VAL 39 -0.083 -6.470 -3.409 335 H TYR 40 HN TYR 40 -0.317 -3.779 -7.283 336 HA TYR 40 HA TYR 40 -2.663 -4.016 -9.019 337 HB2 TYR 40 HB2 TYR 40 -2.095 -2.235 -6.838 338 HB3 TYR 40 HB1 TYR 40 -2.245 -1.275 -8.301 339 HD1 TYR 40 HD1 TYR 40 -3.995 -3.341 -5.864 340 HD2 TYR 40 HD2 TYR 40 -4.376 -1.141 -9.480 341 HE1 TYR 40 HE1 TYR 40 -6.435 -3.319 -5.587 342 HE2 TYR 40 HE2 TYR 40 -6.821 -1.118 -9.216 343 HH TYR 40 HH TYR 40 -8.562 -2.307 -8.085 344 H ALA 41 HN ALA 41 -2.699 -3.090 -11.027 345 HA ALA 41 HA ALA 41 -0.125 -2.063 -12.006 346 HB1 ALA 41 HB1 ALA 41 -0.666 -2.861 -14.129 347 HB2 ALA 41 HB2 ALA 41 -2.396 -2.883 -13.786 348 HB3 ALA 41 HB3 ALA 41 -1.338 -4.097 -13.065 349 H LEU 42 HN LEU 42 0.029 0.073 -12.477 350 HA LEU 42 HA LEU 42 -2.432 1.633 -12.396 351 HB2 LEU 42 HB2 LEU 42 -0.684 2.343 -10.885 352 HB3 LEU 42 HB1 LEU 42 0.458 2.476 -12.208 353 HG LEU 42 HG LEU 42 -0.862 4.340 -13.148 354 HD11 LEU 42 HD11 LEU 42 -2.509 5.367 -11.404 355 HD12 LEU 42 HD12 LEU 42 -2.631 3.704 -10.832 356 HD13 LEU 42 HD13 LEU 42 -3.054 4.097 -12.499 357 HD21 LEU 42 HD21 LEU 42 0.300 5.802 -11.922 358 HD22 LEU 42 HD22 LEU 42 0.873 4.391 -11.032 359 HD23 LEU 42 HD23 LEU 42 -0.499 5.320 -10.425 360 H LYS 43 HN LYS 43 -3.292 2.640 -14.019 361 HA LYS 43 HA LYS 43 -1.788 3.029 -16.509 362 HB2 LYS 43 HB2 LYS 43 -4.250 1.518 -16.064 363 HB3 LYS 43 HB1 LYS 43 -4.468 2.809 -17.236 364 HG2 LYS 43 HG2 LYS 43 -3.906 0.871 -18.452 365 HG3 LYS 43 HG1 LYS 43 -2.477 1.902 -18.459 366 HD2 LYS 43 HD2 LYS 43 -1.447 0.568 -16.738 367 HD3 LYS 43 HD1 LYS 43 -2.915 -0.397 -16.556 368 HE2 LYS 43 HE2 LYS 43 -2.672 -1.201 -18.849 369 HE3 LYS 43 HE1 LYS 43 -1.212 -0.232 -19.038 370 HZ1 LYS 43 HZ1 LYS 43 -1.622 -2.605 -17.320 371 HZ2 LYS 43 HZ2 LYS 43 -0.324 -1.546 -17.082 372 HZ3 LYS 43 HZ3 LYS 43 -0.477 -2.382 -18.545 373 H VAL 44 HN VAL 44 -1.939 5.022 -17.321 374 HA VAL 44 HA VAL 44 -3.850 6.905 -16.063 375 HB VAL 44 HB VAL 44 -0.991 7.396 -16.902 376 HG11 VAL 44 HG11 VAL 44 -2.106 9.402 -17.409 377 HG12 VAL 44 HG12 VAL 44 -1.445 9.663 -15.796 378 HG13 VAL 44 HG13 VAL 44 -3.153 9.275 -15.996 379 HG21 VAL 44 HG21 VAL 44 -0.370 7.217 -14.756 380 HG22 VAL 44 HG22 VAL 44 -1.865 6.296 -14.580 381 HG23 VAL 44 HG23 VAL 44 -1.831 8.010 -14.165 382 H ILE 45 HN ILE 45 -5.111 8.006 -17.304 383 HA ILE 45 HA ILE 45 -4.725 7.822 -20.217 384 HB ILE 45 HB ILE 45 -7.267 8.233 -18.640 385 HG12 ILE 45 HG12 ILE 45 -6.372 6.030 -18.155 386 HG13 ILE 45 HG11 ILE 45 -7.810 5.884 -19.155 387 HG21 ILE 45 HG21 ILE 45 -8.462 7.775 -20.691 388 HG22 ILE 45 HG22 ILE 45 -6.943 7.473 -21.544 389 HG23 ILE 45 HG23 ILE 45 -7.318 9.095 -20.962 390 HD11 ILE 45 HD11 ILE 45 -6.457 5.421 -21.089 391 HD12 ILE 45 HD12 ILE 45 -6.018 4.329 -19.773 392 HD13 ILE 45 HD13 ILE 45 -4.983 5.703 -20.162 393 H ASP 46 HN ASP 46 -4.047 9.769 -21.035 394 HA ASP 46 HA ASP 46 -4.593 12.227 -19.594 395 HB2 ASP 46 HB2 ASP 46 -2.388 11.766 -20.696 396 HB3 ASP 46 HB1 ASP 46 -3.197 11.863 -22.255 397 H VAL 47 HN VAL 47 -6.686 12.847 -19.797 398 HA VAL 47 HA VAL 47 -8.288 12.335 -22.062 399 HB VAL 47 HB VAL 47 -9.982 13.728 -21.026 400 HG11 VAL 47 HG11 VAL 47 -8.572 11.572 -19.682 401 HG12 VAL 47 HG12 VAL 47 -10.305 11.838 -19.886 402 HG13 VAL 47 HG13 VAL 47 -9.446 12.608 -18.552 403 HG21 VAL 47 HG21 VAL 47 -9.603 15.003 -19.030 404 HG22 VAL 47 HG22 VAL 47 -8.448 15.533 -20.251 405 HG23 VAL 47 HG23 VAL 47 -7.925 14.466 -18.947 406 H LEU 48 HN LEU 48 -6.368 15.198 -21.218 407 HA LEU 48 HA LEU 48 -7.548 16.842 -23.228 408 HB2 LEU 48 HB2 LEU 48 -4.959 17.111 -21.721 409 HB3 LEU 48 HB1 LEU 48 -5.485 18.273 -22.924 410 HG LEU 48 HG LEU 48 -6.996 17.589 -20.400 411 HD11 LEU 48 HD11 LEU 48 -4.965 18.769 -19.863 412 HD12 LEU 48 HD12 LEU 48 -6.339 19.861 -19.693 413 HD13 LEU 48 HD13 LEU 48 -5.296 19.974 -21.109 414 HD21 LEU 48 HD21 LEU 48 -8.049 19.897 -21.185 415 HD22 LEU 48 HD22 LEU 48 -8.679 18.344 -21.733 416 HD23 LEU 48 HD23 LEU 48 -7.594 19.270 -22.770 417 H LYS 49 HN LYS 49 -4.781 14.685 -23.182 418 HA LYS 49 HA LYS 49 -3.730 15.490 -25.702 419 HB2 LYS 49 HB2 LYS 49 -2.383 14.320 -24.007 420 HB3 LYS 49 HB1 LYS 49 -3.374 12.883 -24.221 421 HG2 LYS 49 HG2 LYS 49 -2.617 12.676 -26.519 422 HG3 LYS 49 HG1 LYS 49 -1.659 14.151 -26.348 423 HD2 LYS 49 HD2 LYS 49 -0.336 13.090 -24.596 424 HD3 LYS 49 HD1 LYS 49 -1.294 11.616 -24.757 425 HE2 LYS 49 HE2 LYS 49 -0.543 11.381 -27.073 426 HE3 LYS 49 HE1 LYS 49 0.407 12.857 -26.918 427 HZ1 LYS 49 HZ1 LYS 49 1.625 11.713 -25.077 428 HZ2 LYS 49 HZ2 LYS 49 1.872 11.047 -26.611 429 HZ3 LYS 49 HZ3 LYS 49 0.837 10.281 -25.516 430 H ASN 50 HN ASN 50 -5.962 12.949 -24.668 431 HA ASN 50 HA ASN 50 -6.707 12.600 -27.497 432 HB2 ASN 50 HB2 ASN 50 -5.341 10.662 -26.494 433 HB3 ASN 50 HB1 ASN 50 -6.762 10.354 -25.496 434 HD21 ASN 50 HD21 ASN 50 -5.249 9.322 -28.142 435 HD22 ASN 50 HD22 ASN 50 -6.586 8.748 -29.071 436 HA PRO 51 HA PRO 51 -10.360 13.951 -25.118 437 HB2 PRO 51 HB2 PRO 51 -11.112 14.779 -27.873 438 HB3 PRO 51 HB1 PRO 51 -11.158 15.709 -26.370 439 HG2 PRO 51 HG2 PRO 51 -9.269 16.199 -28.171 440 HG3 PRO 51 HG1 PRO 51 -8.866 16.176 -26.443 441 HD2 PRO 51 HD2 PRO 51 -8.444 14.043 -28.509 442 HD3 PRO 51 HD1 PRO 51 -7.318 14.650 -27.271 443 H GLN 52 HN GLN 52 -10.047 12.088 -28.060 444 HA GLN 52 HA GLN 52 -12.703 11.172 -28.295 445 HB2 GLN 52 HB2 GLN 52 -10.079 9.964 -29.178 446 HB3 GLN 52 HB1 GLN 52 -11.644 9.273 -29.586 447 HG2 GLN 52 HG2 GLN 52 -11.351 10.501 -31.452 448 HG3 GLN 52 HG1 GLN 52 -12.056 11.766 -30.447 449 HE21 GLN 52 HE21 GLN 52 -10.349 12.121 -32.707 450 HE22 GLN 52 HE22 GLN 52 -8.924 12.925 -32.154 451 H LEU 53 HN LEU 53 -9.903 9.905 -26.539 452 HA LEU 53 HA LEU 53 -11.279 7.542 -25.746 453 HB2 LEU 53 HB2 LEU 53 -8.770 8.824 -24.663 454 HB3 LEU 53 HB1 LEU 53 -9.407 7.303 -24.065 455 HG LEU 53 HG LEU 53 -8.541 7.809 -26.911 456 HD11 LEU 53 HD11 LEU 53 -6.745 7.783 -25.094 457 HD12 LEU 53 HD12 LEU 53 -6.546 6.680 -26.455 458 HD13 LEU 53 HD13 LEU 53 -7.136 6.074 -24.906 459 HD21 LEU 53 HD21 LEU 53 -9.982 6.085 -27.197 460 HD22 LEU 53 HD22 LEU 53 -9.843 5.538 -25.526 461 HD23 LEU 53 HD23 LEU 53 -8.571 5.156 -26.687 462 H ALA 54 HN ALA 54 -10.818 10.744 -24.384 463 HA ALA 54 HA ALA 54 -11.842 10.228 -21.805 464 HB1 ALA 54 HB1 ALA 54 -11.907 12.553 -21.511 465 HB2 ALA 54 HB2 ALA 54 -12.098 12.851 -23.240 466 HB3 ALA 54 HB3 ALA 54 -10.554 12.278 -22.610 467 H GLU 55 HN GLU 55 -13.298 11.260 -24.839 468 HA GLU 55 HA GLU 55 -15.951 11.586 -23.852 469 HB2 GLU 55 HB2 GLU 55 -15.151 12.606 -25.966 470 HB3 GLU 55 HB1 GLU 55 -15.033 11.002 -26.676 471 HG2 GLU 55 HG2 GLU 55 -17.433 10.698 -26.439 472 HG3 GLU 55 HG1 GLU 55 -17.572 12.278 -25.669 473 H GLU 56 HN GLU 56 -14.192 8.878 -25.264 474 HA GLU 56 HA GLU 56 -16.366 7.136 -25.597 475 HB2 GLU 56 HB2 GLU 56 -13.444 6.579 -25.054 476 HB3 GLU 56 HB1 GLU 56 -14.613 5.318 -25.417 477 HG2 GLU 56 HG2 GLU 56 -13.860 7.613 -27.227 478 HG3 GLU 56 HG1 GLU 56 -13.338 5.934 -27.391 479 H ASP 57 HN ASP 57 -14.256 7.690 -22.767 480 HA ASP 57 HA ASP 57 -16.010 5.903 -21.250 481 HB2 ASP 57 HB2 ASP 57 -13.378 5.848 -21.152 482 HB3 ASP 57 HB1 ASP 57 -13.570 7.216 -20.061 483 H LYS 58 HN LYS 58 -16.430 8.787 -22.172 484 HA LYS 58 HA LYS 58 -17.410 10.701 -21.453 485 HB2 LYS 58 HB2 LYS 58 -18.732 8.528 -19.891 486 HB3 LYS 58 HB1 LYS 58 -19.173 10.202 -19.576 487 HG2 LYS 58 HG2 LYS 58 -20.713 9.740 -21.175 488 HG3 LYS 58 HG1 LYS 58 -19.387 10.236 -22.231 489 HD2 LYS 58 HD2 LYS 58 -18.766 7.937 -22.608 490 HD3 LYS 58 HD1 LYS 58 -19.963 7.382 -21.434 491 HE2 LYS 58 HE2 LYS 58 -21.755 8.264 -22.847 492 HE3 LYS 58 HE1 LYS 58 -20.560 8.824 -24.016 493 HZ1 LYS 58 HZ1 LYS 58 -19.857 6.321 -23.950 494 HZ2 LYS 58 HZ2 LYS 58 -21.146 6.829 -24.921 495 HZ3 LYS 58 HZ3 LYS 58 -21.451 6.093 -23.430 496 H ILE 59 HN ILE 59 -14.986 10.881 -20.486 497 HA ILE 59 HA ILE 59 -15.065 11.280 -17.600 498 HB ILE 59 HB ILE 59 -12.817 11.794 -19.557 499 HG12 ILE 59 HG12 ILE 59 -13.442 9.434 -19.526 500 HG13 ILE 59 HG11 ILE 59 -11.883 9.664 -18.745 501 HG21 ILE 59 HG21 ILE 59 -12.830 11.650 -16.541 502 HG22 ILE 59 HG22 ILE 59 -12.527 13.079 -17.532 503 HG23 ILE 59 HG23 ILE 59 -11.380 11.738 -17.543 504 HD11 ILE 59 HD11 ILE 59 -14.489 8.856 -17.586 505 HD12 ILE 59 HD12 ILE 59 -13.369 9.774 -16.578 506 HD13 ILE 59 HD13 ILE 59 -12.867 8.235 -17.279 507 H LEU 60 HN LEU 60 -16.059 13.088 -16.932 508 HA LEU 60 HA LEU 60 -15.656 15.563 -18.469 509 HB2 LEU 60 HB2 LEU 60 -17.790 14.887 -16.444 510 HB3 LEU 60 HB1 LEU 60 -17.661 16.401 -17.314 511 HG LEU 60 HG LEU 60 -18.172 13.707 -18.580 512 HD11 LEU 60 HD11 LEU 60 -20.074 14.473 -17.268 513 HD12 LEU 60 HD12 LEU 60 -20.421 14.572 -18.993 514 HD13 LEU 60 HD13 LEU 60 -20.026 16.034 -18.090 515 HD21 LEU 60 HD21 LEU 60 -17.831 16.469 -19.693 516 HD22 LEU 60 HD22 LEU 60 -18.797 15.257 -20.535 517 HD23 LEU 60 HD23 LEU 60 -17.089 14.957 -20.218 518 H ALA 61 HN ALA 61 -14.592 14.056 -15.662 519 HA ALA 61 HA ALA 61 -13.642 16.627 -14.623 520 HB1 ALA 61 HB1 ALA 61 -14.486 14.629 -12.594 521 HB2 ALA 61 HB2 ALA 61 -15.749 15.553 -13.411 522 HB3 ALA 61 HB3 ALA 61 -14.481 16.392 -12.517 523 H THR 62 HN THR 62 -11.607 16.574 -13.782 524 HA THR 62 HA THR 62 -10.264 13.996 -13.463 525 HB THR 62 HB THR 62 -8.230 14.957 -14.532 526 HG1 THR 62 HG1 THR 62 -9.257 17.209 -14.249 527 HG21 THR 62 HG21 THR 62 -8.954 14.764 -16.854 528 HG22 THR 62 HG22 THR 62 -10.639 14.942 -16.354 529 HG23 THR 62 HG23 THR 62 -9.719 13.522 -15.857 530 HA PRO 63 HA PRO 63 -8.173 13.418 -13.003 531 HB2 PRO 63 HB2 PRO 63 -7.211 12.203 -10.798 532 HB3 PRO 63 HB1 PRO 63 -6.294 13.414 -11.699 533 HG2 PRO 63 HG2 PRO 63 -7.829 13.701 -9.157 534 HG3 PRO 63 HG1 PRO 63 -6.267 14.405 -9.622 535 HD2 PRO 63 HD2 PRO 63 -8.645 15.774 -9.688 536 HD3 PRO 63 HD1 PRO 63 -7.248 16.160 -10.712 537 H THR 64 HN THR 64 -9.003 11.359 -13.043 538 HA THR 64 HA THR 64 -11.336 10.851 -11.303 539 HB THR 64 HB THR 64 -11.238 9.314 -13.802 540 HG1 THR 64 HG1 THR 64 -11.882 12.077 -14.031 541 HG21 THR 64 HG21 THR 64 -13.259 10.767 -12.160 542 HG22 THR 64 HG22 THR 64 -13.252 9.091 -12.717 543 HG23 THR 64 HG23 THR 64 -13.639 10.395 -13.841 544 H LEU 65 HN LEU 65 -11.130 9.125 -10.024 545 HA LEU 65 HA LEU 65 -8.970 7.201 -10.576 546 HB2 LEU 65 HB2 LEU 65 -9.077 8.479 -8.383 547 HB3 LEU 65 HB1 LEU 65 -10.541 7.585 -8.026 548 HG LEU 65 HG LEU 65 -9.168 5.469 -8.247 549 HD11 LEU 65 HD11 LEU 65 -6.918 7.472 -8.194 550 HD12 LEU 65 HD12 LEU 65 -7.304 6.352 -9.499 551 HD13 LEU 65 HD13 LEU 65 -6.736 5.736 -7.948 552 HD21 LEU 65 HD21 LEU 65 -9.039 5.502 -6.025 553 HD22 LEU 65 HD22 LEU 65 -9.558 7.186 -6.105 554 HD23 LEU 65 HD23 LEU 65 -7.840 6.795 -6.042 555 H ALA 66 HN ALA 66 -9.638 5.359 -11.565 556 HA ALA 66 HA ALA 66 -12.103 4.110 -10.580 557 HB1 ALA 66 HB1 ALA 66 -11.712 4.128 -13.533 558 HB2 ALA 66 HB2 ALA 66 -12.406 5.557 -12.765 559 HB3 ALA 66 HB3 ALA 66 -13.197 3.989 -12.590 560 H LYS 67 HN LYS 67 -12.126 2.008 -10.518 561 HA LYS 67 HA LYS 67 -9.703 0.590 -11.334 562 HB2 LYS 67 HB2 LYS 67 -10.110 0.130 -9.066 563 HB3 LYS 67 HB1 LYS 67 -11.849 0.121 -9.285 564 HG2 LYS 67 HG2 LYS 67 -11.677 -2.049 -10.437 565 HG3 LYS 67 HG1 LYS 67 -9.933 -2.037 -10.165 566 HD2 LYS 67 HD2 LYS 67 -10.410 -3.149 -8.275 567 HD3 LYS 67 HD1 LYS 67 -10.905 -1.577 -7.649 568 HE2 LYS 67 HE2 LYS 67 -12.828 -2.672 -7.199 569 HE3 LYS 67 HE1 LYS 67 -13.177 -2.321 -8.890 570 HZ1 LYS 67 HZ1 LYS 67 -11.759 -4.797 -8.182 571 HZ2 LYS 67 HZ2 LYS 67 -12.737 -4.473 -9.529 572 HZ3 LYS 67 HZ3 LYS 67 -13.439 -4.713 -8.006 573 H VAL 68 HN VAL 68 -9.954 -0.080 -13.411 574 HA VAL 68 HA VAL 68 -12.559 -0.788 -14.414 575 HB VAL 68 HB VAL 68 -11.407 -1.225 -16.546 576 HG11 VAL 68 HG11 VAL 68 -12.131 1.086 -15.667 577 HG12 VAL 68 HG12 VAL 68 -11.086 1.010 -17.085 578 HG13 VAL 68 HG13 VAL 68 -10.404 1.394 -15.505 579 HG21 VAL 68 HG21 VAL 68 -9.182 -1.414 -16.790 580 HG22 VAL 68 HG22 VAL 68 -9.177 -1.698 -15.049 581 HG23 VAL 68 HG23 VAL 68 -8.854 -0.083 -15.680 582 H LEU 69 HN LEU 69 -9.753 -2.436 -13.193 583 HA LEU 69 HA LEU 69 -11.209 -4.973 -13.520 584 HB2 LEU 69 HB2 LEU 69 -8.293 -4.561 -14.195 585 HB3 LEU 69 HB1 LEU 69 -9.069 -6.126 -14.072 586 HG LEU 69 HG LEU 69 -9.868 -4.000 -16.063 587 HD11 LEU 69 HD11 LEU 69 -7.776 -6.078 -16.119 588 HD12 LEU 69 HD12 LEU 69 -7.894 -4.557 -17.005 589 HD13 LEU 69 HD13 LEU 69 -8.802 -5.967 -17.550 590 HD21 LEU 69 HD21 LEU 69 -10.648 -6.885 -15.690 591 HD22 LEU 69 HD22 LEU 69 -10.964 -5.971 -17.165 592 HD23 LEU 69 HD23 LEU 69 -11.694 -5.465 -15.642 593 HA PRO 70 HA PRO 70 -11.023 -7.012 -12.951 594 HB2 PRO 70 HB2 PRO 70 -12.169 -8.533 -11.065 595 HB3 PRO 70 HB1 PRO 70 -10.448 -8.683 -11.446 596 HG2 PRO 70 HG2 PRO 70 -11.764 -7.200 -9.195 597 HG3 PRO 70 HG1 PRO 70 -10.349 -8.269 -9.150 598 HD2 PRO 70 HD2 PRO 70 -10.164 -5.549 -9.220 599 HD3 PRO 70 HD1 PRO 70 -8.928 -6.626 -9.901 600 HA PRO 71 HA PRO 71 -15.046 -5.120 -13.111 601 HB2 PRO 71 HB2 PRO 71 -16.107 -7.832 -13.704 602 HB3 PRO 71 HB1 PRO 71 -16.259 -6.338 -14.638 603 HG2 PRO 71 HG2 PRO 71 -14.616 -8.248 -15.456 604 HG3 PRO 71 HG1 PRO 71 -14.128 -6.545 -15.558 605 HD2 PRO 71 HD2 PRO 71 -13.351 -8.619 -13.533 606 HD3 PRO 71 HD1 PRO 71 -12.341 -7.408 -14.348 607 HA PRO 72 HA PRO 72 -17.274 -4.695 -13.080 608 HB2 PRO 72 HB2 PRO 72 -18.776 -3.111 -11.528 609 HB3 PRO 72 HB1 PRO 72 -19.325 -4.723 -12.011 610 HG2 PRO 72 HG2 PRO 72 -18.065 -3.848 -9.433 611 HG3 PRO 72 HG1 PRO 72 -19.484 -4.883 -9.685 612 HD2 PRO 72 HD2 PRO 72 -16.997 -5.866 -9.163 613 HD3 PRO 72 HD1 PRO 72 -18.201 -6.742 -10.126 614 H VAL 73 HN VAL 73 -17.128 -2.336 -13.379 615 HA VAL 73 HA VAL 73 -14.592 -1.346 -12.515 616 HB VAL 73 HB VAL 73 -16.802 0.043 -14.051 617 HG11 VAL 73 HG11 VAL 73 -15.495 1.797 -13.267 618 HG12 VAL 73 HG12 VAL 73 -14.787 1.449 -14.846 619 HG13 VAL 73 HG13 VAL 73 -14.000 0.864 -13.378 620 HG21 VAL 73 HG21 VAL 73 -14.668 -0.471 -15.752 621 HG22 VAL 73 HG22 VAL 73 -16.211 -1.323 -15.709 622 HG23 VAL 73 HG23 VAL 73 -14.835 -1.946 -14.798 623 H ARG 74 HN ARG 74 -14.126 -0.121 -10.817 624 HA ARG 74 HA ARG 74 -16.341 1.092 -9.292 625 HB2 ARG 74 HB2 ARG 74 -15.283 -0.575 -7.962 626 HB3 ARG 74 HB1 ARG 74 -13.681 -0.026 -8.426 627 HG2 ARG 74 HG2 ARG 74 -14.140 0.610 -6.152 628 HG3 ARG 74 HG1 ARG 74 -14.046 2.053 -7.163 629 HD2 ARG 74 HD2 ARG 74 -15.906 2.262 -5.638 630 HD3 ARG 74 HD1 ARG 74 -16.517 2.084 -7.283 631 HE ARG 74 HE ARG 74 -16.373 -0.437 -6.009 632 HH11 ARG 74 HH11 ARG 74 -18.223 2.511 -6.034 633 HH12 ARG 74 HH12 ARG 74 -19.688 1.755 -5.504 634 HH21 ARG 74 HH21 ARG 74 -18.292 -1.452 -5.311 635 HH22 ARG 74 HH22 ARG 74 -19.726 -0.507 -5.092 636 H ARG 75 HN ARG 75 -16.485 3.218 -9.406 637 HA ARG 75 HA ARG 75 -14.067 4.737 -10.065 638 HB2 ARG 75 HB2 ARG 75 -16.986 5.399 -10.358 639 HB3 ARG 75 HB1 ARG 75 -15.720 6.611 -10.496 640 HG2 ARG 75 HG2 ARG 75 -14.719 5.333 -12.336 641 HG3 ARG 75 HG1 ARG 75 -16.047 4.173 -12.230 642 HD2 ARG 75 HD2 ARG 75 -16.419 7.118 -12.713 643 HD3 ARG 75 HD1 ARG 75 -16.285 5.931 -14.006 644 HE ARG 75 HE ARG 75 -18.344 4.950 -13.234 645 HH11 ARG 75 HH11 ARG 75 -17.556 8.059 -11.859 646 HH12 ARG 75 HH12 ARG 75 -19.187 8.413 -11.398 647 HH21 ARG 75 HH21 ARG 75 -20.492 5.406 -12.630 648 HH22 ARG 75 HH22 ARG 75 -20.858 6.902 -11.836 649 H ILE 76 HN ILE 76 -13.089 5.786 -8.542 650 HA ILE 76 HA ILE 76 -14.516 6.411 -6.048 651 HB ILE 76 HB ILE 76 -11.544 6.243 -6.541 652 HG12 ILE 76 HG12 ILE 76 -13.393 4.309 -5.121 653 HG13 ILE 76 HG11 ILE 76 -12.725 4.070 -6.734 654 HG21 ILE 76 HG21 ILE 76 -13.179 6.722 -4.058 655 HG22 ILE 76 HG22 ILE 76 -11.900 7.731 -4.736 656 HG23 ILE 76 HG23 ILE 76 -11.502 6.176 -4.005 657 HD11 ILE 76 HD11 ILE 76 -10.899 4.536 -4.443 658 HD12 ILE 76 HD12 ILE 76 -10.621 3.664 -5.950 659 HD13 ILE 76 HD13 ILE 76 -11.622 2.946 -4.686 660 H ILE 77 HN ILE 77 -15.118 8.507 -5.837 661 HA ILE 77 HA ILE 77 -13.514 10.544 -7.232 662 HB ILE 77 HB ILE 77 -16.423 10.798 -6.496 663 HG12 ILE 77 HG12 ILE 77 -16.208 10.728 -9.276 664 HG13 ILE 77 HG11 ILE 77 -15.151 9.432 -8.725 665 HG21 ILE 77 HG21 ILE 77 -16.446 12.804 -7.682 666 HG22 ILE 77 HG22 ILE 77 -14.946 12.428 -8.531 667 HG23 ILE 77 HG23 ILE 77 -14.908 12.857 -6.820 668 HD11 ILE 77 HD11 ILE 77 -17.448 8.690 -9.198 669 HD12 ILE 77 HD12 ILE 77 -18.031 9.755 -7.918 670 HD13 ILE 77 HD13 ILE 77 -16.964 8.407 -7.527 671 H GLY 78 HN GLY 78 -12.492 11.983 -6.008 672 HA2 GLY 78 HA2 GLY 78 -13.484 13.363 -3.830 673 HA3 GLY 78 HA1 GLY 78 -12.687 11.942 -3.170 674 H ASP 79 HN ASP 79 -11.385 13.800 -2.189 675 HA ASP 79 HA ASP 79 -9.507 15.085 -3.967 676 HB2 ASP 79 HB2 ASP 79 -9.560 14.981 -0.939 677 HB3 ASP 79 HB1 ASP 79 -8.505 16.006 -1.906 678 H LEU 80 HN LEU 80 -7.996 13.846 -4.878 679 HA LEU 80 HA LEU 80 -6.913 11.568 -3.436 680 HB2 LEU 80 HB2 LEU 80 -6.364 12.557 -6.240 681 HB3 LEU 80 HB1 LEU 80 -5.765 11.057 -5.560 682 HG LEU 80 HG LEU 80 -8.673 11.718 -6.035 683 HD11 LEU 80 HD11 LEU 80 -7.434 9.495 -7.475 684 HD12 LEU 80 HD12 LEU 80 -6.798 11.080 -7.913 685 HD13 LEU 80 HD13 LEU 80 -8.527 10.754 -8.050 686 HD21 LEU 80 HD21 LEU 80 -8.500 10.233 -4.173 687 HD22 LEU 80 HD22 LEU 80 -7.301 9.242 -5.002 688 HD23 LEU 80 HD23 LEU 80 -8.966 9.275 -5.578 689 H SER 81 HN SER 81 -6.188 14.761 -3.493 690 HA SER 81 HA SER 81 -3.375 14.743 -3.828 691 HB2 SER 81 HB2 SER 81 -3.456 16.972 -2.756 692 HB3 SER 81 HB1 SER 81 -4.672 16.807 -4.021 693 HG SER 81 HG SER 81 -5.031 17.427 -1.462 694 H ASN 82 HN ASN 82 -5.401 13.722 -1.291 695 HA ASN 82 HA ASN 82 -3.290 13.833 0.715 696 HB2 ASN 82 HB2 ASN 82 -5.592 14.427 1.377 697 HB3 ASN 82 HB1 ASN 82 -6.122 12.817 0.920 698 HD21 ASN 82 HD21 ASN 82 -6.858 13.173 3.268 699 HD22 ASN 82 HD22 ASN 82 -5.797 12.555 4.482 700 H ARG 83 HN ARG 83 -1.902 12.232 0.905 701 HA ARG 83 HA ARG 83 -1.995 9.915 -0.625 702 HB2 ARG 83 HB2 ARG 83 -0.375 10.604 1.828 703 HB3 ARG 83 HB1 ARG 83 -0.162 9.085 0.969 704 HG2 ARG 83 HG2 ARG 83 1.303 10.118 -0.333 705 HG3 ARG 83 HG1 ARG 83 -0.036 11.052 -1.004 706 HD2 ARG 83 HD2 ARG 83 1.189 11.937 1.565 707 HD3 ARG 83 HD1 ARG 83 2.059 12.240 0.061 708 HE ARG 83 HE ARG 83 -0.445 13.147 -0.457 709 HH11 ARG 83 HH11 ARG 83 1.872 13.773 2.068 710 HH12 ARG 83 HH12 ARG 83 1.343 15.401 2.330 711 HH21 ARG 83 HH21 ARG 83 -1.153 15.278 -0.131 712 HH22 ARG 83 HH22 ARG 83 -0.385 16.260 1.076 713 H GLU 84 HN GLU 84 -3.099 10.458 2.684 714 HA GLU 84 HA GLU 84 -3.501 7.763 3.405 715 HB2 GLU 84 HB2 GLU 84 -4.812 10.310 4.301 716 HB3 GLU 84 HB1 GLU 84 -5.250 8.738 4.963 717 HG2 GLU 84 HG2 GLU 84 -3.068 8.388 5.809 718 HG3 GLU 84 HG1 GLU 84 -2.441 9.797 4.954 719 H LYS 85 HN LYS 85 -5.760 10.024 1.753 720 HA LYS 85 HA LYS 85 -7.860 8.116 1.738 721 HB2 LYS 85 HB2 LYS 85 -7.355 10.534 -0.012 722 HB3 LYS 85 HB1 LYS 85 -8.775 9.513 -0.204 723 HG2 LYS 85 HG2 LYS 85 -9.468 10.043 2.072 724 HG3 LYS 85 HG1 LYS 85 -8.046 11.064 2.275 725 HD2 LYS 85 HD2 LYS 85 -8.817 12.472 0.395 726 HD3 LYS 85 HD1 LYS 85 -10.245 11.451 0.245 727 HE2 LYS 85 HE2 LYS 85 -10.927 12.044 2.517 728 HE3 LYS 85 HE1 LYS 85 -9.495 13.059 2.686 729 HZ1 LYS 85 HZ1 LYS 85 -11.345 13.559 0.461 730 HZ2 LYS 85 HZ2 LYS 85 -10.338 14.641 1.282 731 HZ3 LYS 85 HZ3 LYS 85 -11.763 14.095 2.010 732 H VAL 86 HN VAL 86 -5.302 8.840 -0.566 733 HA VAL 86 HA VAL 86 -6.145 7.039 -2.561 734 HB VAL 86 HB VAL 86 -3.380 8.093 -1.900 735 HG11 VAL 86 HG11 VAL 86 -3.172 7.375 -4.467 736 HG12 VAL 86 HG12 VAL 86 -4.277 6.116 -3.912 737 HG13 VAL 86 HG13 VAL 86 -2.706 6.315 -3.136 738 HG21 VAL 86 HG21 VAL 86 -4.296 9.938 -2.778 739 HG22 VAL 86 HG22 VAL 86 -5.691 9.058 -3.403 740 HG23 VAL 86 HG23 VAL 86 -4.188 9.094 -4.324 741 H LEU 87 HN LEU 87 -3.994 6.624 0.231 742 HA LEU 87 HA LEU 87 -3.333 3.905 -0.316 743 HB2 LEU 87 HB2 LEU 87 -2.688 5.888 1.632 744 HB3 LEU 87 HB1 LEU 87 -3.201 4.443 2.479 745 HG LEU 87 HG LEU 87 -1.014 4.502 0.405 746 HD11 LEU 87 HD11 LEU 87 -0.150 3.962 3.091 747 HD12 LEU 87 HD12 LEU 87 -0.976 5.522 3.019 748 HD13 LEU 87 HD13 LEU 87 0.404 5.203 1.966 749 HD21 LEU 87 HD21 LEU 87 -1.175 2.360 2.418 750 HD22 LEU 87 HD22 LEU 87 -0.793 2.275 0.699 751 HD23 LEU 87 HD23 LEU 87 -2.475 2.363 1.226 752 H ILE 88 HN ILE 88 -5.690 5.383 1.897 753 HA ILE 88 HA ILE 88 -6.594 2.979 3.029 754 HB ILE 88 HB ILE 88 -7.905 5.669 2.743 755 HG12 ILE 88 HG12 ILE 88 -6.885 4.233 5.195 756 HG13 ILE 88 HG11 ILE 88 -5.866 5.271 4.208 757 HG21 ILE 88 HG21 ILE 88 -9.771 4.238 2.875 758 HG22 ILE 88 HG22 ILE 88 -9.496 4.793 4.527 759 HG23 ILE 88 HG23 ILE 88 -8.978 3.178 4.040 760 HD11 ILE 88 HD11 ILE 88 -7.809 5.954 6.234 761 HD12 ILE 88 HD12 ILE 88 -8.065 6.838 4.730 762 HD13 ILE 88 HD13 ILE 88 -6.500 6.916 5.543 763 H ALA 89 HN ALA 89 -7.835 4.812 0.231 764 HA ALA 89 HA ALA 89 -9.987 3.067 -0.315 765 HB1 ALA 89 HB1 ALA 89 -8.700 4.448 -2.596 766 HB2 ALA 89 HB2 ALA 89 -9.294 5.463 -1.279 767 HB3 ALA 89 HB3 ALA 89 -10.399 4.377 -2.124 768 H LEU 90 HN LEU 90 -6.619 3.065 -1.434 769 HA LEU 90 HA LEU 90 -6.947 0.928 -3.275 770 HB2 LEU 90 HB2 LEU 90 -4.504 2.023 -1.890 771 HB3 LEU 90 HB1 LEU 90 -4.424 0.709 -3.044 772 HG LEU 90 HG LEU 90 -5.494 3.457 -3.675 773 HD11 LEU 90 HD11 LEU 90 -2.781 2.425 -3.506 774 HD12 LEU 90 HD12 LEU 90 -3.357 4.084 -3.672 775 HD13 LEU 90 HD13 LEU 90 -3.169 3.068 -5.102 776 HD21 LEU 90 HD21 LEU 90 -4.856 2.432 -6.038 777 HD22 LEU 90 HD22 LEU 90 -6.438 2.171 -5.305 778 HD23 LEU 90 HD23 LEU 90 -5.199 0.921 -5.196 779 H ARG 91 HN ARG 91 -6.108 1.022 0.175 780 HA ARG 91 HA ARG 91 -5.405 -1.729 0.394 781 HB2 ARG 91 HB2 ARG 91 -6.299 0.303 2.430 782 HB3 ARG 91 HB1 ARG 91 -5.858 -1.348 2.850 783 HG2 ARG 91 HG2 ARG 91 -3.622 -1.001 1.979 784 HG3 ARG 91 HG1 ARG 91 -4.054 0.637 1.480 785 HD2 ARG 91 HD2 ARG 91 -2.831 0.714 3.568 786 HD3 ARG 91 HD1 ARG 91 -4.501 1.211 3.836 787 HE ARG 91 HE ARG 91 -4.825 -0.650 5.149 788 HH11 ARG 91 HH11 ARG 91 -1.774 -0.914 3.481 789 HH12 ARG 91 HH12 ARG 91 -1.245 -2.287 4.393 790 HH21 ARG 91 HH21 ARG 91 -4.140 -2.457 6.356 791 HH22 ARG 91 HH22 ARG 91 -2.594 -3.167 6.031 792 H LEU 92 HN LEU 92 -8.470 0.016 0.888 793 HA LEU 92 HA LEU 92 -9.924 -2.234 1.764 794 HB2 LEU 92 HB2 LEU 92 -10.557 0.486 0.849 795 HB3 LEU 92 HB1 LEU 92 -11.824 -0.687 0.547 796 HG LEU 92 HG LEU 92 -12.132 -1.124 2.843 797 HD11 LEU 92 HD11 LEU 92 -10.560 0.099 4.515 798 HD12 LEU 92 HD12 LEU 92 -9.426 0.096 3.164 799 HD13 LEU 92 HD13 LEU 92 -10.055 -1.430 3.790 800 HD21 LEU 92 HD21 LEU 92 -11.508 1.817 2.780 801 HD22 LEU 92 HD22 LEU 92 -12.735 0.983 3.733 802 HD23 LEU 92 HD23 LEU 92 -12.916 1.112 1.984 803 H LEU 93 HN LEU 93 -9.248 -0.993 -1.451 804 HA LEU 93 HA LEU 93 -11.025 -2.686 -2.863 805 HB2 LEU 93 HB2 LEU 93 -8.448 -1.354 -3.696 806 HB3 LEU 93 HB1 LEU 93 -9.453 -2.271 -4.801 807 HG LEU 93 HG LEU 93 -10.392 0.175 -3.299 808 HD11 LEU 93 HD11 LEU 93 -10.308 1.005 -5.821 809 HD12 LEU 93 HD12 LEU 93 -8.982 -0.157 -5.886 810 HD13 LEU 93 HD13 LEU 93 -8.934 1.173 -4.727 811 HD21 LEU 93 HD21 LEU 93 -11.764 -1.852 -4.757 812 HD22 LEU 93 HD22 LEU 93 -11.844 -0.349 -5.675 813 HD23 LEU 93 HD23 LEU 93 -12.417 -0.396 -4.008 814 H ALA 94 HN ALA 94 -7.712 -3.053 -1.739 815 HA ALA 94 HA ALA 94 -7.095 -5.423 -3.101 816 HB1 ALA 94 HB1 ALA 94 -5.102 -5.174 -2.116 817 HB2 ALA 94 HB2 ALA 94 -5.814 -5.302 -0.508 818 HB3 ALA 94 HB3 ALA 94 -5.761 -3.739 -1.326 819 H GLU 95 HN GLU 95 -8.668 -4.896 0.028 820 HA GLU 95 HA GLU 95 -8.567 -7.555 0.890 821 HB2 GLU 95 HB2 GLU 95 -10.473 -5.288 1.494 822 HB3 GLU 95 HB1 GLU 95 -10.589 -6.855 2.291 823 HG2 GLU 95 HG2 GLU 95 -8.428 -6.582 3.280 824 HG3 GLU 95 HG1 GLU 95 -8.124 -5.129 2.331 825 H GLU 96 HN GLU 96 -10.840 -5.800 -1.128 826 HA GLU 96 HA GLU 96 -12.809 -7.807 -1.377 827 HB2 GLU 96 HB2 GLU 96 -11.992 -5.516 -3.178 828 HB3 GLU 96 HB1 GLU 96 -13.374 -6.555 -3.515 829 HG2 GLU 96 HG2 GLU 96 -14.486 -5.838 -1.521 830 HG3 GLU 96 HG1 GLU 96 -13.057 -4.960 -0.981 831 H ILE 97 HN ILE 97 -9.900 -7.056 -3.210 832 HA ILE 97 HA ILE 97 -10.254 -8.986 -5.264 833 HB ILE 97 HB ILE 97 -7.742 -7.619 -4.278 834 HG12 ILE 97 HG12 ILE 97 -9.465 -6.968 -6.669 835 HG13 ILE 97 HG11 ILE 97 -9.661 -6.196 -5.096 836 HG21 ILE 97 HG21 ILE 97 -7.330 -9.702 -5.596 837 HG22 ILE 97 HG22 ILE 97 -6.713 -8.236 -6.359 838 HG23 ILE 97 HG23 ILE 97 -8.211 -8.968 -6.936 839 HD11 ILE 97 HD11 ILE 97 -6.956 -6.169 -6.245 840 HD12 ILE 97 HD12 ILE 97 -7.826 -4.940 -5.328 841 HD13 ILE 97 HD13 ILE 97 -8.176 -5.176 -7.039 842 H GLY 98 HN GLY 98 -8.444 -8.946 -2.228 843 HA2 GLY 98 HA2 GLY 98 -7.162 -11.434 -2.451 844 HA3 GLY 98 HA1 GLY 98 -7.519 -10.606 -0.944 845 H ASP 99 HN ASP 99 -10.395 -10.622 -1.386 846 HA ASP 99 HA ASP 99 -11.075 -12.999 -0.078 847 HB2 ASP 99 HB2 ASP 99 -12.431 -10.929 -0.009 848 HB3 ASP 99 HB1 ASP 99 -12.897 -11.198 -1.687 849 H TYR 100 HN TYR 100 -11.179 -12.182 -3.520 850 HA TYR 100 HA TYR 100 -12.544 -14.549 -4.308 851 HB2 TYR 100 HB2 TYR 100 -12.588 -12.564 -5.727 852 HB3 TYR 100 HB1 TYR 100 -10.837 -12.619 -5.903 853 HD1 TYR 100 HD1 TYR 100 -13.922 -14.582 -6.627 854 HD2 TYR 100 HD2 TYR 100 -9.877 -13.787 -7.683 855 HE1 TYR 100 HE1 TYR 100 -14.173 -15.988 -8.629 856 HE2 TYR 100 HE2 TYR 100 -10.118 -15.191 -9.688 857 HH TYR 100 HH TYR 100 -11.972 -17.345 -10.211 858 H LYS 101 HN LYS 101 -11.764 -16.512 -4.413 859 HA LYS 101 HA LYS 101 -8.849 -16.891 -4.495 860 HB2 LYS 101 HB2 LYS 101 -10.965 -18.805 -3.487 861 HB3 LYS 101 HB1 LYS 101 -9.228 -19.068 -3.436 862 HG2 LYS 101 HG2 LYS 101 -10.717 -16.904 -1.958 863 HG3 LYS 101 HG1 LYS 101 -10.123 -18.412 -1.258 864 HD2 LYS 101 HD2 LYS 101 -7.823 -17.750 -1.850 865 HD3 LYS 101 HD1 LYS 101 -8.444 -16.223 -2.484 866 HE2 LYS 101 HE2 LYS 101 -9.340 -15.686 -0.258 867 HE3 LYS 101 HE1 LYS 101 -8.669 -17.192 0.365 868 HZ1 LYS 101 HZ1 LYS 101 -6.469 -16.233 -0.572 869 HZ2 LYS 101 HZ2 LYS 101 -7.054 -15.677 0.914 870 HZ3 LYS 101 HZ3 LYS 101 -7.275 -14.746 -0.482 871 H ASP 102 HN ASP 102 -7.941 -18.206 -6.022 872 HA ASP 102 HA ASP 102 -9.739 -19.133 -8.152 873 HB2 ASP 102 HB2 ASP 102 -7.999 -17.564 -8.869 874 HB3 ASP 102 HB1 ASP 102 -6.754 -18.626 -8.219 875 H ASP 103 HN ASP 103 -6.819 -20.161 -6.394 876 HA ASP 103 HA ASP 103 -7.316 -22.928 -7.182 877 HB2 ASP 103 HB2 ASP 103 -5.013 -22.025 -7.361 878 HB3 ASP 103 HB1 ASP 103 -5.001 -21.753 -5.622 879 H ASP 104 HN ASP 104 -8.783 -23.932 -5.957 880 HA ASP 104 HA ASP 104 -9.378 -23.260 -3.269 881 HB2 ASP 104 HB2 ASP 104 -10.901 -24.441 -4.939 882 HB3 ASP 104 HB1 ASP 104 -9.998 -25.909 -4.580 883 H ASP 105 HN ASP 105 -7.140 -25.493 -4.730 884 HA ASP 105 HA ASP 105 -5.466 -26.786 -3.911 885 HB2 ASP 105 HB2 ASP 105 -5.404 -24.573 -2.336 886 HB3 ASP 105 HB1 ASP 105 -5.658 -25.821 -1.123 887 H LYS 106 HN LYS 106 -5.006 -28.120 -1.580 888 HA LYS 106 HA LYS 106 -7.478 -29.678 -1.193 889 HB2 LYS 106 HB2 LYS 106 -5.783 -30.895 -2.514 890 HB3 LYS 106 HB1 LYS 106 -4.624 -30.691 -1.210 891 HG2 LYS 106 HG2 LYS 106 -6.018 -32.048 0.259 892 HG3 LYS 106 HG1 LYS 106 -7.207 -32.234 -1.031 893 HD2 LYS 106 HD2 LYS 106 -5.532 -33.370 -2.408 894 HD3 LYS 106 HD1 LYS 106 -4.340 -33.178 -1.121 895 HE2 LYS 106 HE2 LYS 106 -5.727 -34.537 0.366 896 HE3 LYS 106 HE1 LYS 106 -6.925 -34.719 -0.914 897 HZ1 LYS 106 HZ1 LYS 106 -5.283 -35.877 -2.248 898 HZ2 LYS 106 HZ2 LYS 106 -5.481 -36.651 -0.757 899 HZ3 LYS 106 HZ3 LYS 106 -4.119 -35.686 -1.033 Start of MODEL 8 1 H1 MET 1 HT1 MET 1 -16.504 -13.942 -16.466 2 H2 MET 1 HT2 MET 1 -14.982 -14.084 -17.191 3 H3 MET 1 HT3 MET 1 -16.318 -13.621 -18.117 4 HA MET 1 HA MET 1 -15.178 -11.647 -17.761 5 HB2 MET 1 HB2 MET 1 -17.287 -11.862 -15.600 6 HB3 MET 1 HB1 MET 1 -16.650 -10.361 -16.256 7 HG2 MET 1 HG2 MET 1 -17.566 -10.895 -18.437 8 HG3 MET 1 HG1 MET 1 -18.151 -12.443 -17.829 9 HE1 MET 1 HE1 MET 1 -20.375 -11.994 -18.784 10 HE2 MET 1 HE2 MET 1 -20.291 -10.299 -19.265 11 HE3 MET 1 HE3 MET 1 -21.567 -10.845 -18.177 12 H ALA 2 HN ALA 2 -14.821 -13.921 -15.300 13 HA ALA 2 HA ALA 2 -13.464 -12.196 -13.421 14 HB1 ALA 2 HB1 ALA 2 -13.097 -15.098 -13.145 15 HB2 ALA 2 HB2 ALA 2 -14.775 -14.555 -13.137 16 HB3 ALA 2 HB3 ALA 2 -13.632 -13.901 -11.964 17 HA PRO 3 HA PRO 3 -9.591 -12.568 -15.620 18 HB2 PRO 3 HB2 PRO 3 -8.086 -11.115 -13.922 19 HB3 PRO 3 HB1 PRO 3 -9.233 -10.375 -15.046 20 HG2 PRO 3 HG2 PRO 3 -9.577 -11.018 -12.147 21 HG3 PRO 3 HG1 PRO 3 -9.999 -9.531 -13.014 22 HD2 PRO 3 HD2 PRO 3 -11.836 -11.414 -12.403 23 HD3 PRO 3 HD1 PRO 3 -11.934 -10.449 -13.891 24 H LEU 4 HN LEU 4 -7.676 -13.713 -15.437 25 HA LEU 4 HA LEU 4 -7.591 -15.577 -13.184 26 HB2 LEU 4 HB2 LEU 4 -6.105 -15.657 -15.811 27 HB3 LEU 4 HB1 LEU 4 -6.118 -16.922 -14.598 28 HG LEU 4 HG LEU 4 -8.492 -16.002 -16.222 29 HD11 LEU 4 HD11 LEU 4 -7.010 -17.261 -17.596 30 HD12 LEU 4 HD12 LEU 4 -8.350 -18.315 -17.144 31 HD13 LEU 4 HD13 LEU 4 -6.788 -18.480 -16.341 32 HD21 LEU 4 HD21 LEU 4 -8.224 -17.852 -13.900 33 HD22 LEU 4 HD22 LEU 4 -9.402 -18.215 -15.162 34 HD23 LEU 4 HD23 LEU 4 -9.496 -16.689 -14.279 35 H ARG 5 HN ARG 5 -6.282 -12.683 -13.910 36 HA ARG 5 HA ARG 5 -3.616 -13.293 -12.866 37 HB2 ARG 5 HB2 ARG 5 -4.764 -11.118 -14.517 38 HB3 ARG 5 HB1 ARG 5 -3.522 -10.637 -13.371 39 HG2 ARG 5 HG2 ARG 5 -2.463 -11.074 -15.453 40 HG3 ARG 5 HG1 ARG 5 -2.038 -12.386 -14.354 41 HD2 ARG 5 HD2 ARG 5 -3.569 -13.871 -15.404 42 HD3 ARG 5 HD1 ARG 5 -4.305 -12.562 -16.328 43 HE ARG 5 HE ARG 5 -1.626 -12.634 -17.034 44 HH11 ARG 5 HH11 ARG 5 -4.394 -14.737 -17.220 45 HH12 ARG 5 HH12 ARG 5 -3.855 -15.539 -18.658 46 HH21 ARG 5 HH21 ARG 5 -0.901 -13.678 -18.925 47 HH22 ARG 5 HH22 ARG 5 -1.862 -14.935 -19.629 48 H LYS 6 HN LYS 6 -2.884 -12.541 -10.938 49 HA LYS 6 HA LYS 6 -4.797 -11.804 -8.963 50 HB2 LYS 6 HB2 LYS 6 -3.084 -12.007 -7.406 51 HB3 LYS 6 HB1 LYS 6 -2.624 -13.144 -8.658 52 HG2 LYS 6 HG2 LYS 6 -0.628 -12.179 -8.620 53 HG3 LYS 6 HG1 LYS 6 -1.385 -10.794 -9.413 54 HD2 LYS 6 HD2 LYS 6 -1.210 -9.528 -7.580 55 HD3 LYS 6 HD1 LYS 6 -1.838 -10.809 -6.541 56 HE2 LYS 6 HE2 LYS 6 1.001 -10.601 -7.548 57 HE3 LYS 6 HE1 LYS 6 0.456 -10.141 -5.936 58 HZ1 LYS 6 HZ1 LYS 6 -0.391 -12.767 -6.491 59 HZ2 LYS 6 HZ2 LYS 6 0.664 -12.231 -5.284 60 HZ3 LYS 6 HZ3 LYS 6 1.268 -12.653 -6.805 61 H THR 7 HN THR 7 -2.906 -10.026 -11.146 62 HA THR 7 HA THR 7 -2.885 -7.629 -9.528 63 HB THR 7 HB THR 7 -1.806 -6.619 -11.577 64 HG1 THR 7 HG1 THR 7 -2.672 -8.279 -13.028 65 HG21 THR 7 HG21 THR 7 -0.739 -8.846 -9.919 66 HG22 THR 7 HG22 THR 7 -0.236 -7.150 -10.008 67 HG23 THR 7 HG23 THR 7 0.246 -8.281 -11.275 68 H ALA 8 HN ALA 8 -4.379 -6.193 -9.509 69 HA ALA 8 HA ALA 8 -6.539 -6.224 -11.460 70 HB1 ALA 8 HB1 ALA 8 -7.062 -6.142 -9.056 71 HB2 ALA 8 HB2 ALA 8 -7.674 -4.727 -9.916 72 HB3 ALA 8 HB3 ALA 8 -6.212 -4.601 -8.936 73 H VAL 9 HN VAL 9 -7.252 -4.223 -12.491 74 HA VAL 9 HA VAL 9 -4.920 -2.539 -13.095 75 HB VAL 9 HB VAL 9 -7.324 -3.108 -14.826 76 HG11 VAL 9 HG11 VAL 9 -5.009 -1.228 -15.127 77 HG12 VAL 9 HG12 VAL 9 -6.716 -0.966 -15.483 78 HG13 VAL 9 HG13 VAL 9 -5.735 -1.962 -16.558 79 HG21 VAL 9 HG21 VAL 9 -5.261 -4.778 -14.390 80 HG22 VAL 9 HG22 VAL 9 -4.599 -3.810 -15.708 81 HG23 VAL 9 HG23 VAL 9 -6.122 -4.673 -15.925 82 H LEU 10 HN LEU 10 -4.995 -0.529 -12.470 83 HA LEU 10 HA LEU 10 -7.597 0.706 -11.813 84 HB2 LEU 10 HB2 LEU 10 -5.545 0.267 -10.085 85 HB3 LEU 10 HB1 LEU 10 -5.084 1.838 -10.703 86 HG LEU 10 HG LEU 10 -6.256 2.247 -8.695 87 HD11 LEU 10 HD11 LEU 10 -8.137 2.676 -11.001 88 HD12 LEU 10 HD12 LEU 10 -6.927 3.799 -10.379 89 HD13 LEU 10 HD13 LEU 10 -8.337 3.387 -9.399 90 HD21 LEU 10 HD21 LEU 10 -7.330 0.293 -8.118 91 HD22 LEU 10 HD22 LEU 10 -8.150 0.158 -9.674 92 HD23 LEU 10 HD23 LEU 10 -8.680 1.365 -8.498 93 H LYS 11 HN LYS 11 -8.102 2.541 -13.023 94 HA LYS 11 HA LYS 11 -5.901 3.534 -14.706 95 HB2 LYS 11 HB2 LYS 11 -8.849 3.370 -15.345 96 HB3 LYS 11 HB1 LYS 11 -7.709 4.331 -16.282 97 HG2 LYS 11 HG2 LYS 11 -6.439 2.301 -16.797 98 HG3 LYS 11 HG1 LYS 11 -7.615 1.347 -15.894 99 HD2 LYS 11 HD2 LYS 11 -9.378 2.052 -17.425 100 HD3 LYS 11 HD1 LYS 11 -8.222 3.049 -18.312 101 HE2 LYS 11 HE2 LYS 11 -6.947 1.051 -18.897 102 HE3 LYS 11 HE1 LYS 11 -8.090 0.051 -18.002 103 HZ1 LYS 11 HZ1 LYS 11 -9.461 1.675 -19.870 104 HZ2 LYS 11 HZ2 LYS 11 -9.417 -0.013 -19.758 105 HZ3 LYS 11 HZ3 LYS 11 -8.242 0.806 -20.657 106 H LEU 12 HN LEU 12 -5.371 5.581 -14.550 107 HA LEU 12 HA LEU 12 -7.078 7.282 -12.875 108 HB2 LEU 12 HB2 LEU 12 -4.402 6.681 -12.598 109 HB3 LEU 12 HB1 LEU 12 -4.358 8.234 -13.406 110 HG LEU 12 HG LEU 12 -5.672 7.623 -10.758 111 HD11 LEU 12 HD11 LEU 12 -3.988 9.067 -9.825 112 HD12 LEU 12 HD12 LEU 12 -3.341 9.408 -11.430 113 HD13 LEU 12 HD13 LEU 12 -3.206 7.786 -10.752 114 HD21 LEU 12 HD21 LEU 12 -5.843 9.986 -12.560 115 HD22 LEU 12 HD22 LEU 12 -5.800 10.245 -10.816 116 HD23 LEU 12 HD23 LEU 12 -7.076 9.258 -11.530 117 H TYR 13 HN TYR 13 -8.107 8.946 -13.962 118 HA TYR 13 HA TYR 13 -7.157 9.588 -16.668 119 HB2 TYR 13 HB2 TYR 13 -9.766 10.183 -15.251 120 HB3 TYR 13 HB1 TYR 13 -9.384 10.623 -16.912 121 HD1 TYR 13 HD1 TYR 13 -10.155 7.836 -14.644 122 HD2 TYR 13 HD2 TYR 13 -9.394 8.963 -18.675 123 HE1 TYR 13 HE1 TYR 13 -10.988 5.654 -15.403 124 HE2 TYR 13 HE2 TYR 13 -10.224 6.779 -19.444 125 HH TYR 13 HH TYR 13 -11.281 4.886 -18.843 126 H VAL 14 HN VAL 14 -5.963 11.390 -16.865 127 HA VAL 14 HA VAL 14 -6.354 13.541 -14.883 128 HB VAL 14 HB VAL 14 -3.934 14.053 -15.084 129 HG11 VAL 14 HG11 VAL 14 -4.717 12.910 -13.123 130 HG12 VAL 14 HG12 VAL 14 -3.201 12.159 -13.626 131 HG13 VAL 14 HG13 VAL 14 -4.734 11.364 -13.977 132 HG21 VAL 14 HG21 VAL 14 -3.535 12.879 -17.214 133 HG22 VAL 14 HG22 VAL 14 -3.768 11.338 -16.389 134 HG23 VAL 14 HG23 VAL 14 -2.412 12.377 -15.950 135 H ALA 15 HN ALA 15 -5.602 15.669 -15.615 136 HA ALA 15 HA ALA 15 -5.958 15.958 -18.522 137 HB1 ALA 15 HB1 ALA 15 -7.568 17.480 -18.232 138 HB2 ALA 15 HB2 ALA 15 -6.618 18.354 -17.030 139 HB3 ALA 15 HB3 ALA 15 -7.615 16.982 -16.541 140 H GLY 16 HN GLY 16 -3.934 16.187 -19.236 141 HA2 GLY 16 HA2 GLY 16 -1.902 17.141 -19.646 142 HA3 GLY 16 HA1 GLY 16 -2.577 18.611 -18.967 143 H ASN 17 HN ASN 17 -1.038 19.376 -17.692 144 HA ASN 17 HA ASN 17 0.056 17.582 -15.632 145 HB2 ASN 17 HB2 ASN 17 2.135 18.886 -15.679 146 HB3 ASN 17 HB1 ASN 17 1.793 18.202 -17.263 147 HD21 ASN 17 HD21 ASN 17 3.431 20.506 -16.466 148 HD22 ASN 17 HD22 ASN 17 2.815 21.849 -17.359 149 H THR 18 HN THR 18 -2.318 19.032 -15.368 150 HA THR 18 HA THR 18 -1.980 21.481 -13.991 151 HB THR 18 HB THR 18 -4.282 20.869 -13.013 152 HG1 THR 18 HG1 THR 18 -4.424 18.927 -15.044 153 HG21 THR 18 HG21 THR 18 -3.771 21.087 -15.974 154 HG22 THR 18 HG22 THR 18 -4.183 22.375 -14.842 155 HG23 THR 18 HG23 THR 18 -5.387 21.159 -15.271 156 HA PRO 19 HA PRO 19 -0.365 20.348 -10.093 157 HB2 PRO 19 HB2 PRO 19 -2.024 21.796 -8.400 158 HB3 PRO 19 HB1 PRO 19 -0.603 22.442 -9.226 159 HG2 PRO 19 HG2 PRO 19 -3.489 22.616 -10.000 160 HG3 PRO 19 HG1 PRO 19 -2.226 23.855 -10.104 161 HD2 PRO 19 HD2 PRO 19 -3.022 22.519 -12.267 162 HD3 PRO 19 HD1 PRO 19 -1.308 22.926 -12.028 163 H ASN 20 HN ASN 20 -3.856 20.169 -10.447 164 HA ASN 20 HA ASN 20 -4.257 18.464 -8.200 165 HB2 ASN 20 HB2 ASN 20 -6.469 17.937 -9.412 166 HB3 ASN 20 HB1 ASN 20 -6.191 19.597 -8.901 167 HD21 ASN 20 HD21 ASN 20 -7.327 17.769 -11.349 168 HD22 ASN 20 HD22 ASN 20 -7.080 18.853 -12.670 169 H SER 21 HN SER 21 -3.784 17.922 -11.689 170 HA SER 21 HA SER 21 -4.022 15.061 -11.592 171 HB2 SER 21 HB2 SER 21 -2.762 16.914 -13.628 172 HB3 SER 21 HB1 SER 21 -3.000 15.183 -13.857 173 HG SER 21 HG SER 21 -4.846 17.264 -13.884 174 H VAL 22 HN VAL 22 -1.272 17.300 -11.529 175 HA VAL 22 HA VAL 22 0.680 15.263 -11.549 176 HB VAL 22 HB VAL 22 0.792 18.120 -10.555 177 HG11 VAL 22 HG11 VAL 22 3.005 16.083 -10.678 178 HG12 VAL 22 HG12 VAL 22 2.442 16.997 -9.275 179 HG13 VAL 22 HG13 VAL 22 3.285 17.823 -10.588 180 HG21 VAL 22 HG21 VAL 22 1.214 16.778 -13.114 181 HG22 VAL 22 HG22 VAL 22 2.519 17.874 -12.663 182 HG23 VAL 22 HG23 VAL 22 0.861 18.470 -12.764 183 H ARG 23 HN ARG 23 -0.915 16.983 -8.916 184 HA ARG 23 HA ARG 23 0.498 15.864 -6.767 185 HB2 ARG 23 HB2 ARG 23 -1.376 17.747 -6.991 186 HB3 ARG 23 HB1 ARG 23 -2.420 16.406 -6.521 187 HG2 ARG 23 HG2 ARG 23 -1.979 17.130 -4.455 188 HG3 ARG 23 HG1 ARG 23 -0.491 16.200 -4.650 189 HD2 ARG 23 HD2 ARG 23 0.674 18.199 -5.405 190 HD3 ARG 23 HD1 ARG 23 -0.817 19.132 -5.273 191 HE ARG 23 HE ARG 23 0.894 18.239 -3.097 192 HH11 ARG 23 HH11 ARG 23 -2.147 19.641 -4.065 193 HH12 ARG 23 HH12 ARG 23 -2.471 20.334 -2.512 194 HH21 ARG 23 HH21 ARG 23 0.479 19.143 -1.049 195 HH22 ARG 23 HH22 ARG 23 -0.974 20.050 -0.791 196 H ALA 24 HN ALA 24 -2.520 14.917 -8.344 197 HA ALA 24 HA ALA 24 -3.075 12.688 -6.724 198 HB1 ALA 24 HB1 ALA 24 -4.025 12.402 -9.454 199 HB2 ALA 24 HB2 ALA 24 -4.352 13.998 -8.775 200 HB3 ALA 24 HB3 ALA 24 -4.928 12.551 -7.946 201 H LEU 25 HN LEU 25 -1.392 12.994 -9.822 202 HA LEU 25 HA LEU 25 -0.954 10.267 -10.330 203 HB2 LEU 25 HB2 LEU 25 -0.695 11.974 -12.040 204 HB3 LEU 25 HB1 LEU 25 0.642 12.690 -11.162 205 HG LEU 25 HG LEU 25 1.979 10.658 -11.557 206 HD11 LEU 25 HD11 LEU 25 1.030 9.153 -13.433 207 HD12 LEU 25 HD12 LEU 25 -0.538 9.763 -12.907 208 HD13 LEU 25 HD13 LEU 25 0.495 8.890 -11.773 209 HD21 LEU 25 HD21 LEU 25 2.193 12.517 -13.086 210 HD22 LEU 25 HD22 LEU 25 0.813 11.942 -14.023 211 HD23 LEU 25 HD23 LEU 25 2.302 10.999 -13.976 212 H LYS 26 HN LYS 26 1.161 12.644 -8.717 213 HA LYS 26 HA LYS 26 3.274 10.842 -8.238 214 HB2 LYS 26 HB2 LYS 26 2.513 13.529 -7.313 215 HB3 LYS 26 HB1 LYS 26 3.484 12.615 -6.168 216 HG2 LYS 26 HG2 LYS 26 4.914 13.969 -7.554 217 HG3 LYS 26 HG1 LYS 26 5.181 12.264 -7.914 218 HD2 LYS 26 HD2 LYS 26 4.221 12.415 -9.997 219 HD3 LYS 26 HD1 LYS 26 3.194 13.776 -9.542 220 HE2 LYS 26 HE2 LYS 26 4.935 14.477 -11.098 221 HE3 LYS 26 HE1 LYS 26 5.144 15.247 -9.526 222 HZ1 LYS 26 HZ1 LYS 26 6.713 13.021 -10.687 223 HZ2 LYS 26 HZ2 LYS 26 6.770 13.400 -9.039 224 HZ3 LYS 26 HZ3 LYS 26 7.264 14.540 -10.186 225 H THR 27 HN THR 27 0.460 11.736 -6.292 226 HA THR 27 HA THR 27 1.131 10.253 -3.980 227 HB THR 27 HB THR 27 -1.581 11.099 -5.018 228 HG1 THR 27 HG1 THR 27 -0.475 12.949 -4.660 229 HG21 THR 27 HG21 THR 27 -2.269 9.752 -3.337 230 HG22 THR 27 HG22 THR 27 -1.800 11.125 -2.335 231 HG23 THR 27 HG23 THR 27 -0.697 9.763 -2.542 232 H LEU 28 HN LEU 28 -0.860 9.445 -6.824 233 HA LEU 28 HA LEU 28 -1.649 6.896 -5.845 234 HB2 LEU 28 HB2 LEU 28 -2.061 8.492 -8.213 235 HB3 LEU 28 HB1 LEU 28 -1.755 6.823 -8.651 236 HG LEU 28 HG LEU 28 -4.106 7.072 -8.497 237 HD11 LEU 28 HD11 LEU 28 -3.969 5.899 -5.858 238 HD12 LEU 28 HD12 LEU 28 -2.720 5.264 -6.930 239 HD13 LEU 28 HD13 LEU 28 -4.417 5.171 -7.400 240 HD21 LEU 28 HD21 LEU 28 -3.446 8.860 -6.317 241 HD22 LEU 28 HD22 LEU 28 -4.748 7.748 -5.893 242 HD23 LEU 28 HD23 LEU 28 -4.897 8.780 -7.315 243 H ALA 29 HN ALA 29 0.803 7.858 -8.288 244 HA ALA 29 HA ALA 29 1.582 5.259 -8.979 245 HB1 ALA 29 HB1 ALA 29 2.354 6.654 -10.550 246 HB2 ALA 29 HB2 ALA 29 3.800 6.669 -9.539 247 HB3 ALA 29 HB3 ALA 29 2.618 7.972 -9.408 248 H ASN 30 HN ASN 30 3.001 7.456 -6.526 249 HA ASN 30 HA ASN 30 5.174 5.680 -5.987 250 HB2 ASN 30 HB2 ASN 30 4.043 8.054 -4.511 251 HB3 ASN 30 HB1 ASN 30 5.312 7.062 -3.796 252 HD21 ASN 30 HD21 ASN 30 4.564 9.532 -6.017 253 HD22 ASN 30 HD22 ASN 30 6.167 9.788 -6.619 254 H ILE 31 HN ILE 31 2.001 6.086 -4.531 255 HA ILE 31 HA ILE 31 2.467 4.289 -2.431 256 HB ILE 31 HB ILE 31 -0.069 5.289 -3.674 257 HG12 ILE 31 HG12 ILE 31 1.135 5.655 -0.928 258 HG13 ILE 31 HG11 ILE 31 1.399 6.754 -2.277 259 HG21 ILE 31 HG21 ILE 31 -0.090 2.856 -2.584 260 HG22 ILE 31 HG22 ILE 31 -1.424 3.998 -2.408 261 HG23 ILE 31 HG23 ILE 31 -0.237 3.820 -1.114 262 HD11 ILE 31 HD11 ILE 31 -0.337 7.439 -0.611 263 HD12 ILE 31 HD12 ILE 31 -1.320 6.104 -1.212 264 HD13 ILE 31 HD13 ILE 31 -0.855 7.414 -2.297 265 H LEU 32 HN LEU 32 1.105 3.836 -5.673 266 HA LEU 32 HA LEU 32 0.637 1.054 -5.355 267 HB2 LEU 32 HB2 LEU 32 0.797 2.824 -7.773 268 HB3 LEU 32 HB1 LEU 32 0.493 1.099 -7.892 269 HG LEU 32 HG LEU 32 -1.241 2.970 -6.272 270 HD11 LEU 32 HD11 LEU 32 -1.819 1.892 -9.025 271 HD12 LEU 32 HD12 LEU 32 -1.203 3.517 -8.724 272 HD13 LEU 32 HD13 LEU 32 -2.776 3.038 -8.089 273 HD21 LEU 32 HD21 LEU 32 -1.148 0.091 -6.763 274 HD22 LEU 32 HD22 LEU 32 -2.732 0.817 -7.043 275 HD23 LEU 32 HD23 LEU 32 -1.942 1.003 -5.478 276 H GLU 33 HN GLU 33 3.489 2.858 -6.314 277 HA GLU 33 HA GLU 33 4.792 0.449 -7.316 278 HB2 GLU 33 HB2 GLU 33 5.872 3.255 -6.999 279 HB3 GLU 33 HB1 GLU 33 6.730 1.917 -7.752 280 HG2 GLU 33 HG2 GLU 33 4.941 1.786 -9.456 281 HG3 GLU 33 HG1 GLU 33 4.190 3.203 -8.718 282 H LYS 34 HN LYS 34 4.247 1.614 -4.281 283 HA LYS 34 HA LYS 34 6.666 0.259 -3.304 284 HB2 LYS 34 HB2 LYS 34 7.009 2.666 -3.058 285 HB3 LYS 34 HB1 LYS 34 5.488 2.813 -2.191 286 HG2 LYS 34 HG2 LYS 34 7.294 2.878 -0.619 287 HG3 LYS 34 HG1 LYS 34 6.412 1.363 -0.408 288 HD2 LYS 34 HD2 LYS 34 8.110 0.168 -1.667 289 HD3 LYS 34 HD1 LYS 34 8.970 1.678 -1.983 290 HE2 LYS 34 HE2 LYS 34 9.342 1.964 0.417 291 HE3 LYS 34 HE1 LYS 34 8.484 0.457 0.731 292 HZ1 LYS 34 HZ1 LYS 34 11.046 0.779 -0.730 293 HZ2 LYS 34 HZ2 LYS 34 10.188 -0.676 -0.641 294 HZ3 LYS 34 HZ3 LYS 34 10.811 0.024 0.767 295 H GLU 35 HN GLU 35 3.649 1.667 -2.054 296 HA GLU 35 HA GLU 35 3.386 -0.147 0.087 297 HB2 GLU 35 HB2 GLU 35 1.441 1.725 -1.266 298 HB3 GLU 35 HB1 GLU 35 1.010 0.761 0.146 299 HG2 GLU 35 HG2 GLU 35 3.204 2.822 0.011 300 HG3 GLU 35 HG1 GLU 35 1.627 3.032 0.769 301 H PHE 36 HN PHE 36 1.948 -0.138 -3.170 302 HA PHE 36 HA PHE 36 0.981 -2.868 -2.608 303 HB2 PHE 36 HB2 PHE 36 -0.354 -0.774 -4.333 304 HB3 PHE 36 HB1 PHE 36 -0.896 -2.440 -4.162 305 HD1 PHE 36 HD1 PHE 36 -0.867 0.858 -2.706 306 HD2 PHE 36 HD2 PHE 36 -1.729 -3.241 -1.962 307 HE1 PHE 36 HE1 PHE 36 -2.179 1.498 -0.728 308 HE2 PHE 36 HE2 PHE 36 -3.045 -2.608 0.017 309 HZ PHE 36 HZ PHE 36 -3.270 -0.235 0.637 310 H LYS 37 HN LYS 37 3.534 -2.047 -3.797 311 HA LYS 37 HA LYS 37 3.505 -2.321 -6.592 312 HB2 LYS 37 HB2 LYS 37 5.442 -1.453 -5.342 313 HB3 LYS 37 HB1 LYS 37 5.720 -3.054 -4.670 314 HG2 LYS 37 HG2 LYS 37 6.285 -3.939 -6.812 315 HG3 LYS 37 HG1 LYS 37 5.773 -2.458 -7.620 316 HD2 LYS 37 HD2 LYS 37 8.176 -2.493 -7.499 317 HD3 LYS 37 HD1 LYS 37 7.567 -1.237 -6.416 318 HE2 LYS 37 HE2 LYS 37 7.852 -2.707 -4.512 319 HE3 LYS 37 HE1 LYS 37 8.384 -4.014 -5.569 320 HZ1 LYS 37 HZ1 LYS 37 10.337 -2.806 -6.125 321 HZ2 LYS 37 HZ2 LYS 37 10.207 -2.787 -4.439 322 HZ3 LYS 37 HZ3 LYS 37 9.792 -1.413 -5.335 323 H GLY 38 HN GLY 38 3.296 -4.003 -7.904 324 HA2 GLY 38 HA2 GLY 38 3.568 -6.226 -8.613 325 HA3 GLY 38 HA1 GLY 38 3.874 -6.696 -6.948 326 H VAL 39 HN VAL 39 1.251 -4.878 -6.554 327 HA VAL 39 HA VAL 39 -0.515 -7.186 -6.979 328 HB VAL 39 HB VAL 39 -0.864 -4.920 -5.000 329 HG11 VAL 39 HG11 VAL 39 -2.469 -7.463 -5.139 330 HG12 VAL 39 HG12 VAL 39 -2.972 -5.976 -5.944 331 HG13 VAL 39 HG13 VAL 39 -2.796 -6.014 -4.188 332 HG21 VAL 39 HG21 VAL 39 -0.287 -6.470 -3.283 333 HG22 VAL 39 HG22 VAL 39 0.978 -6.552 -4.510 334 HG23 VAL 39 HG23 VAL 39 -0.253 -7.813 -4.426 335 H TYR 40 HN TYR 40 -0.413 -3.624 -7.265 336 HA TYR 40 HA TYR 40 -2.741 -3.929 -9.007 337 HB2 TYR 40 HB2 TYR 40 -2.090 -1.930 -6.967 338 HB3 TYR 40 HB1 TYR 40 -2.560 -1.193 -8.489 339 HD1 TYR 40 HD1 TYR 40 -3.703 -2.705 -5.464 340 HD2 TYR 40 HD2 TYR 40 -4.799 -1.874 -9.489 341 HE1 TYR 40 HE1 TYR 40 -6.075 -2.947 -4.864 342 HE2 TYR 40 HE2 TYR 40 -7.170 -2.120 -8.902 343 HH TYR 40 HH TYR 40 -8.287 -3.610 -6.356 344 H ALA 41 HN ALA 41 -2.779 -3.055 -11.032 345 HA ALA 41 HA ALA 41 -0.215 -2.016 -12.031 346 HB1 ALA 41 HB1 ALA 41 -0.835 -2.801 -14.183 347 HB2 ALA 41 HB2 ALA 41 -2.515 -3.027 -13.697 348 HB3 ALA 41 HB3 ALA 41 -1.260 -4.092 -13.058 349 H LEU 42 HN LEU 42 -0.107 0.115 -12.542 350 HA LEU 42 HA LEU 42 -2.601 1.629 -12.491 351 HB2 LEU 42 HB2 LEU 42 -0.839 2.362 -10.980 352 HB3 LEU 42 HB1 LEU 42 0.266 2.557 -12.327 353 HG LEU 42 HG LEU 42 -1.167 4.367 -13.219 354 HD11 LEU 42 HD11 LEU 42 -2.787 5.318 -11.414 355 HD12 LEU 42 HD12 LEU 42 -2.814 3.653 -10.835 356 HD13 LEU 42 HD13 LEU 42 -3.321 4.021 -12.483 357 HD21 LEU 42 HD21 LEU 42 -0.517 5.006 -10.366 358 HD22 LEU 42 HD22 LEU 42 -0.346 6.017 -11.799 359 HD23 LEU 42 HD23 LEU 42 0.757 4.666 -11.537 360 H LYS 43 HN LYS 43 -3.483 2.532 -14.174 361 HA LYS 43 HA LYS 43 -1.930 2.897 -16.641 362 HB2 LYS 43 HB2 LYS 43 -4.317 1.298 -16.197 363 HB3 LYS 43 HB1 LYS 43 -4.609 2.560 -17.384 364 HG2 LYS 43 HG2 LYS 43 -3.879 0.951 -18.780 365 HG3 LYS 43 HG1 LYS 43 -2.314 1.643 -18.351 366 HD2 LYS 43 HD2 LYS 43 -1.833 -0.103 -16.857 367 HD3 LYS 43 HD1 LYS 43 -3.517 -0.631 -16.803 368 HE2 LYS 43 HE2 LYS 43 -2.363 -2.205 -18.147 369 HE3 LYS 43 HE1 LYS 43 -3.305 -1.196 -19.244 370 HZ1 LYS 43 HZ1 LYS 43 -0.707 -1.738 -19.560 371 HZ2 LYS 43 HZ2 LYS 43 -0.614 -0.265 -18.735 372 HZ3 LYS 43 HZ3 LYS 43 -1.469 -0.365 -20.190 373 H VAL 44 HN VAL 44 -1.712 4.982 -16.894 374 HA VAL 44 HA VAL 44 -3.823 6.820 -15.984 375 HB VAL 44 HB VAL 44 -0.948 7.299 -16.768 376 HG11 VAL 44 HG11 VAL 44 -2.124 9.283 -17.338 377 HG12 VAL 44 HG12 VAL 44 -1.372 9.587 -15.771 378 HG13 VAL 44 HG13 VAL 44 -3.093 9.210 -15.865 379 HG21 VAL 44 HG21 VAL 44 -0.381 7.194 -14.593 380 HG22 VAL 44 HG22 VAL 44 -1.839 6.208 -14.473 381 HG23 VAL 44 HG23 VAL 44 -1.896 7.921 -14.056 382 H ILE 45 HN ILE 45 -5.064 7.885 -17.261 383 HA ILE 45 HA ILE 45 -4.627 7.700 -20.168 384 HB ILE 45 HB ILE 45 -7.192 8.124 -18.634 385 HG12 ILE 45 HG12 ILE 45 -6.316 5.915 -18.140 386 HG13 ILE 45 HG11 ILE 45 -7.743 5.781 -19.156 387 HG21 ILE 45 HG21 ILE 45 -6.897 7.297 -21.517 388 HG22 ILE 45 HG22 ILE 45 -7.115 8.969 -21.001 389 HG23 ILE 45 HG23 ILE 45 -8.375 7.773 -20.674 390 HD11 ILE 45 HD11 ILE 45 -4.905 5.575 -20.127 391 HD12 ILE 45 HD12 ILE 45 -6.368 5.313 -21.077 392 HD13 ILE 45 HD13 ILE 45 -5.961 4.210 -19.760 393 H ASP 46 HN ASP 46 -3.938 9.650 -20.987 394 HA ASP 46 HA ASP 46 -4.490 12.100 -19.542 395 HB2 ASP 46 HB2 ASP 46 -2.282 11.615 -20.652 396 HB3 ASP 46 HB1 ASP 46 -3.094 11.794 -22.204 397 H VAL 47 HN VAL 47 -6.559 12.764 -19.759 398 HA VAL 47 HA VAL 47 -8.162 12.259 -22.030 399 HB VAL 47 HB VAL 47 -9.848 13.656 -20.991 400 HG11 VAL 47 HG11 VAL 47 -8.484 11.464 -19.700 401 HG12 VAL 47 HG12 VAL 47 -10.212 11.807 -19.808 402 HG13 VAL 47 HG13 VAL 47 -9.251 12.519 -18.512 403 HG21 VAL 47 HG21 VAL 47 -8.307 15.454 -20.217 404 HG22 VAL 47 HG22 VAL 47 -7.786 14.385 -18.913 405 HG23 VAL 47 HG23 VAL 47 -9.463 14.929 -18.993 406 H LEU 48 HN LEU 48 -6.165 15.075 -21.219 407 HA LEU 48 HA LEU 48 -7.395 16.777 -23.146 408 HB2 LEU 48 HB2 LEU 48 -4.741 16.963 -21.748 409 HB3 LEU 48 HB1 LEU 48 -5.288 18.159 -22.909 410 HG LEU 48 HG LEU 48 -6.718 17.459 -20.342 411 HD11 LEU 48 HD11 LEU 48 -4.910 19.749 -21.078 412 HD12 LEU 48 HD12 LEU 48 -4.705 18.581 -19.773 413 HD13 LEU 48 HD13 LEU 48 -6.001 19.775 -19.693 414 HD21 LEU 48 HD21 LEU 48 -7.368 19.193 -22.657 415 HD22 LEU 48 HD22 LEU 48 -7.742 19.810 -21.048 416 HD23 LEU 48 HD23 LEU 48 -8.433 18.280 -21.588 417 H LYS 49 HN LYS 49 -4.588 14.625 -23.299 418 HA LYS 49 HA LYS 49 -3.794 15.500 -25.892 419 HB2 LYS 49 HB2 LYS 49 -3.107 13.034 -24.313 420 HB3 LYS 49 HB1 LYS 49 -2.484 13.327 -25.931 421 HG2 LYS 49 HG2 LYS 49 -1.484 15.435 -25.134 422 HG3 LYS 49 HG1 LYS 49 -2.048 15.058 -23.505 423 HD2 LYS 49 HD2 LYS 49 -0.689 13.064 -23.452 424 HD3 LYS 49 HD1 LYS 49 -0.214 13.308 -25.134 425 HE2 LYS 49 HE2 LYS 49 1.567 14.028 -23.657 426 HE3 LYS 49 HE1 LYS 49 0.882 15.416 -24.500 427 HZ1 LYS 49 HZ1 LYS 49 0.161 16.311 -22.597 428 HZ2 LYS 49 HZ2 LYS 49 1.282 15.288 -21.852 429 HZ3 LYS 49 HZ3 LYS 49 -0.347 14.830 -21.947 430 H ASN 50 HN ASN 50 -5.905 12.929 -24.725 431 HA ASN 50 HA ASN 50 -6.741 12.531 -27.522 432 HB2 ASN 50 HB2 ASN 50 -5.343 10.612 -26.517 433 HB3 ASN 50 HB1 ASN 50 -6.747 10.311 -25.492 434 HD21 ASN 50 HD21 ASN 50 -5.321 9.023 -27.958 435 HD22 ASN 50 HD22 ASN 50 -6.657 8.531 -28.936 436 HA PRO 51 HA PRO 51 -10.341 13.896 -25.074 437 HB2 PRO 51 HB2 PRO 51 -11.156 14.710 -27.813 438 HB3 PRO 51 HB1 PRO 51 -11.162 15.650 -26.315 439 HG2 PRO 51 HG2 PRO 51 -9.320 16.125 -28.170 440 HG3 PRO 51 HG1 PRO 51 -8.875 16.116 -26.453 441 HD2 PRO 51 HD2 PRO 51 -8.503 13.966 -28.508 442 HD3 PRO 51 HD1 PRO 51 -7.346 14.585 -27.306 443 H GLN 52 HN GLN 52 -10.066 12.000 -27.991 444 HA GLN 52 HA GLN 52 -12.728 11.083 -28.194 445 HB2 GLN 52 HB2 GLN 52 -10.999 10.872 -29.992 446 HB3 GLN 52 HB1 GLN 52 -10.202 9.637 -29.024 447 HG2 GLN 52 HG2 GLN 52 -12.142 8.204 -29.196 448 HG3 GLN 52 HG1 GLN 52 -13.014 9.451 -30.085 449 HE21 GLN 52 HE21 GLN 52 -12.992 7.211 -31.353 450 HE22 GLN 52 HE22 GLN 52 -11.826 7.157 -32.625 451 H LEU 53 HN LEU 53 -9.904 9.864 -26.455 452 HA LEU 53 HA LEU 53 -11.244 7.494 -25.615 453 HB2 LEU 53 HB2 LEU 53 -8.738 8.807 -24.559 454 HB3 LEU 53 HB1 LEU 53 -9.344 7.265 -23.983 455 HG LEU 53 HG LEU 53 -8.472 7.852 -26.812 456 HD11 LEU 53 HD11 LEU 53 -6.720 7.711 -24.928 457 HD12 LEU 53 HD12 LEU 53 -6.485 6.737 -26.378 458 HD13 LEU 53 HD13 LEU 53 -7.106 5.991 -24.906 459 HD21 LEU 53 HD21 LEU 53 -8.536 5.184 -26.662 460 HD22 LEU 53 HD22 LEU 53 -9.906 6.154 -27.205 461 HD23 LEU 53 HD23 LEU 53 -9.844 5.565 -25.542 462 H ALA 54 HN ALA 54 -10.800 10.722 -24.310 463 HA ALA 54 HA ALA 54 -11.775 10.225 -21.706 464 HB1 ALA 54 HB1 ALA 54 -11.845 12.545 -21.430 465 HB2 ALA 54 HB2 ALA 54 -12.102 12.832 -23.152 466 HB3 ALA 54 HB3 ALA 54 -10.527 12.286 -22.574 467 H GLU 55 HN GLU 55 -13.285 11.199 -24.737 468 HA GLU 55 HA GLU 55 -15.932 11.486 -23.720 469 HB2 GLU 55 HB2 GLU 55 -15.182 12.499 -25.855 470 HB3 GLU 55 HB1 GLU 55 -15.037 10.890 -26.549 471 HG2 GLU 55 HG2 GLU 55 -17.428 10.533 -26.272 472 HG3 GLU 55 HG1 GLU 55 -17.589 12.123 -25.529 473 H GLU 56 HN GLU 56 -14.143 8.796 -25.136 474 HA GLU 56 HA GLU 56 -16.285 7.005 -25.412 475 HB2 GLU 56 HB2 GLU 56 -13.345 6.515 -24.896 476 HB3 GLU 56 HB1 GLU 56 -14.493 5.227 -25.235 477 HG2 GLU 56 HG2 GLU 56 -13.799 7.518 -27.074 478 HG3 GLU 56 HG1 GLU 56 -13.243 5.848 -27.226 479 H ASP 57 HN ASP 57 -14.133 7.651 -22.648 480 HA ASP 57 HA ASP 57 -15.783 5.849 -21.045 481 HB2 ASP 57 HB2 ASP 57 -13.100 7.167 -20.498 482 HB3 ASP 57 HB1 ASP 57 -14.006 6.318 -19.246 483 H LYS 58 HN LYS 58 -16.247 8.758 -22.010 484 HA LYS 58 HA LYS 58 -17.321 10.621 -21.306 485 HB2 LYS 58 HB2 LYS 58 -18.554 8.583 -19.458 486 HB3 LYS 58 HB1 LYS 58 -19.179 10.211 -19.688 487 HG2 LYS 58 HG2 LYS 58 -19.523 9.742 -22.070 488 HG3 LYS 58 HG1 LYS 58 -18.907 8.105 -21.829 489 HD2 LYS 58 HD2 LYS 58 -20.736 7.665 -20.243 490 HD3 LYS 58 HD1 LYS 58 -21.361 9.291 -20.527 491 HE2 LYS 58 HE2 LYS 58 -21.053 7.140 -22.620 492 HE3 LYS 58 HE1 LYS 58 -22.563 7.583 -21.828 493 HZ1 LYS 58 HZ1 LYS 58 -22.649 8.778 -23.775 494 HZ2 LYS 58 HZ2 LYS 58 -20.989 9.104 -23.794 495 HZ3 LYS 58 HZ3 LYS 58 -21.999 9.926 -22.716 496 H ILE 59 HN ILE 59 -14.887 10.830 -20.345 497 HA ILE 59 HA ILE 59 -14.960 11.278 -17.470 498 HB ILE 59 HB ILE 59 -12.742 11.793 -19.459 499 HG12 ILE 59 HG12 ILE 59 -13.325 9.428 -19.374 500 HG13 ILE 59 HG11 ILE 59 -11.767 9.697 -18.600 501 HG21 ILE 59 HG21 ILE 59 -12.524 11.540 -16.464 502 HG22 ILE 59 HG22 ILE 59 -12.649 13.086 -17.306 503 HG23 ILE 59 HG23 ILE 59 -11.270 12.030 -17.604 504 HD11 ILE 59 HD11 ILE 59 -14.343 8.825 -17.443 505 HD12 ILE 59 HD12 ILE 59 -13.311 9.852 -16.446 506 HD13 ILE 59 HD13 ILE 59 -12.694 8.321 -17.066 507 H LEU 60 HN LEU 60 -15.983 13.074 -16.822 508 HA LEU 60 HA LEU 60 -15.644 15.538 -18.384 509 HB2 LEU 60 HB2 LEU 60 -17.711 14.856 -16.293 510 HB3 LEU 60 HB1 LEU 60 -17.628 16.363 -17.185 511 HG LEU 60 HG LEU 60 -18.137 13.645 -18.404 512 HD11 LEU 60 HD11 LEU 60 -20.408 14.473 -18.762 513 HD12 LEU 60 HD12 LEU 60 -20.009 15.955 -17.893 514 HD13 LEU 60 HD13 LEU 60 -20.010 14.408 -17.046 515 HD21 LEU 60 HD21 LEU 60 -17.116 14.892 -20.086 516 HD22 LEU 60 HD22 LEU 60 -17.863 16.400 -19.558 517 HD23 LEU 60 HD23 LEU 60 -18.837 15.167 -20.359 518 H ALA 61 HN ALA 61 -14.564 14.061 -15.550 519 HA ALA 61 HA ALA 61 -13.544 16.633 -14.584 520 HB1 ALA 61 HB1 ALA 61 -15.658 15.672 -13.322 521 HB2 ALA 61 HB2 ALA 61 -14.334 16.441 -12.445 522 HB3 ALA 61 HB3 ALA 61 -14.437 14.682 -12.521 523 H THR 62 HN THR 62 -11.497 16.550 -13.766 524 HA THR 62 HA THR 62 -10.213 13.939 -13.452 525 HB THR 62 HB THR 62 -8.157 14.888 -14.496 526 HG1 THR 62 HG1 THR 62 -9.198 17.149 -14.196 527 HG21 THR 62 HG21 THR 62 -10.549 14.941 -16.338 528 HG22 THR 62 HG22 THR 62 -9.680 13.490 -15.837 529 HG23 THR 62 HG23 THR 62 -8.864 14.714 -16.815 530 HA PRO 63 HA PRO 63 -8.132 13.318 -13.006 531 HB2 PRO 63 HB2 PRO 63 -7.191 12.037 -10.837 532 HB3 PRO 63 HB1 PRO 63 -6.260 13.271 -11.691 533 HG2 PRO 63 HG2 PRO 63 -7.827 13.495 -9.161 534 HG3 PRO 63 HG1 PRO 63 -6.245 14.183 -9.575 535 HD2 PRO 63 HD2 PRO 63 -8.586 15.604 -9.641 536 HD3 PRO 63 HD1 PRO 63 -7.172 15.984 -10.642 537 H THR 64 HN THR 64 -8.980 11.276 -13.091 538 HA THR 64 HA THR 64 -11.302 10.725 -11.353 539 HB THR 64 HB THR 64 -11.275 9.283 -13.901 540 HG1 THR 64 HG1 THR 64 -11.838 12.068 -14.053 541 HG21 THR 64 HG21 THR 64 -13.236 10.779 -12.218 542 HG22 THR 64 HG22 THR 64 -13.278 9.104 -12.775 543 HG23 THR 64 HG23 THR 64 -13.640 10.418 -13.896 544 H LEU 65 HN LEU 65 -11.048 8.957 -10.129 545 HA LEU 65 HA LEU 65 -8.935 7.032 -10.856 546 HB2 LEU 65 HB2 LEU 65 -8.852 8.268 -8.646 547 HB3 LEU 65 HB1 LEU 65 -10.305 7.401 -8.191 548 HG LEU 65 HG LEU 65 -9.030 5.259 -8.497 549 HD11 LEU 65 HD11 LEU 65 -6.553 5.452 -8.453 550 HD12 LEU 65 HD12 LEU 65 -6.722 7.176 -8.778 551 HD13 LEU 65 HD13 LEU 65 -7.279 5.996 -9.964 552 HD21 LEU 65 HD21 LEU 65 -9.148 6.970 -6.351 553 HD22 LEU 65 HD22 LEU 65 -7.425 6.624 -6.484 554 HD23 LEU 65 HD23 LEU 65 -8.579 5.302 -6.310 555 H ALA 66 HN ALA 66 -9.713 5.235 -11.844 556 HA ALA 66 HA ALA 66 -12.144 4.019 -10.720 557 HB1 ALA 66 HB1 ALA 66 -11.873 4.015 -13.689 558 HB2 ALA 66 HB2 ALA 66 -12.509 5.462 -12.900 559 HB3 ALA 66 HB3 ALA 66 -13.320 3.910 -12.687 560 H LYS 67 HN LYS 67 -12.181 1.914 -10.614 561 HA LYS 67 HA LYS 67 -9.803 0.471 -11.492 562 HB2 LYS 67 HB2 LYS 67 -10.312 0.122 -9.176 563 HB3 LYS 67 HB1 LYS 67 -12.009 -0.142 -9.527 564 HG2 LYS 67 HG2 LYS 67 -11.611 -2.292 -10.393 565 HG3 LYS 67 HG1 LYS 67 -9.876 -2.006 -10.522 566 HD2 LYS 67 HD2 LYS 67 -9.877 -3.247 -8.615 567 HD3 LYS 67 HD1 LYS 67 -10.138 -1.662 -7.892 568 HE2 LYS 67 HE2 LYS 67 -11.643 -3.392 -6.984 569 HE3 LYS 67 HE1 LYS 67 -12.523 -2.077 -7.750 570 HZ1 LYS 67 HZ1 LYS 67 -13.463 -3.504 -9.142 571 HZ2 LYS 67 HZ2 LYS 67 -12.756 -4.773 -8.278 572 HZ3 LYS 67 HZ3 LYS 67 -11.968 -4.128 -9.628 573 H VAL 68 HN VAL 68 -10.078 -0.211 -13.571 574 HA VAL 68 HA VAL 68 -12.703 -0.881 -14.548 575 HB VAL 68 HB VAL 68 -11.573 -1.348 -16.688 576 HG11 VAL 68 HG11 VAL 68 -12.275 0.971 -15.824 577 HG12 VAL 68 HG12 VAL 68 -11.226 0.884 -17.239 578 HG13 VAL 68 HG13 VAL 68 -10.545 1.267 -15.657 579 HG21 VAL 68 HG21 VAL 68 -9.338 -1.835 -15.204 580 HG22 VAL 68 HG22 VAL 68 -9.004 -0.226 -15.841 581 HG23 VAL 68 HG23 VAL 68 -9.350 -1.555 -16.945 582 H LEU 69 HN LEU 69 -9.924 -2.588 -13.347 583 HA LEU 69 HA LEU 69 -11.426 -5.097 -13.679 584 HB2 LEU 69 HB2 LEU 69 -8.503 -4.741 -14.356 585 HB3 LEU 69 HB1 LEU 69 -9.316 -6.288 -14.252 586 HG LEU 69 HG LEU 69 -10.059 -4.119 -16.218 587 HD11 LEU 69 HD11 LEU 69 -8.007 -6.228 -16.289 588 HD12 LEU 69 HD12 LEU 69 -8.115 -4.714 -17.188 589 HD13 LEU 69 HD13 LEU 69 -9.041 -6.121 -17.713 590 HD21 LEU 69 HD21 LEU 69 -11.152 -6.127 -17.343 591 HD22 LEU 69 HD22 LEU 69 -11.936 -5.490 -15.897 592 HD23 LEU 69 HD23 LEU 69 -10.957 -6.955 -15.797 593 HA PRO 70 HA PRO 70 -11.415 -7.192 -12.968 594 HB2 PRO 70 HB2 PRO 70 -12.728 -7.830 -10.418 595 HB3 PRO 70 HB1 PRO 70 -11.858 -8.897 -11.524 596 HG2 PRO 70 HG2 PRO 70 -10.840 -8.232 -9.133 597 HG3 PRO 70 HG1 PRO 70 -9.803 -8.441 -10.558 598 HD2 PRO 70 HD2 PRO 70 -10.843 -5.901 -9.332 599 HD3 PRO 70 HD1 PRO 70 -9.200 -6.285 -9.892 600 HA PRO 71 HA PRO 71 -15.104 -4.725 -13.330 601 HB2 PRO 71 HB2 PRO 71 -16.769 -6.502 -14.527 602 HB3 PRO 71 HB1 PRO 71 -15.423 -5.736 -15.381 603 HG2 PRO 71 HG2 PRO 71 -15.554 -8.449 -14.107 604 HG3 PRO 71 HG1 PRO 71 -14.914 -7.994 -15.699 605 HD2 PRO 71 HD2 PRO 71 -13.300 -8.396 -13.582 606 HD3 PRO 71 HD1 PRO 71 -12.947 -7.162 -14.809 607 HA PRO 72 HA PRO 72 -17.457 -4.254 -13.659 608 HB2 PRO 72 HB2 PRO 72 -19.008 -2.638 -12.169 609 HB3 PRO 72 HB1 PRO 72 -19.601 -4.177 -12.809 610 HG2 PRO 72 HG2 PRO 72 -18.565 -3.544 -10.065 611 HG3 PRO 72 HG1 PRO 72 -20.014 -4.459 -10.525 612 HD2 PRO 72 HD2 PRO 72 -17.692 -5.664 -9.814 613 HD3 PRO 72 HD1 PRO 72 -18.812 -6.370 -10.996 614 H VAL 73 HN VAL 73 -17.173 -1.897 -13.843 615 HA VAL 73 HA VAL 73 -14.659 -1.091 -12.785 616 HB VAL 73 HB VAL 73 -16.712 0.515 -14.322 617 HG11 VAL 73 HG11 VAL 73 -15.294 2.094 -13.317 618 HG12 VAL 73 HG12 VAL 73 -14.655 1.879 -14.947 619 HG13 VAL 73 HG13 VAL 73 -13.861 1.098 -13.579 620 HG21 VAL 73 HG21 VAL 73 -14.928 -1.588 -15.117 621 HG22 VAL 73 HG22 VAL 73 -14.488 -0.084 -15.924 622 HG23 VAL 73 HG23 VAL 73 -16.126 -0.717 -16.076 623 H ARG 74 HN ARG 74 -14.210 -0.028 -10.989 624 HA ARG 74 HA ARG 74 -16.403 1.225 -9.471 625 HB2 ARG 74 HB2 ARG 74 -15.389 -0.526 -8.202 626 HB3 ARG 74 HB1 ARG 74 -13.773 0.018 -8.617 627 HG2 ARG 74 HG2 ARG 74 -14.251 0.566 -6.328 628 HG3 ARG 74 HG1 ARG 74 -14.134 2.049 -7.275 629 HD2 ARG 74 HD2 ARG 74 -16.010 2.208 -5.763 630 HD3 ARG 74 HD1 ARG 74 -16.602 2.107 -7.420 631 HE ARG 74 HE ARG 74 -16.495 -0.468 -6.262 632 HH11 ARG 74 HH11 ARG 74 -18.316 2.497 -6.157 633 HH12 ARG 74 HH12 ARG 74 -19.792 1.731 -5.675 634 HH21 ARG 74 HH21 ARG 74 -18.429 -1.495 -5.626 635 HH22 ARG 74 HH22 ARG 74 -19.856 -0.548 -5.371 636 H ARG 75 HN ARG 75 -16.491 3.357 -9.538 637 HA ARG 75 HA ARG 75 -14.035 4.827 -10.151 638 HB2 ARG 75 HB2 ARG 75 -16.933 5.603 -10.381 639 HB3 ARG 75 HB1 ARG 75 -15.613 6.749 -10.553 640 HG2 ARG 75 HG2 ARG 75 -14.722 5.336 -12.400 641 HG3 ARG 75 HG1 ARG 75 -16.205 4.380 -12.302 642 HD2 ARG 75 HD2 ARG 75 -16.086 7.350 -12.793 643 HD3 ARG 75 HD1 ARG 75 -16.265 6.133 -14.055 644 HE ARG 75 HE ARG 75 -18.283 6.996 -12.154 645 HH11 ARG 75 HH11 ARG 75 -17.330 4.674 -14.572 646 HH12 ARG 75 HH12 ARG 75 -18.947 4.128 -14.874 647 HH21 ARG 75 HH21 ARG 75 -20.413 6.287 -12.539 648 HH22 ARG 75 HH22 ARG 75 -20.704 5.049 -13.715 649 H ILE 76 HN ILE 76 -13.026 5.848 -8.642 650 HA ILE 76 HA ILE 76 -14.390 6.452 -6.106 651 HB ILE 76 HB ILE 76 -11.435 6.281 -6.696 652 HG12 ILE 76 HG12 ILE 76 -13.239 4.364 -5.199 653 HG13 ILE 76 HG11 ILE 76 -12.638 4.114 -6.837 654 HG21 ILE 76 HG21 ILE 76 -11.356 6.180 -4.132 655 HG22 ILE 76 HG22 ILE 76 -12.989 6.843 -4.187 656 HG23 ILE 76 HG23 ILE 76 -11.646 7.751 -4.882 657 HD11 ILE 76 HD11 ILE 76 -11.455 2.984 -4.851 658 HD12 ILE 76 HD12 ILE 76 -10.732 4.574 -4.606 659 HD13 ILE 76 HD13 ILE 76 -10.495 3.724 -6.133 660 H ILE 77 HN ILE 77 -14.999 8.540 -5.871 661 HA ILE 77 HA ILE 77 -13.407 10.612 -7.236 662 HB ILE 77 HB ILE 77 -16.349 10.721 -6.572 663 HG12 ILE 77 HG12 ILE 77 -15.900 9.157 -8.406 664 HG13 ILE 77 HG11 ILE 77 -16.710 10.600 -9.005 665 HG21 ILE 77 HG21 ILE 77 -16.407 12.877 -7.237 666 HG22 ILE 77 HG22 ILE 77 -15.172 12.641 -8.474 667 HG23 ILE 77 HG23 ILE 77 -14.702 12.846 -6.786 668 HD11 ILE 77 HD11 ILE 77 -15.075 10.190 -10.591 669 HD12 ILE 77 HD12 ILE 77 -13.874 9.738 -9.381 670 HD13 ILE 77 HD13 ILE 77 -14.341 11.429 -9.571 671 H GLY 78 HN GLY 78 -12.434 12.060 -5.966 672 HA2 GLY 78 HA2 GLY 78 -13.472 13.375 -3.778 673 HA3 GLY 78 HA1 GLY 78 -12.688 11.940 -3.129 674 H ASP 79 HN ASP 79 -11.369 13.675 -2.050 675 HA ASP 79 HA ASP 79 -9.467 15.058 -3.740 676 HB2 ASP 79 HB2 ASP 79 -10.323 16.102 -1.651 677 HB3 ASP 79 HB1 ASP 79 -9.553 14.823 -0.719 678 H LEU 80 HN LEU 80 -8.070 13.706 -4.718 679 HA LEU 80 HA LEU 80 -6.947 11.461 -3.256 680 HB2 LEU 80 HB2 LEU 80 -6.529 12.357 -6.111 681 HB3 LEU 80 HB1 LEU 80 -5.892 10.882 -5.414 682 HG LEU 80 HG LEU 80 -8.827 11.520 -5.744 683 HD11 LEU 80 HD11 LEU 80 -7.122 10.903 -7.743 684 HD12 LEU 80 HD12 LEU 80 -8.823 10.435 -7.716 685 HD13 LEU 80 HD13 LEU 80 -7.584 9.288 -7.205 686 HD21 LEU 80 HD21 LEU 80 -9.057 9.068 -5.233 687 HD22 LEU 80 HD22 LEU 80 -8.565 10.076 -3.872 688 HD23 LEU 80 HD23 LEU 80 -7.371 9.090 -4.717 689 H SER 81 HN SER 81 -6.168 14.656 -3.443 690 HA SER 81 HA SER 81 -3.360 14.542 -3.866 691 HB2 SER 81 HB2 SER 81 -5.018 16.588 -2.359 692 HB3 SER 81 HB1 SER 81 -3.327 16.794 -2.821 693 HG SER 81 HG SER 81 -5.580 17.101 -4.315 694 H ASN 82 HN ASN 82 -5.407 13.824 -1.205 695 HA ASN 82 HA ASN 82 -3.300 13.882 0.775 696 HB2 ASN 82 HB2 ASN 82 -5.634 14.458 1.376 697 HB3 ASN 82 HB1 ASN 82 -6.119 12.820 0.966 698 HD21 ASN 82 HD21 ASN 82 -6.864 13.370 3.323 699 HD22 ASN 82 HD22 ASN 82 -5.818 12.768 4.559 700 H ARG 83 HN ARG 83 -1.887 12.307 0.966 701 HA ARG 83 HA ARG 83 -1.975 9.950 -0.512 702 HB2 ARG 83 HB2 ARG 83 -0.315 10.689 1.903 703 HB3 ARG 83 HB1 ARG 83 -0.090 9.182 1.027 704 HG2 ARG 83 HG2 ARG 83 0.311 10.555 -1.036 705 HG3 ARG 83 HG1 ARG 83 0.321 11.979 0.004 706 HD2 ARG 83 HD2 ARG 83 2.144 9.598 0.319 707 HD3 ARG 83 HD1 ARG 83 2.587 11.104 -0.482 708 HE ARG 83 HE ARG 83 2.286 10.658 2.371 709 HH11 ARG 83 HH11 ARG 83 2.649 12.964 -0.217 710 HH12 ARG 83 HH12 ARG 83 3.219 14.232 0.816 711 HH21 ARG 83 HH21 ARG 83 3.033 12.317 3.741 712 HH22 ARG 83 HH22 ARG 83 3.438 13.863 3.074 713 H GLU 84 HN GLU 84 -3.035 10.565 2.799 714 HA GLU 84 HA GLU 84 -3.366 7.906 3.623 715 HB2 GLU 84 HB2 GLU 84 -4.456 10.527 4.454 716 HB3 GLU 84 HB1 GLU 84 -5.357 9.100 4.956 717 HG2 GLU 84 HG2 GLU 84 -3.416 8.197 6.046 718 HG3 GLU 84 HG1 GLU 84 -2.419 9.526 5.452 719 H LYS 85 HN LYS 85 -5.716 10.043 1.943 720 HA LYS 85 HA LYS 85 -7.762 8.084 1.959 721 HB2 LYS 85 HB2 LYS 85 -7.313 10.480 0.164 722 HB3 LYS 85 HB1 LYS 85 -8.717 9.432 0.006 723 HG2 LYS 85 HG2 LYS 85 -9.398 10.004 2.280 724 HG3 LYS 85 HG1 LYS 85 -7.993 11.058 2.436 725 HD2 LYS 85 HD2 LYS 85 -8.817 12.368 0.491 726 HD3 LYS 85 HD1 LYS 85 -10.251 11.345 0.455 727 HE2 LYS 85 HE2 LYS 85 -9.402 13.066 2.783 728 HE3 LYS 85 HE1 LYS 85 -10.658 13.475 1.617 729 HZ1 LYS 85 HZ1 LYS 85 -10.730 11.609 3.837 730 HZ2 LYS 85 HZ2 LYS 85 -11.493 11.083 2.423 731 HZ3 LYS 85 HZ3 LYS 85 -11.975 12.530 3.155 732 H VAL 86 HN VAL 86 -5.230 8.812 -0.380 733 HA VAL 86 HA VAL 86 -6.072 6.980 -2.341 734 HB VAL 86 HB VAL 86 -3.302 8.028 -1.712 735 HG11 VAL 86 HG11 VAL 86 -3.099 7.262 -4.262 736 HG12 VAL 86 HG12 VAL 86 -4.226 6.029 -3.695 737 HG13 VAL 86 HG13 VAL 86 -2.655 6.212 -2.917 738 HG21 VAL 86 HG21 VAL 86 -4.088 9.018 -4.128 739 HG22 VAL 86 HG22 VAL 86 -4.258 9.861 -2.587 740 HG23 VAL 86 HG23 VAL 86 -5.616 8.955 -3.251 741 H LEU 87 HN LEU 87 -3.925 6.593 0.457 742 HA LEU 87 HA LEU 87 -3.301 3.864 -0.047 743 HB2 LEU 87 HB2 LEU 87 -2.850 5.818 2.073 744 HB3 LEU 87 HB1 LEU 87 -3.108 4.200 2.693 745 HG LEU 87 HG LEU 87 -1.065 4.810 0.568 746 HD11 LEU 87 HD11 LEU 87 -1.001 5.761 3.182 747 HD12 LEU 87 HD12 LEU 87 0.366 5.607 2.077 748 HD13 LEU 87 HD13 LEU 87 -0.001 4.307 3.210 749 HD21 LEU 87 HD21 LEU 87 -0.548 2.631 0.674 750 HD22 LEU 87 HD22 LEU 87 -2.116 2.427 1.457 751 HD23 LEU 87 HD23 LEU 87 -0.656 2.599 2.434 752 H ILE 88 HN ILE 88 -5.754 5.405 2.014 753 HA ILE 88 HA ILE 88 -6.740 3.022 3.132 754 HB ILE 88 HB ILE 88 -8.035 5.704 2.703 755 HG12 ILE 88 HG12 ILE 88 -7.148 4.330 5.244 756 HG13 ILE 88 HG11 ILE 88 -6.093 5.377 4.303 757 HG21 ILE 88 HG21 ILE 88 -9.735 4.865 4.393 758 HG22 ILE 88 HG22 ILE 88 -9.165 3.240 4.010 759 HG23 ILE 88 HG23 ILE 88 -9.888 4.239 2.749 760 HD11 ILE 88 HD11 ILE 88 -6.843 7.016 5.588 761 HD12 ILE 88 HD12 ILE 88 -8.195 6.047 6.180 762 HD13 ILE 88 HD13 ILE 88 -8.335 6.914 4.651 763 H ALA 89 HN ALA 89 -7.834 4.842 0.261 764 HA ALA 89 HA ALA 89 -9.941 3.076 -0.401 765 HB1 ALA 89 HB1 ALA 89 -8.835 5.455 -1.463 766 HB2 ALA 89 HB2 ALA 89 -10.364 4.680 -1.878 767 HB3 ALA 89 HB3 ALA 89 -8.898 4.270 -2.768 768 H LEU 90 HN LEU 90 -6.542 3.157 -1.386 769 HA LEU 90 HA LEU 90 -6.745 1.013 -3.247 770 HB2 LEU 90 HB2 LEU 90 -4.559 2.557 -1.991 771 HB3 LEU 90 HB1 LEU 90 -4.137 0.945 -2.531 772 HG LEU 90 HG LEU 90 -4.607 1.462 -4.792 773 HD11 LEU 90 HD11 LEU 90 -6.613 2.633 -4.825 774 HD12 LEU 90 HD12 LEU 90 -5.438 3.845 -5.338 775 HD13 LEU 90 HD13 LEU 90 -6.038 3.845 -3.680 776 HD21 LEU 90 HD21 LEU 90 -3.050 3.181 -5.246 777 HD22 LEU 90 HD22 LEU 90 -2.520 2.419 -3.746 778 HD23 LEU 90 HD23 LEU 90 -3.361 3.970 -3.700 779 H ARG 91 HN ARG 91 -6.010 1.189 0.204 780 HA ARG 91 HA ARG 91 -5.155 -1.482 0.588 781 HB2 ARG 91 HB2 ARG 91 -4.835 0.331 2.239 782 HB3 ARG 91 HB1 ARG 91 -6.571 0.372 2.512 783 HG2 ARG 91 HG2 ARG 91 -6.521 -1.880 3.398 784 HG3 ARG 91 HG1 ARG 91 -4.795 -2.001 3.047 785 HD2 ARG 91 HD2 ARG 91 -5.099 -1.511 5.387 786 HD3 ARG 91 HD1 ARG 91 -4.388 -0.111 4.585 787 HE ARG 91 HE ARG 91 -7.210 0.115 4.664 788 HH11 ARG 91 HH11 ARG 91 -4.379 0.358 6.677 789 HH12 ARG 91 HH12 ARG 91 -5.098 1.479 7.784 790 HH21 ARG 91 HH21 ARG 91 -8.174 1.589 6.111 791 HH22 ARG 91 HH22 ARG 91 -7.264 2.180 7.461 792 H LEU 92 HN LEU 92 -8.351 0.051 0.874 793 HA LEU 92 HA LEU 92 -9.741 -2.286 1.626 794 HB2 LEU 92 HB2 LEU 92 -10.669 0.260 0.302 795 HB3 LEU 92 HB1 LEU 92 -11.767 -1.013 0.798 796 HG LEU 92 HG LEU 92 -9.921 0.448 2.687 797 HD11 LEU 92 HD11 LEU 92 -11.424 2.090 1.939 798 HD12 LEU 92 HD12 LEU 92 -12.106 1.497 3.454 799 HD13 LEU 92 HD13 LEU 92 -12.779 0.961 1.915 800 HD21 LEU 92 HD21 LEU 92 -12.071 -1.614 3.016 801 HD22 LEU 92 HD22 LEU 92 -11.685 -0.493 4.321 802 HD23 LEU 92 HD23 LEU 92 -10.444 -1.579 3.697 803 H LEU 93 HN LEU 93 -9.033 -0.875 -1.532 804 HA LEU 93 HA LEU 93 -10.663 -2.626 -3.047 805 HB2 LEU 93 HB2 LEU 93 -8.219 -1.026 -3.775 806 HB3 LEU 93 HB1 LEU 93 -9.117 -1.975 -4.944 807 HG LEU 93 HG LEU 93 -10.299 0.287 -3.329 808 HD11 LEU 93 HD11 LEU 93 -10.272 1.178 -5.866 809 HD12 LEU 93 HD12 LEU 93 -8.785 0.231 -5.857 810 HD13 LEU 93 HD13 LEU 93 -9.007 1.535 -4.691 811 HD21 LEU 93 HD21 LEU 93 -11.448 -1.780 -4.940 812 HD22 LEU 93 HD22 LEU 93 -11.706 -0.218 -5.717 813 HD23 LEU 93 HD23 LEU 93 -12.251 -0.480 -4.060 814 H ALA 94 HN ALA 94 -7.276 -2.781 -2.029 815 HA ALA 94 HA ALA 94 -6.582 -5.090 -3.483 816 HB1 ALA 94 HB1 ALA 94 -5.057 -3.406 -2.265 817 HB2 ALA 94 HB2 ALA 94 -4.581 -5.104 -2.297 818 HB3 ALA 94 HB3 ALA 94 -5.325 -4.424 -0.849 819 H GLU 95 HN GLU 95 -7.980 -4.680 -0.270 820 HA GLU 95 HA GLU 95 -7.758 -7.346 0.591 821 HB2 GLU 95 HB2 GLU 95 -9.715 -5.154 1.284 822 HB3 GLU 95 HB1 GLU 95 -9.713 -6.720 2.083 823 HG2 GLU 95 HG2 GLU 95 -7.520 -6.346 2.959 824 HG3 GLU 95 HG1 GLU 95 -7.336 -4.876 2.001 825 H GLU 96 HN GLU 96 -10.177 -5.666 -1.322 826 HA GLU 96 HA GLU 96 -12.139 -7.677 -1.414 827 HB2 GLU 96 HB2 GLU 96 -11.401 -5.489 -3.371 828 HB3 GLU 96 HB1 GLU 96 -12.810 -6.525 -3.569 829 HG2 GLU 96 HG2 GLU 96 -12.297 -4.662 -1.257 830 HG3 GLU 96 HG1 GLU 96 -13.418 -4.384 -2.589 831 H ILE 97 HN ILE 97 -9.305 -7.042 -3.398 832 HA ILE 97 HA ILE 97 -9.775 -9.016 -5.375 833 HB ILE 97 HB ILE 97 -7.194 -7.729 -4.476 834 HG12 ILE 97 HG12 ILE 97 -8.910 -7.083 -6.868 835 HG13 ILE 97 HG11 ILE 97 -9.076 -6.260 -5.318 836 HG21 ILE 97 HG21 ILE 97 -6.089 -8.678 -6.232 837 HG22 ILE 97 HG22 ILE 97 -7.546 -8.813 -7.216 838 HG23 ILE 97 HG23 ILE 97 -7.252 -9.967 -5.915 839 HD11 ILE 97 HD11 ILE 97 -6.390 -6.392 -6.535 840 HD12 ILE 97 HD12 ILE 97 -7.137 -5.139 -5.544 841 HD13 ILE 97 HD13 ILE 97 -7.582 -5.303 -7.242 842 H GLY 98 HN GLY 98 -7.847 -8.980 -2.398 843 HA2 GLY 98 HA2 GLY 98 -6.712 -11.542 -2.647 844 HA3 GLY 98 HA1 GLY 98 -6.930 -10.667 -1.138 845 H ASP 99 HN ASP 99 -9.807 -10.505 -1.317 846 HA ASP 99 HA ASP 99 -10.417 -13.251 -0.503 847 HB2 ASP 99 HB2 ASP 99 -10.902 -11.110 0.903 848 HB3 ASP 99 HB1 ASP 99 -12.288 -10.926 -0.166 849 H TYR 100 HN TYR 100 -10.346 -12.083 -3.358 850 HA TYR 100 HA TYR 100 -13.100 -12.539 -4.185 851 HB2 TYR 100 HB2 TYR 100 -11.912 -10.631 -5.166 852 HB3 TYR 100 HB1 TYR 100 -10.662 -11.708 -5.778 853 HD1 TYR 100 HD1 TYR 100 -14.288 -10.933 -6.057 854 HD2 TYR 100 HD2 TYR 100 -10.880 -12.700 -7.893 855 HE1 TYR 100 HE1 TYR 100 -15.559 -11.203 -8.144 856 HE2 TYR 100 HE2 TYR 100 -12.143 -12.976 -9.985 857 HH TYR 100 HH TYR 100 -15.326 -12.916 -10.231 858 H LYS 101 HN LYS 101 -13.746 -14.496 -4.684 859 HA LYS 101 HA LYS 101 -11.766 -16.466 -5.611 860 HB2 LYS 101 HB2 LYS 101 -14.403 -16.889 -4.192 861 HB3 LYS 101 HB1 LYS 101 -13.391 -18.184 -4.813 862 HG2 LYS 101 HG2 LYS 101 -11.592 -17.507 -3.300 863 HG3 LYS 101 HG1 LYS 101 -12.610 -16.207 -2.677 864 HD2 LYS 101 HD2 LYS 101 -14.239 -17.861 -1.897 865 HD3 LYS 101 HD1 LYS 101 -13.220 -19.159 -2.521 866 HE2 LYS 101 HE2 LYS 101 -11.430 -18.487 -0.996 867 HE3 LYS 101 HE1 LYS 101 -12.443 -17.183 -0.378 868 HZ1 LYS 101 HZ1 LYS 101 -12.464 -19.979 0.271 869 HZ2 LYS 101 HZ2 LYS 101 -14.005 -19.380 -0.089 870 HZ3 LYS 101 HZ3 LYS 101 -13.086 -18.664 1.136 871 H ASP 102 HN ASP 102 -12.160 -17.668 -7.436 872 HA ASP 102 HA ASP 102 -13.744 -16.528 -9.464 873 HB2 ASP 102 HB2 ASP 102 -11.735 -17.893 -9.914 874 HB3 ASP 102 HB1 ASP 102 -12.588 -19.323 -9.343 875 H ASP 103 HN ASP 103 -14.278 -19.352 -7.394 876 HA ASP 103 HA ASP 103 -16.903 -19.785 -8.589 877 HB2 ASP 103 HB2 ASP 103 -15.456 -21.738 -8.083 878 HB3 ASP 103 HB1 ASP 103 -15.518 -21.317 -6.374 879 H ASP 104 HN ASP 104 -18.355 -18.328 -7.908 880 HA ASP 104 HA ASP 104 -18.369 -17.134 -5.335 881 HB2 ASP 104 HB2 ASP 104 -19.413 -16.211 -7.473 882 HB3 ASP 104 HB1 ASP 104 -20.749 -17.321 -7.183 883 H ASP 105 HN ASP 105 -19.810 -20.010 -6.652 884 HA ASP 105 HA ASP 105 -20.906 -21.768 -5.727 885 HB2 ASP 105 HB2 ASP 105 -19.177 -21.032 -3.772 886 HB3 ASP 105 HB1 ASP 105 -20.707 -20.830 -2.927 887 H LYS 106 HN LYS 106 -22.713 -22.167 -3.815 888 HA LYS 106 HA LYS 106 -24.725 -20.059 -4.269 889 HB2 LYS 106 HB2 LYS 106 -24.987 -22.453 -5.309 890 HB3 LYS 106 HB1 LYS 106 -25.466 -22.905 -3.679 891 HG2 LYS 106 HG2 LYS 106 -27.295 -21.336 -3.730 892 HG3 LYS 106 HG1 LYS 106 -26.773 -20.732 -5.305 893 HD2 LYS 106 HD2 LYS 106 -28.576 -22.224 -5.708 894 HD3 LYS 106 HD1 LYS 106 -27.102 -23.069 -6.187 895 HE2 LYS 106 HE2 LYS 106 -27.091 -24.290 -4.089 896 HE3 LYS 106 HE1 LYS 106 -28.509 -23.398 -3.538 897 HZ1 LYS 106 HZ1 LYS 106 -28.550 -25.035 -6.002 898 HZ2 LYS 106 HZ2 LYS 106 -29.862 -24.459 -5.104 899 HZ3 LYS 106 HZ3 LYS 106 -28.892 -25.698 -4.483 Start of MODEL 9 1 H1 MET 1 HT1 MET 1 5.068 -9.704 -19.805 2 H2 MET 1 HT2 MET 1 4.310 -8.743 -18.637 3 H3 MET 1 HT3 MET 1 5.689 -8.176 -19.432 4 HA MET 1 HA MET 1 3.786 -7.087 -20.340 5 HB2 MET 1 HB2 MET 1 4.846 -9.224 -22.204 6 HB3 MET 1 HB1 MET 1 4.015 -7.758 -22.706 7 HG2 MET 1 HG2 MET 1 5.810 -6.402 -21.792 8 HG3 MET 1 HG1 MET 1 6.635 -7.854 -21.227 9 HE1 MET 1 HE1 MET 1 9.033 -7.441 -22.713 10 HE2 MET 1 HE2 MET 1 8.186 -5.896 -22.620 11 HE3 MET 1 HE3 MET 1 8.833 -6.457 -24.162 12 H ALA 2 HN ALA 2 3.203 -10.138 -19.288 13 HA ALA 2 HA ALA 2 0.644 -10.378 -20.717 14 HB1 ALA 2 HB1 ALA 2 2.436 -12.291 -20.538 15 HB2 ALA 2 HB2 ALA 2 0.714 -12.655 -20.429 16 HB3 ALA 2 HB3 ALA 2 1.686 -12.550 -18.963 17 HA PRO 3 HA PRO 3 -1.100 -8.692 -16.898 18 HB2 PRO 3 HB2 PRO 3 -3.594 -9.306 -18.398 19 HB3 PRO 3 HB1 PRO 3 -3.096 -7.802 -17.615 20 HG2 PRO 3 HG2 PRO 3 -3.034 -8.000 -20.257 21 HG3 PRO 3 HG1 PRO 3 -1.715 -7.185 -19.392 22 HD2 PRO 3 HD2 PRO 3 -1.797 -9.959 -20.540 23 HD3 PRO 3 HD1 PRO 3 -0.495 -8.750 -20.612 24 H LEU 4 HN LEU 4 -1.966 -9.605 -15.104 25 HA LEU 4 HA LEU 4 -2.789 -12.424 -15.320 26 HB2 LEU 4 HB2 LEU 4 -1.520 -11.041 -12.953 27 HB3 LEU 4 HB1 LEU 4 -1.927 -12.743 -13.063 28 HG LEU 4 HG LEU 4 0.174 -11.316 -14.697 29 HD11 LEU 4 HD11 LEU 4 1.785 -12.304 -13.367 30 HD12 LEU 4 HD12 LEU 4 0.670 -13.516 -12.733 31 HD13 LEU 4 HD13 LEU 4 0.552 -11.841 -12.196 32 HD21 LEU 4 HD21 LEU 4 -0.535 -12.974 -16.129 33 HD22 LEU 4 HD22 LEU 4 -0.950 -14.081 -14.817 34 HD23 LEU 4 HD23 LEU 4 0.741 -13.796 -15.228 35 H ARG 5 HN ARG 5 -4.518 -13.136 -14.030 36 HA ARG 5 HA ARG 5 -6.649 -11.333 -13.717 37 HB2 ARG 5 HB2 ARG 5 -6.203 -14.151 -12.768 38 HB3 ARG 5 HB1 ARG 5 -7.669 -13.274 -12.360 39 HG2 ARG 5 HG2 ARG 5 -8.311 -14.440 -14.236 40 HG3 ARG 5 HG1 ARG 5 -7.844 -12.882 -14.919 41 HD2 ARG 5 HD2 ARG 5 -5.680 -13.776 -15.552 42 HD3 ARG 5 HD1 ARG 5 -6.065 -15.315 -14.785 43 HE ARG 5 HE ARG 5 -7.010 -14.352 -17.346 44 HH11 ARG 5 HH11 ARG 5 -7.431 -16.662 -14.769 45 HH12 ARG 5 HH12 ARG 5 -8.301 -17.794 -15.749 46 HH21 ARG 5 HH21 ARG 5 -8.153 -15.831 -18.645 47 HH22 ARG 5 HH22 ARG 5 -8.712 -17.321 -17.959 48 H LYS 6 HN LYS 6 -4.319 -12.615 -11.416 49 HA LYS 6 HA LYS 6 -5.529 -11.708 -9.053 50 HB2 LYS 6 HB2 LYS 6 -2.652 -12.286 -9.729 51 HB3 LYS 6 HB1 LYS 6 -3.174 -11.833 -8.114 52 HG2 LYS 6 HG2 LYS 6 -4.282 -14.198 -9.604 53 HG3 LYS 6 HG1 LYS 6 -2.896 -14.292 -8.517 54 HD2 LYS 6 HD2 LYS 6 -5.223 -12.937 -7.367 55 HD3 LYS 6 HD1 LYS 6 -5.507 -14.629 -7.775 56 HE2 LYS 6 HE2 LYS 6 -3.194 -13.623 -6.121 57 HE3 LYS 6 HE1 LYS 6 -4.688 -14.281 -5.455 58 HZ1 LYS 6 HZ1 LYS 6 -3.611 -16.218 -5.530 59 HZ2 LYS 6 HZ2 LYS 6 -2.432 -15.652 -6.599 60 HZ3 LYS 6 HZ3 LYS 6 -3.919 -16.200 -7.197 61 H THR 7 HN THR 7 -3.326 -10.121 -11.269 62 HA THR 7 HA THR 7 -3.020 -7.812 -9.582 63 HB THR 7 HB THR 7 -2.049 -6.843 -11.815 64 HG1 THR 7 HG1 THR 7 -2.978 -8.819 -12.932 65 HG21 THR 7 HG21 THR 7 -0.958 -8.417 -9.708 66 HG22 THR 7 HG22 THR 7 -0.168 -7.174 -10.682 67 HG23 THR 7 HG23 THR 7 -0.148 -8.858 -11.212 68 H ALA 8 HN ALA 8 -4.351 -6.183 -9.430 69 HA ALA 8 HA ALA 8 -6.594 -5.931 -11.250 70 HB1 ALA 8 HB1 ALA 8 -5.940 -4.197 -8.878 71 HB2 ALA 8 HB2 ALA 8 -6.803 -5.731 -8.758 72 HB3 ALA 8 HB3 ALA 8 -7.500 -4.395 -9.677 73 H VAL 9 HN VAL 9 -7.131 -3.999 -12.364 74 HA VAL 9 HA VAL 9 -4.757 -2.382 -13.020 75 HB VAL 9 HB VAL 9 -7.105 -3.031 -14.798 76 HG11 VAL 9 HG11 VAL 9 -6.467 -0.947 -15.570 77 HG12 VAL 9 HG12 VAL 9 -5.410 -1.995 -16.516 78 HG13 VAL 9 HG13 VAL 9 -4.783 -1.166 -15.091 79 HG21 VAL 9 HG21 VAL 9 -5.838 -4.617 -15.830 80 HG22 VAL 9 HG22 VAL 9 -5.147 -4.731 -14.211 81 HG23 VAL 9 HG23 VAL 9 -4.319 -3.801 -15.461 82 H LEU 10 HN LEU 10 -4.884 -0.289 -12.619 83 HA LEU 10 HA LEU 10 -7.525 0.933 -12.088 84 HB2 LEU 10 HB2 LEU 10 -4.861 1.361 -10.785 85 HB3 LEU 10 HB1 LEU 10 -6.066 2.627 -10.780 86 HG LEU 10 HG LEU 10 -6.610 -0.116 -9.658 87 HD11 LEU 10 HD11 LEU 10 -4.905 0.505 -8.257 88 HD12 LEU 10 HD12 LEU 10 -6.280 1.261 -7.454 89 HD13 LEU 10 HD13 LEU 10 -5.211 2.229 -8.470 90 HD21 LEU 10 HD21 LEU 10 -8.393 1.766 -10.275 91 HD22 LEU 10 HD22 LEU 10 -7.895 2.390 -8.704 92 HD23 LEU 10 HD23 LEU 10 -8.555 0.761 -8.836 93 H LYS 11 HN LYS 11 -8.011 2.792 -13.221 94 HA LYS 11 HA LYS 11 -5.847 3.772 -14.961 95 HB2 LYS 11 HB2 LYS 11 -8.801 3.575 -15.564 96 HB3 LYS 11 HB1 LYS 11 -7.689 4.550 -16.515 97 HG2 LYS 11 HG2 LYS 11 -6.397 2.536 -17.045 98 HG3 LYS 11 HG1 LYS 11 -7.551 1.568 -16.128 99 HD2 LYS 11 HD2 LYS 11 -9.341 2.256 -17.639 100 HD3 LYS 11 HD1 LYS 11 -8.201 3.254 -18.545 101 HE2 LYS 11 HE2 LYS 11 -6.917 1.258 -19.131 102 HE3 LYS 11 HE1 LYS 11 -8.049 0.259 -18.219 103 HZ1 LYS 11 HZ1 LYS 11 -8.232 1.062 -20.881 104 HZ2 LYS 11 HZ2 LYS 11 -9.487 1.831 -20.048 105 HZ3 LYS 11 HZ3 LYS 11 -9.344 0.148 -19.992 106 H LEU 12 HN LEU 12 -5.279 5.789 -14.687 107 HA LEU 12 HA LEU 12 -6.965 7.483 -12.992 108 HB2 LEU 12 HB2 LEU 12 -4.281 6.906 -12.837 109 HB3 LEU 12 HB1 LEU 12 -4.272 8.439 -13.682 110 HG LEU 12 HG LEU 12 -5.287 7.853 -10.910 111 HD11 LEU 12 HD11 LEU 12 -2.834 8.458 -11.575 112 HD12 LEU 12 HD12 LEU 12 -3.591 9.212 -10.171 113 HD13 LEU 12 HD13 LEU 12 -3.484 10.094 -11.695 114 HD21 LEU 12 HD21 LEU 12 -5.825 10.383 -10.961 115 HD22 LEU 12 HD22 LEU 12 -6.994 9.246 -11.634 116 HD23 LEU 12 HD23 LEU 12 -5.932 10.160 -12.707 117 H TYR 13 HN TYR 13 -8.070 9.151 -14.030 118 HA TYR 13 HA TYR 13 -7.241 9.793 -16.772 119 HB2 TYR 13 HB2 TYR 13 -9.787 10.398 -15.246 120 HB3 TYR 13 HB1 TYR 13 -9.480 10.822 -16.927 121 HD1 TYR 13 HD1 TYR 13 -10.326 8.131 -14.610 122 HD2 TYR 13 HD2 TYR 13 -9.404 9.075 -18.656 123 HE1 TYR 13 HE1 TYR 13 -11.189 5.939 -15.311 124 HE2 TYR 13 HE2 TYR 13 -10.265 6.884 -19.368 125 HH TYR 13 HH TYR 13 -11.392 5.043 -18.730 126 H VAL 14 HN VAL 14 -6.028 11.586 -16.994 127 HA VAL 14 HA VAL 14 -6.373 13.752 -15.020 128 HB VAL 14 HB VAL 14 -3.963 14.249 -15.234 129 HG11 VAL 14 HG11 VAL 14 -3.202 12.212 -13.906 130 HG12 VAL 14 HG12 VAL 14 -4.833 11.583 -14.146 131 HG13 VAL 14 HG13 VAL 14 -4.592 13.099 -13.273 132 HG21 VAL 14 HG21 VAL 14 -3.950 12.725 -17.439 133 HG22 VAL 14 HG22 VAL 14 -3.386 11.536 -16.265 134 HG23 VAL 14 HG23 VAL 14 -2.502 13.045 -16.484 135 H ALA 15 HN ALA 15 -5.638 15.863 -15.788 136 HA ALA 15 HA ALA 15 -6.033 16.136 -18.693 137 HB1 ALA 15 HB1 ALA 15 -7.679 17.161 -16.709 138 HB2 ALA 15 HB2 ALA 15 -7.630 17.677 -18.395 139 HB3 ALA 15 HB3 ALA 15 -6.675 18.533 -17.183 140 H GLY 16 HN GLY 16 -4.056 16.427 -19.477 141 HA2 GLY 16 HA2 GLY 16 -2.030 17.407 -19.901 142 HA3 GLY 16 HA1 GLY 16 -2.665 18.833 -19.093 143 H ASN 17 HN ASN 17 -1.173 19.481 -17.687 144 HA ASN 17 HA ASN 17 -0.161 17.495 -15.768 145 HB2 ASN 17 HB2 ASN 17 1.479 18.360 -17.675 146 HB3 ASN 17 HB1 ASN 17 1.620 19.750 -16.602 147 HD21 ASN 17 HD21 ASN 17 3.630 19.491 -15.840 148 HD22 ASN 17 HD22 ASN 17 4.173 18.111 -14.958 149 H THR 18 HN THR 18 -2.320 18.891 -15.165 150 HA THR 18 HA THR 18 -1.770 21.401 -13.893 151 HB THR 18 HB THR 18 -4.027 21.119 -12.879 152 HG1 THR 18 HG1 THR 18 -4.708 18.963 -14.429 153 HG21 THR 18 HG21 THR 18 -3.740 22.153 -15.091 154 HG22 THR 18 HG22 THR 18 -5.278 21.303 -14.949 155 HG23 THR 18 HG23 THR 18 -3.946 20.571 -15.844 156 HA PRO 19 HA PRO 19 -0.135 20.174 -10.035 157 HB2 PRO 19 HB2 PRO 19 -1.739 21.619 -8.285 158 HB3 PRO 19 HB1 PRO 19 -0.320 22.254 -9.119 159 HG2 PRO 19 HG2 PRO 19 -3.211 22.502 -9.842 160 HG3 PRO 19 HG1 PRO 19 -1.925 23.720 -9.936 161 HD2 PRO 19 HD2 PRO 19 -2.773 22.456 -12.118 162 HD3 PRO 19 HD1 PRO 19 -1.047 22.815 -11.888 163 H ASN 20 HN ASN 20 -3.655 20.142 -10.266 164 HA ASN 20 HA ASN 20 -4.084 18.380 -8.077 165 HB2 ASN 20 HB2 ASN 20 -5.823 18.842 -10.533 166 HB3 ASN 20 HB1 ASN 20 -6.305 17.912 -9.122 167 HD21 ASN 20 HD21 ASN 20 -5.903 19.167 -6.993 168 HD22 ASN 20 HD22 ASN 20 -6.489 20.792 -6.991 169 H SER 21 HN SER 21 -3.636 17.860 -11.565 170 HA SER 21 HA SER 21 -3.888 15.001 -11.495 171 HB2 SER 21 HB2 SER 21 -2.610 16.856 -13.517 172 HB3 SER 21 HB1 SER 21 -2.885 15.131 -13.763 173 HG SER 21 HG SER 21 -4.785 17.208 -13.507 174 H VAL 22 HN VAL 22 -1.129 17.219 -11.399 175 HA VAL 22 HA VAL 22 0.813 15.169 -11.451 176 HB VAL 22 HB VAL 22 0.944 18.002 -10.382 177 HG11 VAL 22 HG11 VAL 22 3.447 17.678 -10.491 178 HG12 VAL 22 HG12 VAL 22 3.128 15.945 -10.579 179 HG13 VAL 22 HG13 VAL 22 2.612 16.868 -9.163 180 HG21 VAL 22 HG21 VAL 22 1.818 16.706 -12.947 181 HG22 VAL 22 HG22 VAL 22 2.423 18.278 -12.427 182 HG23 VAL 22 HG23 VAL 22 0.699 18.050 -12.719 183 H ARG 23 HN ARG 23 -0.788 16.863 -8.808 184 HA ARG 23 HA ARG 23 0.623 15.703 -6.671 185 HB2 ARG 23 HB2 ARG 23 -1.175 17.647 -6.861 186 HB3 ARG 23 HB1 ARG 23 -2.278 16.342 -6.429 187 HG2 ARG 23 HG2 ARG 23 -1.831 16.917 -4.332 188 HG3 ARG 23 HG1 ARG 23 -0.307 16.056 -4.566 189 HD2 ARG 23 HD2 ARG 23 -0.538 18.924 -5.366 190 HD3 ARG 23 HD1 ARG 23 -0.313 18.510 -3.666 191 HE ARG 23 HE ARG 23 1.610 17.120 -5.115 192 HH11 ARG 23 HH11 ARG 23 0.767 20.424 -4.412 193 HH12 ARG 23 HH12 ARG 23 2.394 21.006 -4.537 194 HH21 ARG 23 HH21 ARG 23 3.757 17.867 -5.283 195 HH22 ARG 23 HH22 ARG 23 4.099 19.546 -5.035 196 H ALA 24 HN ALA 24 -2.462 14.846 -8.201 197 HA ALA 24 HA ALA 24 -3.020 12.621 -6.573 198 HB1 ALA 24 HB1 ALA 24 -4.504 13.929 -8.286 199 HB2 ALA 24 HB2 ALA 24 -4.825 12.232 -7.929 200 HB3 ALA 24 HB3 ALA 24 -3.958 12.674 -9.400 201 H LEU 25 HN LEU 25 -1.417 12.887 -9.719 202 HA LEU 25 HA LEU 25 -1.028 10.146 -10.200 203 HB2 LEU 25 HB2 LEU 25 -0.781 11.824 -11.940 204 HB3 LEU 25 HB1 LEU 25 0.583 12.534 -11.102 205 HG LEU 25 HG LEU 25 1.889 10.486 -11.495 206 HD11 LEU 25 HD11 LEU 25 0.391 8.723 -11.645 207 HD12 LEU 25 HD12 LEU 25 0.872 8.959 -13.325 208 HD13 LEU 25 HD13 LEU 25 -0.673 9.588 -12.755 209 HD21 LEU 25 HD21 LEU 25 2.204 10.799 -13.897 210 HD22 LEU 25 HD22 LEU 25 2.027 12.345 -13.067 211 HD23 LEU 25 HD23 LEU 25 0.677 11.678 -13.986 212 H LYS 26 HN LYS 26 1.128 12.527 -8.660 213 HA LYS 26 HA LYS 26 3.263 10.750 -8.195 214 HB2 LYS 26 HB2 LYS 26 3.468 13.203 -8.061 215 HB3 LYS 26 HB1 LYS 26 2.458 13.207 -6.623 216 HG2 LYS 26 HG2 LYS 26 4.146 11.892 -5.436 217 HG3 LYS 26 HG1 LYS 26 5.161 11.905 -6.879 218 HD2 LYS 26 HD2 LYS 26 4.237 14.389 -5.440 219 HD3 LYS 26 HD1 LYS 26 5.792 13.605 -5.157 220 HE2 LYS 26 HE2 LYS 26 4.838 14.705 -7.802 221 HE3 LYS 26 HE1 LYS 26 5.969 15.505 -6.710 222 HZ1 LYS 26 HZ1 LYS 26 6.405 13.295 -8.531 223 HZ2 LYS 26 HZ2 LYS 26 7.139 13.127 -7.016 224 HZ3 LYS 26 HZ3 LYS 26 7.486 14.474 -7.978 225 H THR 27 HN THR 27 0.487 11.678 -6.194 226 HA THR 27 HA THR 27 1.180 10.245 -3.871 227 HB THR 27 HB THR 27 -1.532 11.060 -4.929 228 HG1 THR 27 HG1 THR 27 -0.407 12.906 -4.586 229 HG21 THR 27 HG21 THR 27 -0.653 9.857 -2.354 230 HG22 THR 27 HG22 THR 27 -2.153 9.632 -3.253 231 HG23 THR 27 HG23 THR 27 -1.900 11.105 -2.315 232 H LEU 28 HN LEU 28 -0.968 9.364 -6.589 233 HA LEU 28 HA LEU 28 -1.650 6.834 -5.520 234 HB2 LEU 28 HB2 LEU 28 -3.040 7.977 -7.151 235 HB3 LEU 28 HB1 LEU 28 -1.775 7.850 -8.357 236 HG LEU 28 HG LEU 28 -2.006 5.385 -8.308 237 HD11 LEU 28 HD11 LEU 28 -4.277 5.987 -6.423 238 HD12 LEU 28 HD12 LEU 28 -2.835 5.025 -6.090 239 HD13 LEU 28 HD13 LEU 28 -4.042 4.441 -7.236 240 HD21 LEU 28 HD21 LEU 28 -4.006 5.288 -9.594 241 HD22 LEU 28 HD22 LEU 28 -3.250 6.851 -9.903 242 HD23 LEU 28 HD23 LEU 28 -4.640 6.742 -8.823 243 H ALA 29 HN ALA 29 0.755 7.801 -7.994 244 HA ALA 29 HA ALA 29 1.543 5.206 -8.717 245 HB1 ALA 29 HB1 ALA 29 2.390 7.903 -9.267 246 HB2 ALA 29 HB2 ALA 29 2.504 6.455 -10.269 247 HB3 ALA 29 HB3 ALA 29 3.772 6.821 -9.097 248 H ASN 30 HN ASN 30 2.852 7.389 -6.222 249 HA ASN 30 HA ASN 30 5.095 5.749 -5.588 250 HB2 ASN 30 HB2 ASN 30 4.768 8.195 -4.943 251 HB3 ASN 30 HB1 ASN 30 3.678 7.625 -3.683 252 HD21 ASN 30 HD21 ASN 30 4.825 8.124 -1.906 253 HD22 ASN 30 HD22 ASN 30 6.389 7.490 -1.541 254 H ILE 31 HN ILE 31 1.829 5.918 -4.289 255 HA ILE 31 HA ILE 31 2.242 4.046 -2.245 256 HB ILE 31 HB ILE 31 -0.248 4.999 -3.612 257 HG12 ILE 31 HG12 ILE 31 0.771 5.338 -0.788 258 HG13 ILE 31 HG11 ILE 31 1.102 6.471 -2.095 259 HG21 ILE 31 HG21 ILE 31 -1.635 3.756 -2.201 260 HG22 ILE 31 HG22 ILE 31 -0.296 3.275 -1.157 261 HG23 ILE 31 HG23 ILE 31 -0.442 2.591 -2.778 262 HD11 ILE 31 HD11 ILE 31 -1.719 5.802 -1.602 263 HD12 ILE 31 HD12 ILE 31 -0.967 7.333 -2.046 264 HD13 ILE 31 HD13 ILE 31 -0.896 6.765 -0.379 265 H LEU 32 HN LEU 32 1.053 3.731 -5.554 266 HA LEU 32 HA LEU 32 0.601 0.944 -5.504 267 HB2 LEU 32 HB2 LEU 32 1.039 2.892 -7.747 268 HB3 LEU 32 HB1 LEU 32 0.753 1.188 -8.035 269 HG LEU 32 HG LEU 32 -1.186 2.921 -6.485 270 HD11 LEU 32 HD11 LEU 32 -1.523 2.098 -9.353 271 HD12 LEU 32 HD12 LEU 32 -0.721 3.611 -8.931 272 HD13 LEU 32 HD13 LEU 32 -2.391 3.331 -8.441 273 HD21 LEU 32 HD21 LEU 32 -2.739 1.102 -7.120 274 HD22 LEU 32 HD22 LEU 32 -1.423 0.563 -6.078 275 HD23 LEU 32 HD23 LEU 32 -1.377 0.219 -7.807 276 H GLU 33 HN GLU 33 3.499 2.825 -6.265 277 HA GLU 33 HA GLU 33 4.912 0.449 -7.178 278 HB2 GLU 33 HB2 GLU 33 5.885 3.281 -6.795 279 HB3 GLU 33 HB1 GLU 33 6.814 1.976 -7.520 280 HG2 GLU 33 HG2 GLU 33 4.188 2.955 -8.591 281 HG3 GLU 33 HG1 GLU 33 5.754 3.553 -9.133 282 H LYS 34 HN LYS 34 4.219 1.582 -4.147 283 HA LYS 34 HA LYS 34 6.667 0.322 -3.110 284 HB2 LYS 34 HB2 LYS 34 5.827 3.018 -2.724 285 HB3 LYS 34 HB1 LYS 34 5.721 2.179 -1.182 286 HG2 LYS 34 HG2 LYS 34 7.926 2.194 -0.930 287 HG3 LYS 34 HG1 LYS 34 8.183 1.543 -2.549 288 HD2 LYS 34 HD2 LYS 34 8.090 3.715 -3.520 289 HD3 LYS 34 HD1 LYS 34 7.553 4.435 -2.001 290 HE2 LYS 34 HE2 LYS 34 9.907 4.900 -2.369 291 HE3 LYS 34 HE1 LYS 34 9.701 3.844 -0.973 292 HZ1 LYS 34 HZ1 LYS 34 11.415 3.383 -2.977 293 HZ2 LYS 34 HZ2 LYS 34 10.085 2.471 -3.489 294 HZ3 LYS 34 HZ3 LYS 34 10.780 2.175 -1.975 295 H GLU 35 HN GLU 35 3.559 1.531 -1.887 296 HA GLU 35 HA GLU 35 3.350 -0.366 0.183 297 HB2 GLU 35 HB2 GLU 35 1.344 1.452 -1.147 298 HB3 GLU 35 HB1 GLU 35 0.924 0.412 0.214 299 HG2 GLU 35 HG2 GLU 35 3.021 2.577 0.221 300 HG3 GLU 35 HG1 GLU 35 1.412 2.690 0.932 301 H PHE 36 HN PHE 36 1.941 -0.326 -3.098 302 HA PHE 36 HA PHE 36 1.159 -3.129 -2.638 303 HB2 PHE 36 HB2 PHE 36 -0.361 -1.003 -4.145 304 HB3 PHE 36 HB1 PHE 36 -0.737 -2.720 -4.245 305 HD1 PHE 36 HD1 PHE 36 -0.879 0.275 -2.173 306 HD2 PHE 36 HD2 PHE 36 -1.661 -3.905 -2.331 307 HE1 PHE 36 HE1 PHE 36 -2.267 0.462 -0.151 308 HE2 PHE 36 HE2 PHE 36 -3.051 -3.723 -0.310 309 HZ PHE 36 HZ PHE 36 -3.353 -1.538 0.784 310 H LYS 37 HN LYS 37 3.635 -2.081 -3.838 311 HA LYS 37 HA LYS 37 3.600 -2.253 -6.627 312 HB2 LYS 37 HB2 LYS 37 5.503 -1.379 -5.317 313 HB3 LYS 37 HB1 LYS 37 5.851 -3.011 -4.756 314 HG2 LYS 37 HG2 LYS 37 6.333 -3.714 -7.030 315 HG3 LYS 37 HG1 LYS 37 5.929 -2.104 -7.628 316 HD2 LYS 37 HD2 LYS 37 7.766 -1.153 -6.334 317 HD3 LYS 37 HD1 LYS 37 8.156 -2.753 -5.698 318 HE2 LYS 37 HE2 LYS 37 9.653 -2.193 -7.515 319 HE3 LYS 37 HE1 LYS 37 8.607 -3.533 -7.980 320 HZ1 LYS 37 HZ1 LYS 37 7.735 -2.350 -9.634 321 HZ2 LYS 37 HZ2 LYS 37 9.007 -1.259 -9.411 322 HZ3 LYS 37 HZ3 LYS 37 7.512 -0.975 -8.673 323 H GLY 38 HN GLY 38 3.452 -3.885 -8.019 324 HA2 GLY 38 HA2 GLY 38 3.792 -6.064 -8.830 325 HA3 GLY 38 HA1 GLY 38 4.130 -6.596 -7.189 326 H VAL 39 HN VAL 39 1.460 -4.869 -6.718 327 HA VAL 39 HA VAL 39 -0.246 -7.216 -7.166 328 HB VAL 39 HB VAL 39 -0.692 -4.960 -5.193 329 HG11 VAL 39 HG11 VAL 39 -2.773 -6.004 -5.982 330 HG12 VAL 39 HG12 VAL 39 -2.466 -6.351 -4.279 331 HG13 VAL 39 HG13 VAL 39 -2.153 -7.585 -5.500 332 HG21 VAL 39 HG21 VAL 39 0.049 -6.391 -3.471 333 HG22 VAL 39 HG22 VAL 39 1.261 -6.521 -4.746 334 HG23 VAL 39 HG23 VAL 39 0.061 -7.797 -4.535 335 H TYR 40 HN TYR 40 -0.167 -3.671 -7.506 336 HA TYR 40 HA TYR 40 -2.512 -3.993 -9.232 337 HB2 TYR 40 HB2 TYR 40 -1.691 -1.726 -7.445 338 HB3 TYR 40 HB1 TYR 40 -2.710 -1.396 -8.835 339 HD1 TYR 40 HD1 TYR 40 -2.526 -3.295 -5.655 340 HD2 TYR 40 HD2 TYR 40 -5.003 -1.775 -8.759 341 HE1 TYR 40 HE1 TYR 40 -4.521 -3.790 -4.303 342 HE2 TYR 40 HE2 TYR 40 -6.996 -2.271 -7.422 343 HH TYR 40 HH TYR 40 -6.875 -2.987 -4.147 344 H ALA 41 HN ALA 41 -2.573 -3.061 -11.246 345 HA ALA 41 HA ALA 41 -0.009 -2.029 -12.254 346 HB1 ALA 41 HB1 ALA 41 -0.616 -2.802 -14.393 347 HB2 ALA 41 HB2 ALA 41 -2.319 -2.934 -13.957 348 HB3 ALA 41 HB3 ALA 41 -1.149 -4.078 -13.298 349 H LEU 42 HN LEU 42 0.128 0.099 -12.773 350 HA LEU 42 HA LEU 42 -2.334 1.649 -12.645 351 HB2 LEU 42 HB2 LEU 42 -0.553 2.362 -11.173 352 HB3 LEU 42 HB1 LEU 42 0.555 2.504 -12.522 353 HG LEU 42 HG LEU 42 -0.792 4.367 -13.423 354 HD11 LEU 42 HD11 LEU 42 -2.367 5.339 -11.511 355 HD12 LEU 42 HD12 LEU 42 -2.548 3.621 -11.157 356 HD13 LEU 42 HD13 LEU 42 -2.958 4.239 -12.757 357 HD21 LEU 42 HD21 LEU 42 0.395 5.825 -12.218 358 HD22 LEU 42 HD22 LEU 42 0.990 4.414 -11.345 359 HD23 LEU 42 HD23 LEU 42 -0.368 5.339 -10.706 360 H LYS 43 HN LYS 43 -3.242 2.632 -14.255 361 HA LYS 43 HA LYS 43 -1.802 3.040 -16.781 362 HB2 LYS 43 HB2 LYS 43 -4.229 1.500 -16.275 363 HB3 LYS 43 HB1 LYS 43 -4.511 2.805 -17.417 364 HG2 LYS 43 HG2 LYS 43 -3.971 0.887 -18.679 365 HG3 LYS 43 HG1 LYS 43 -2.566 1.950 -18.739 366 HD2 LYS 43 HD2 LYS 43 -1.426 0.621 -17.086 367 HD3 LYS 43 HD1 LYS 43 -2.865 -0.373 -16.839 368 HE2 LYS 43 HE2 LYS 43 -2.722 -1.160 -19.145 369 HE3 LYS 43 HE1 LYS 43 -1.295 -0.158 -19.406 370 HZ1 LYS 43 HZ1 LYS 43 -0.292 -1.466 -17.488 371 HZ2 LYS 43 HZ2 LYS 43 -0.468 -2.277 -18.961 372 HZ3 LYS 43 HZ3 LYS 43 -1.565 -2.562 -17.704 373 H VAL 44 HN VAL 44 -1.970 5.039 -17.571 374 HA VAL 44 HA VAL 44 -3.867 6.904 -16.270 375 HB VAL 44 HB VAL 44 -1.025 7.415 -17.148 376 HG11 VAL 44 HG11 VAL 44 -2.143 9.425 -17.621 377 HG12 VAL 44 HG12 VAL 44 -1.479 9.673 -16.006 378 HG13 VAL 44 HG13 VAL 44 -3.186 9.278 -16.206 379 HG21 VAL 44 HG21 VAL 44 -1.828 8.005 -14.393 380 HG22 VAL 44 HG22 VAL 44 -0.371 7.226 -15.012 381 HG23 VAL 44 HG23 VAL 44 -1.857 6.294 -14.823 382 H ILE 45 HN ILE 45 -5.142 8.029 -17.484 383 HA ILE 45 HA ILE 45 -4.800 7.866 -20.404 384 HB ILE 45 HB ILE 45 -7.314 8.275 -18.786 385 HG12 ILE 45 HG12 ILE 45 -6.436 6.057 -18.358 386 HG13 ILE 45 HG11 ILE 45 -7.884 5.942 -19.350 387 HG21 ILE 45 HG21 ILE 45 -7.343 9.175 -21.118 388 HG22 ILE 45 HG22 ILE 45 -8.555 7.928 -20.808 389 HG23 ILE 45 HG23 ILE 45 -7.082 7.530 -21.700 390 HD11 ILE 45 HD11 ILE 45 -6.117 4.388 -20.030 391 HD12 ILE 45 HD12 ILE 45 -5.063 5.761 -20.372 392 HD13 ILE 45 HD13 ILE 45 -6.539 5.529 -21.308 393 H ASP 46 HN ASP 46 -4.116 9.816 -21.214 394 HA ASP 46 HA ASP 46 -4.643 12.257 -19.750 395 HB2 ASP 46 HB2 ASP 46 -2.465 11.772 -20.942 396 HB3 ASP 46 HB1 ASP 46 -3.334 11.995 -22.459 397 H VAL 47 HN VAL 47 -6.715 12.920 -19.912 398 HA VAL 47 HA VAL 47 -8.376 12.407 -22.135 399 HB VAL 47 HB VAL 47 -10.029 13.827 -21.064 400 HG11 VAL 47 HG11 VAL 47 -9.433 12.700 -18.599 401 HG12 VAL 47 HG12 VAL 47 -8.622 11.648 -19.761 402 HG13 VAL 47 HG13 VAL 47 -10.355 11.949 -19.901 403 HG21 VAL 47 HG21 VAL 47 -8.489 15.625 -20.334 404 HG22 VAL 47 HG22 VAL 47 -7.884 14.555 -19.069 405 HG23 VAL 47 HG23 VAL 47 -9.569 15.077 -19.052 406 H LEU 48 HN LEU 48 -6.359 15.225 -21.393 407 HA LEU 48 HA LEU 48 -7.620 16.915 -23.308 408 HB2 LEU 48 HB2 LEU 48 -4.945 17.106 -21.953 409 HB3 LEU 48 HB1 LEU 48 -5.511 18.296 -23.111 410 HG LEU 48 HG LEU 48 -6.908 17.611 -20.522 411 HD11 LEU 48 HD11 LEU 48 -6.159 19.880 -19.840 412 HD12 LEU 48 HD12 LEU 48 -5.143 19.930 -21.282 413 HD13 LEU 48 HD13 LEU 48 -4.844 18.722 -20.033 414 HD21 LEU 48 HD21 LEU 48 -7.920 19.970 -21.226 415 HD22 LEU 48 HD22 LEU 48 -8.633 18.442 -21.744 416 HD23 LEU 48 HD23 LEU 48 -7.577 19.338 -22.836 417 H LYS 49 HN LYS 49 -4.793 14.776 -23.501 418 HA LYS 49 HA LYS 49 -4.059 15.659 -26.113 419 HB2 LYS 49 HB2 LYS 49 -3.326 13.176 -24.573 420 HB3 LYS 49 HB1 LYS 49 -2.721 13.510 -26.190 421 HG2 LYS 49 HG2 LYS 49 -1.838 15.692 -25.277 422 HG3 LYS 49 HG1 LYS 49 -2.220 15.070 -23.671 423 HD2 LYS 49 HD2 LYS 49 -0.447 13.653 -25.653 424 HD3 LYS 49 HD1 LYS 49 0.151 14.723 -24.385 425 HE2 LYS 49 HE2 LYS 49 -0.900 13.262 -22.699 426 HE3 LYS 49 HE1 LYS 49 -1.419 12.177 -23.988 427 HZ1 LYS 49 HZ1 LYS 49 0.508 11.152 -23.561 428 HZ2 LYS 49 HZ2 LYS 49 1.185 12.490 -22.780 429 HZ3 LYS 49 HZ3 LYS 49 1.214 12.393 -24.468 430 H ASN 50 HN ASN 50 -6.118 13.058 -24.913 431 HA ASN 50 HA ASN 50 -7.009 12.668 -27.694 432 HB2 ASN 50 HB2 ASN 50 -5.577 10.751 -26.726 433 HB3 ASN 50 HB1 ASN 50 -6.964 10.432 -25.683 434 HD21 ASN 50 HD21 ASN 50 -5.556 9.231 -28.232 435 HD22 ASN 50 HD22 ASN 50 -6.911 8.722 -29.177 436 HA PRO 51 HA PRO 51 -10.574 13.985 -25.172 437 HB2 PRO 51 HB2 PRO 51 -11.449 14.797 -27.894 438 HB3 PRO 51 HB1 PRO 51 -11.437 15.732 -26.394 439 HG2 PRO 51 HG2 PRO 51 -9.636 16.234 -28.282 440 HG3 PRO 51 HG1 PRO 51 -9.159 16.228 -26.572 441 HD2 PRO 51 HD2 PRO 51 -8.798 14.087 -28.640 442 HD3 PRO 51 HD1 PRO 51 -7.629 14.716 -27.455 443 H GLN 52 HN GLN 52 -10.326 12.101 -28.099 444 HA GLN 52 HA GLN 52 -12.980 11.152 -28.254 445 HB2 GLN 52 HB2 GLN 52 -10.365 9.993 -29.228 446 HB3 GLN 52 HB1 GLN 52 -11.928 9.261 -29.569 447 HG2 GLN 52 HG2 GLN 52 -12.631 11.171 -30.819 448 HG3 GLN 52 HG1 GLN 52 -11.201 12.080 -30.330 449 HE21 GLN 52 HE21 GLN 52 -12.174 11.426 -33.001 450 HE22 GLN 52 HE22 GLN 52 -10.893 10.568 -33.779 451 H LEU 53 HN LEU 53 -10.102 9.937 -26.595 452 HA LEU 53 HA LEU 53 -11.412 7.554 -25.754 453 HB2 LEU 53 HB2 LEU 53 -8.875 8.873 -24.789 454 HB3 LEU 53 HB1 LEU 53 -9.463 7.348 -24.149 455 HG LEU 53 HG LEU 53 -8.796 7.830 -27.049 456 HD11 LEU 53 HD11 LEU 53 -6.883 7.892 -25.311 457 HD12 LEU 53 HD12 LEU 53 -6.715 6.850 -26.725 458 HD13 LEU 53 HD13 LEU 53 -7.171 6.159 -25.168 459 HD21 LEU 53 HD21 LEU 53 -10.135 6.033 -27.231 460 HD22 LEU 53 HD22 LEU 53 -9.947 5.579 -25.537 461 HD23 LEU 53 HD23 LEU 53 -8.690 5.170 -26.704 462 H ALA 54 HN ALA 54 -10.941 10.761 -24.408 463 HA ALA 54 HA ALA 54 -11.876 10.229 -21.797 464 HB1 ALA 54 HB1 ALA 54 -11.998 12.562 -21.506 465 HB2 ALA 54 HB2 ALA 54 -12.204 12.846 -23.236 466 HB3 ALA 54 HB3 ALA 54 -10.647 12.301 -22.609 467 H GLU 55 HN GLU 55 -13.423 11.223 -24.795 468 HA GLU 55 HA GLU 55 -16.060 11.489 -23.761 469 HB2 GLU 55 HB2 GLU 55 -15.327 12.510 -25.897 470 HB3 GLU 55 HB1 GLU 55 -15.181 10.902 -26.596 471 HG2 GLU 55 HG2 GLU 55 -17.571 10.541 -26.304 472 HG3 GLU 55 HG1 GLU 55 -17.730 12.130 -25.563 473 H GLU 56 HN GLU 56 -14.259 8.804 -25.178 474 HA GLU 56 HA GLU 56 -16.397 7.010 -25.461 475 HB2 GLU 56 HB2 GLU 56 -13.467 6.490 -24.911 476 HB3 GLU 56 HB1 GLU 56 -14.623 5.224 -25.289 477 HG2 GLU 56 HG2 GLU 56 -15.063 6.367 -27.461 478 HG3 GLU 56 HG1 GLU 56 -13.761 7.503 -27.071 479 H ASP 57 HN ASP 57 -14.256 7.655 -22.690 480 HA ASP 57 HA ASP 57 -15.920 5.862 -21.087 481 HB2 ASP 57 HB2 ASP 57 -13.233 7.164 -20.534 482 HB3 ASP 57 HB1 ASP 57 -14.151 6.336 -19.279 483 H LYS 58 HN LYS 58 -16.365 8.777 -22.054 484 HA LYS 58 HA LYS 58 -17.423 10.650 -21.342 485 HB2 LYS 58 HB2 LYS 58 -18.664 8.621 -19.490 486 HB3 LYS 58 HB1 LYS 58 -19.277 10.253 -19.719 487 HG2 LYS 58 HG2 LYS 58 -19.635 9.783 -22.098 488 HG3 LYS 58 HG1 LYS 58 -19.033 8.142 -21.857 489 HD2 LYS 58 HD2 LYS 58 -20.858 7.721 -20.261 490 HD3 LYS 58 HD1 LYS 58 -21.471 9.351 -20.546 491 HE2 LYS 58 HE2 LYS 58 -21.190 7.193 -22.636 492 HE3 LYS 58 HE1 LYS 58 -22.693 7.651 -21.838 493 HZ1 LYS 58 HZ1 LYS 58 -22.112 9.987 -22.732 494 HZ2 LYS 58 HZ2 LYS 58 -22.777 8.845 -23.787 495 HZ3 LYS 58 HZ3 LYS 58 -21.115 9.153 -23.817 496 H ILE 59 HN ILE 59 -14.977 10.812 -20.393 497 HA ILE 59 HA ILE 59 -15.013 11.236 -17.516 498 HB ILE 59 HB ILE 59 -12.806 11.765 -19.513 499 HG12 ILE 59 HG12 ILE 59 -13.430 9.407 -19.504 500 HG13 ILE 59 HG11 ILE 59 -11.863 9.624 -18.732 501 HG21 ILE 59 HG21 ILE 59 -11.336 11.679 -17.522 502 HG22 ILE 59 HG22 ILE 59 -12.771 11.588 -16.501 503 HG23 ILE 59 HG23 ILE 59 -12.475 13.024 -17.482 504 HD11 ILE 59 HD11 ILE 59 -14.427 8.719 -17.603 505 HD12 ILE 59 HD12 ILE 59 -13.433 9.750 -16.574 506 HD13 ILE 59 HD13 ILE 59 -12.774 8.243 -17.208 507 H LEU 60 HN LEU 60 -16.038 13.028 -16.862 508 HA LEU 60 HA LEU 60 -15.623 15.521 -18.365 509 HB2 LEU 60 HB2 LEU 60 -17.774 14.817 -16.364 510 HB3 LEU 60 HB1 LEU 60 -17.636 16.347 -17.211 511 HG LEU 60 HG LEU 60 -18.144 13.671 -18.522 512 HD11 LEU 60 HD11 LEU 60 -20.388 14.559 -18.943 513 HD12 LEU 60 HD12 LEU 60 -19.994 15.994 -17.996 514 HD13 LEU 60 HD13 LEU 60 -20.055 14.414 -17.218 515 HD21 LEU 60 HD21 LEU 60 -18.750 15.254 -20.458 516 HD22 LEU 60 HD22 LEU 60 -17.045 14.947 -20.132 517 HD23 LEU 60 HD23 LEU 60 -17.791 16.452 -19.589 518 H ALA 61 HN ALA 61 -14.312 13.997 -15.803 519 HA ALA 61 HA ALA 61 -13.543 16.527 -14.561 520 HB1 ALA 61 HB1 ALA 61 -15.496 15.298 -13.332 521 HB2 ALA 61 HB2 ALA 61 -14.164 15.993 -12.408 522 HB3 ALA 61 HB3 ALA 61 -14.201 14.260 -12.734 523 H THR 62 HN THR 62 -11.537 16.489 -13.526 524 HA THR 62 HA THR 62 -9.969 14.046 -13.522 525 HB THR 62 HB THR 62 -8.047 15.234 -14.631 526 HG1 THR 62 HG1 THR 62 -9.306 17.350 -14.352 527 HG21 THR 62 HG21 THR 62 -8.794 14.881 -16.917 528 HG22 THR 62 HG22 THR 62 -10.480 14.901 -16.389 529 HG23 THR 62 HG23 THR 62 -9.410 13.597 -15.873 530 HA PRO 63 HA PRO 63 -8.041 13.440 -13.023 531 HB2 PRO 63 HB2 PRO 63 -6.886 12.318 -10.885 532 HB3 PRO 63 HB1 PRO 63 -6.071 13.553 -11.850 533 HG2 PRO 63 HG2 PRO 63 -7.446 13.807 -9.216 534 HG3 PRO 63 HG1 PRO 63 -5.945 14.563 -9.785 535 HD2 PRO 63 HD2 PRO 63 -8.404 15.816 -9.718 536 HD3 PRO 63 HD1 PRO 63 -7.059 16.293 -10.773 537 H THR 64 HN THR 64 -8.879 11.374 -12.909 538 HA THR 64 HA THR 64 -10.878 10.839 -10.820 539 HB THR 64 HB THR 64 -11.271 10.224 -13.760 540 HG1 THR 64 HG1 THR 64 -11.999 12.243 -13.659 541 HG21 THR 64 HG21 THR 64 -13.177 9.769 -11.468 542 HG22 THR 64 HG22 THR 64 -12.189 8.504 -12.202 543 HG23 THR 64 HG23 THR 64 -13.420 9.332 -13.160 544 H LEU 65 HN LEU 65 -10.703 8.883 -9.923 545 HA LEU 65 HA LEU 65 -8.710 7.003 -11.037 546 HB2 LEU 65 HB2 LEU 65 -8.175 7.870 -8.827 547 HB3 LEU 65 HB1 LEU 65 -9.744 7.368 -8.227 548 HG LEU 65 HG LEU 65 -9.124 5.009 -8.592 549 HD11 LEU 65 HD11 LEU 65 -6.456 4.857 -8.851 550 HD12 LEU 65 HD12 LEU 65 -6.776 6.274 -9.850 551 HD13 LEU 65 HD13 LEU 65 -7.573 4.742 -10.210 552 HD21 LEU 65 HD21 LEU 65 -7.417 4.877 -6.805 553 HD22 LEU 65 HD22 LEU 65 -8.750 5.963 -6.410 554 HD23 LEU 65 HD23 LEU 65 -7.197 6.622 -6.927 555 H ALA 66 HN ALA 66 -9.531 5.229 -11.982 556 HA ALA 66 HA ALA 66 -11.937 4.030 -10.794 557 HB1 ALA 66 HB1 ALA 66 -13.139 3.904 -12.763 558 HB2 ALA 66 HB2 ALA 66 -11.707 4.078 -13.776 559 HB3 ALA 66 HB3 ALA 66 -12.373 5.482 -12.937 560 H LYS 67 HN LYS 67 -11.971 1.930 -10.675 561 HA LYS 67 HA LYS 67 -9.598 0.484 -11.545 562 HB2 LYS 67 HB2 LYS 67 -10.554 0.315 -9.185 563 HB3 LYS 67 HB1 LYS 67 -11.920 -0.534 -9.889 564 HG2 LYS 67 HG2 LYS 67 -9.866 -2.002 -10.871 565 HG3 LYS 67 HG1 LYS 67 -9.197 -1.477 -9.325 566 HD2 LYS 67 HD2 LYS 67 -11.981 -2.484 -9.295 567 HD3 LYS 67 HD1 LYS 67 -10.714 -3.671 -9.605 568 HE2 LYS 67 HE2 LYS 67 -11.118 -1.940 -7.186 569 HE3 LYS 67 HE1 LYS 67 -10.992 -3.695 -7.280 570 HZ1 LYS 67 HZ1 LYS 67 -8.892 -1.684 -7.231 571 HZ2 LYS 67 HZ2 LYS 67 -8.628 -3.018 -8.237 572 HZ3 LYS 67 HZ3 LYS 67 -8.910 -3.249 -6.584 573 H VAL 68 HN VAL 68 -9.832 -0.126 -13.658 574 HA VAL 68 HA VAL 68 -12.431 -0.829 -14.676 575 HB VAL 68 HB VAL 68 -11.265 -1.250 -16.810 576 HG11 VAL 68 HG11 VAL 68 -11.067 0.976 -17.338 577 HG12 VAL 68 HG12 VAL 68 -10.252 1.371 -15.826 578 HG13 VAL 68 HG13 VAL 68 -11.988 1.064 -15.836 579 HG21 VAL 68 HG21 VAL 68 -8.733 -0.093 -15.854 580 HG22 VAL 68 HG22 VAL 68 -9.023 -1.342 -17.064 581 HG23 VAL 68 HG23 VAL 68 -9.050 -1.752 -15.349 582 H LEU 69 HN LEU 69 -9.628 -2.466 -13.442 583 HA LEU 69 HA LEU 69 -11.078 -5.010 -13.814 584 HB2 LEU 69 HB2 LEU 69 -8.140 -4.617 -14.397 585 HB3 LEU 69 HB1 LEU 69 -8.950 -6.167 -14.344 586 HG LEU 69 HG LEU 69 -9.631 -3.973 -16.306 587 HD11 LEU 69 HD11 LEU 69 -7.651 -4.547 -17.210 588 HD12 LEU 69 HD12 LEU 69 -8.553 -5.945 -17.793 589 HD13 LEU 69 HD13 LEU 69 -7.571 -6.077 -16.335 590 HD21 LEU 69 HD21 LEU 69 -10.507 -6.835 -15.997 591 HD22 LEU 69 HD22 LEU 69 -10.697 -5.932 -17.500 592 HD23 LEU 69 HD23 LEU 69 -11.508 -5.383 -16.034 593 HA PRO 70 HA PRO 70 -11.064 -7.001 -13.186 594 HB2 PRO 70 HB2 PRO 70 -12.237 -8.102 -10.772 595 HB3 PRO 70 HB1 PRO 70 -11.144 -8.879 -11.920 596 HG2 PRO 70 HG2 PRO 70 -10.413 -8.257 -9.378 597 HG3 PRO 70 HG1 PRO 70 -9.266 -8.291 -10.730 598 HD2 PRO 70 HD2 PRO 70 -10.649 -5.933 -9.480 599 HD3 PRO 70 HD1 PRO 70 -8.944 -6.114 -9.955 600 HA PRO 71 HA PRO 71 -14.949 -4.794 -13.244 601 HB2 PRO 71 HB2 PRO 71 -16.083 -7.334 -14.288 602 HB3 PRO 71 HB1 PRO 71 -16.109 -5.716 -15.001 603 HG2 PRO 71 HG2 PRO 71 -14.514 -7.588 -15.997 604 HG3 PRO 71 HG1 PRO 71 -13.949 -5.913 -15.845 605 HD2 PRO 71 HD2 PRO 71 -13.368 -8.271 -14.084 606 HD3 PRO 71 HD1 PRO 71 -12.267 -7.015 -14.683 607 HA PRO 72 HA PRO 72 -17.410 -4.434 -13.282 608 HB2 PRO 72 HB2 PRO 72 -18.429 -3.193 -10.816 609 HB3 PRO 72 HB1 PRO 72 -19.303 -3.685 -12.271 610 HG2 PRO 72 HG2 PRO 72 -19.571 -5.032 -9.975 611 HG3 PRO 72 HG1 PRO 72 -19.556 -5.869 -11.539 612 HD2 PRO 72 HD2 PRO 72 -17.328 -5.548 -9.549 613 HD3 PRO 72 HD1 PRO 72 -17.849 -7.008 -10.419 614 H VAL 73 HN VAL 73 -17.049 -2.166 -13.535 615 HA VAL 73 HA VAL 73 -14.470 -1.324 -12.647 616 HB VAL 73 HB VAL 73 -16.613 0.205 -14.144 617 HG11 VAL 73 HG11 VAL 73 -14.552 1.546 -14.908 618 HG12 VAL 73 HG12 VAL 73 -13.769 0.877 -13.475 619 HG13 VAL 73 HG13 VAL 73 -15.218 1.871 -13.307 620 HG21 VAL 73 HG21 VAL 73 -14.725 -1.846 -14.941 621 HG22 VAL 73 HG22 VAL 73 -14.522 -0.361 -15.870 622 HG23 VAL 73 HG23 VAL 73 -16.090 -1.164 -15.825 623 H ARG 74 HN ARG 74 -13.956 -0.187 -10.897 624 HA ARG 74 HA ARG 74 -16.112 1.069 -9.331 625 HB2 ARG 74 HB2 ARG 74 -15.017 -0.635 -8.060 626 HB3 ARG 74 HB1 ARG 74 -13.429 -0.053 -8.531 627 HG2 ARG 74 HG2 ARG 74 -13.872 0.534 -6.240 628 HG3 ARG 74 HG1 ARG 74 -13.810 1.995 -7.226 629 HD2 ARG 74 HD2 ARG 74 -15.656 2.142 -5.673 630 HD3 ARG 74 HD1 ARG 74 -16.280 1.998 -7.315 631 HE ARG 74 HE ARG 74 -16.093 -0.552 -6.109 632 HH11 ARG 74 HH11 ARG 74 -17.977 2.375 -6.031 633 HH12 ARG 74 HH12 ARG 74 -19.427 1.584 -5.508 634 HH21 ARG 74 HH21 ARG 74 -17.992 -1.609 -5.421 635 HH22 ARG 74 HH22 ARG 74 -19.435 -0.688 -5.159 636 H ARG 75 HN ARG 75 -16.247 3.190 -9.434 637 HA ARG 75 HA ARG 75 -13.852 4.690 -10.197 638 HB2 ARG 75 HB2 ARG 75 -16.761 5.480 -10.211 639 HB3 ARG 75 HB1 ARG 75 -15.435 6.565 -10.603 640 HG2 ARG 75 HG2 ARG 75 -14.791 5.071 -12.451 641 HG3 ARG 75 HG1 ARG 75 -16.193 4.062 -12.090 642 HD2 ARG 75 HD2 ARG 75 -16.320 6.985 -12.793 643 HD3 ARG 75 HD1 ARG 75 -16.558 5.672 -13.945 644 HE ARG 75 HE ARG 75 -18.330 5.232 -11.864 645 HH11 ARG 75 HH11 ARG 75 -17.749 7.682 -14.269 646 HH12 ARG 75 HH12 ARG 75 -19.405 8.177 -14.358 647 HH21 ARG 75 HH21 ARG 75 -20.517 5.870 -11.969 648 HH22 ARG 75 HH22 ARG 75 -20.985 7.143 -13.045 649 H ILE 76 HN ILE 76 -12.801 5.848 -8.787 650 HA ILE 76 HA ILE 76 -14.036 6.359 -6.159 651 HB ILE 76 HB ILE 76 -11.105 6.272 -6.875 652 HG12 ILE 76 HG12 ILE 76 -12.803 4.300 -5.324 653 HG13 ILE 76 HG11 ILE 76 -12.223 4.066 -6.971 654 HG21 ILE 76 HG21 ILE 76 -12.538 7.255 -4.547 655 HG22 ILE 76 HG22 ILE 76 -10.840 7.437 -4.986 656 HG23 ILE 76 HG23 ILE 76 -11.380 5.992 -4.131 657 HD11 ILE 76 HD11 ILE 76 -10.250 4.619 -4.834 658 HD12 ILE 76 HD12 ILE 76 -10.087 3.666 -6.308 659 HD13 ILE 76 HD13 ILE 76 -10.979 3.017 -4.932 660 H ILE 77 HN ILE 77 -14.706 8.409 -5.885 661 HA ILE 77 HA ILE 77 -13.221 10.554 -7.248 662 HB ILE 77 HB ILE 77 -16.160 10.589 -6.580 663 HG12 ILE 77 HG12 ILE 77 -15.822 10.737 -9.354 664 HG13 ILE 77 HG11 ILE 77 -14.729 9.458 -8.833 665 HG21 ILE 77 HG21 ILE 77 -14.820 12.774 -6.691 666 HG22 ILE 77 HG22 ILE 77 -16.295 12.660 -7.653 667 HG23 ILE 77 HG23 ILE 77 -14.721 12.465 -8.425 668 HD11 ILE 77 HD11 ILE 77 -16.996 8.683 -9.481 669 HD12 ILE 77 HD12 ILE 77 -17.641 9.573 -8.102 670 HD13 ILE 77 HD13 ILE 77 -16.517 8.239 -7.842 671 H GLY 78 HN GLY 78 -12.325 12.041 -5.968 672 HA2 GLY 78 HA2 GLY 78 -13.404 13.305 -3.783 673 HA3 GLY 78 HA1 GLY 78 -12.604 11.882 -3.126 674 H ASP 79 HN ASP 79 -11.299 13.576 -2.012 675 HA ASP 79 HA ASP 79 -9.425 15.049 -3.656 676 HB2 ASP 79 HB2 ASP 79 -10.287 15.996 -1.522 677 HB3 ASP 79 HB1 ASP 79 -9.487 14.695 -0.645 678 H LEU 80 HN LEU 80 -8.055 13.708 -4.705 679 HA LEU 80 HA LEU 80 -6.884 11.442 -3.326 680 HB2 LEU 80 HB2 LEU 80 -6.503 12.444 -6.152 681 HB3 LEU 80 HB1 LEU 80 -5.834 10.956 -5.515 682 HG LEU 80 HG LEU 80 -8.786 11.548 -5.777 683 HD11 LEU 80 HD11 LEU 80 -8.542 9.658 -7.509 684 HD12 LEU 80 HD12 LEU 80 -6.834 10.095 -7.522 685 HD13 LEU 80 HD13 LEU 80 -8.053 11.290 -7.967 686 HD21 LEU 80 HD21 LEU 80 -7.267 9.091 -4.916 687 HD22 LEU 80 HD22 LEU 80 -8.972 9.084 -5.369 688 HD23 LEU 80 HD23 LEU 80 -8.434 10.022 -3.976 689 H SER 81 HN SER 81 -6.137 14.660 -3.469 690 HA SER 81 HA SER 81 -3.322 14.574 -3.851 691 HB2 SER 81 HB2 SER 81 -5.021 16.593 -2.354 692 HB3 SER 81 HB1 SER 81 -3.328 16.821 -2.797 693 HG SER 81 HG SER 81 -5.532 17.205 -4.288 694 H ASN 82 HN ASN 82 -5.372 13.721 -1.262 695 HA ASN 82 HA ASN 82 -3.289 13.817 0.758 696 HB2 ASN 82 HB2 ASN 82 -5.574 14.407 1.403 697 HB3 ASN 82 HB1 ASN 82 -6.137 12.831 0.874 698 HD21 ASN 82 HD21 ASN 82 -4.183 14.513 3.241 699 HD22 ASN 82 HD22 ASN 82 -4.237 13.272 4.442 700 H ARG 83 HN ARG 83 -1.883 12.218 0.994 701 HA ARG 83 HA ARG 83 -1.958 9.898 -0.530 702 HB2 ARG 83 HB2 ARG 83 -0.350 10.574 1.938 703 HB3 ARG 83 HB1 ARG 83 -0.122 9.069 1.061 704 HG2 ARG 83 HG2 ARG 83 1.358 10.134 -0.198 705 HG3 ARG 83 HG1 ARG 83 0.015 11.044 -0.891 706 HD2 ARG 83 HD2 ARG 83 1.127 11.971 1.702 707 HD3 ARG 83 HD1 ARG 83 2.090 12.240 0.249 708 HE ARG 83 HE ARG 83 -0.418 13.122 -0.399 709 HH11 ARG 83 HH11 ARG 83 1.905 13.867 2.088 710 HH12 ARG 83 HH12 ARG 83 1.409 15.519 2.239 711 HH21 ARG 83 HH21 ARG 83 -1.082 15.285 -0.220 712 HH22 ARG 83 HH22 ARG 83 -0.297 16.329 0.922 713 H GLU 84 HN GLU 84 -3.068 10.388 2.787 714 HA GLU 84 HA GLU 84 -3.438 7.676 3.447 715 HB2 GLU 84 HB2 GLU 84 -4.765 10.185 4.431 716 HB3 GLU 84 HB1 GLU 84 -5.181 8.592 5.052 717 HG2 GLU 84 HG2 GLU 84 -2.984 8.239 5.867 718 HG3 GLU 84 HG1 GLU 84 -2.380 9.678 5.048 719 H LYS 85 HN LYS 85 -5.721 9.960 1.855 720 HA LYS 85 HA LYS 85 -7.806 8.037 1.808 721 HB2 LYS 85 HB2 LYS 85 -7.317 10.467 0.068 722 HB3 LYS 85 HB1 LYS 85 -8.738 9.446 -0.113 723 HG2 LYS 85 HG2 LYS 85 -9.404 9.983 2.180 724 HG3 LYS 85 HG1 LYS 85 -7.989 11.026 2.340 725 HD2 LYS 85 HD2 LYS 85 -8.812 12.360 0.411 726 HD3 LYS 85 HD1 LYS 85 -10.256 11.350 0.373 727 HE2 LYS 85 HE2 LYS 85 -9.379 13.043 2.711 728 HE3 LYS 85 HE1 LYS 85 -10.641 13.471 1.556 729 HZ1 LYS 85 HZ1 LYS 85 -10.700 11.548 3.741 730 HZ2 LYS 85 HZ2 LYS 85 -11.521 11.104 2.331 731 HZ3 LYS 85 HZ3 LYS 85 -11.931 12.535 3.134 732 H VAL 86 HN VAL 86 -5.267 8.781 -0.523 733 HA VAL 86 HA VAL 86 -6.144 6.985 -2.510 734 HB VAL 86 HB VAL 86 -3.354 7.996 -1.893 735 HG11 VAL 86 HG11 VAL 86 -3.798 7.074 -4.602 736 HG12 VAL 86 HG12 VAL 86 -3.988 5.767 -3.433 737 HG13 VAL 86 HG13 VAL 86 -2.488 6.696 -3.483 738 HG21 VAL 86 HG21 VAL 86 -4.296 9.861 -2.719 739 HG22 VAL 86 HG22 VAL 86 -5.670 8.988 -3.396 740 HG23 VAL 86 HG23 VAL 86 -4.144 9.050 -4.278 741 H LEU 87 HN LEU 87 -4.005 6.561 0.277 742 HA LEU 87 HA LEU 87 -3.344 3.838 -0.266 743 HB2 LEU 87 HB2 LEU 87 -2.695 5.828 1.676 744 HB3 LEU 87 HB1 LEU 87 -3.216 4.388 2.527 745 HG LEU 87 HG LEU 87 -1.038 4.397 0.444 746 HD11 LEU 87 HD11 LEU 87 -0.983 5.464 3.062 747 HD12 LEU 87 HD12 LEU 87 0.370 5.203 1.958 748 HD13 LEU 87 HD13 LEU 87 -0.093 3.939 3.097 749 HD21 LEU 87 HD21 LEU 87 -1.158 2.330 2.528 750 HD22 LEU 87 HD22 LEU 87 -0.833 2.183 0.802 751 HD23 LEU 87 HD23 LEU 87 -2.497 2.296 1.379 752 H ILE 88 HN ILE 88 -5.677 5.319 1.984 753 HA ILE 88 HA ILE 88 -6.599 2.895 3.070 754 HB ILE 88 HB ILE 88 -7.873 5.613 2.883 755 HG12 ILE 88 HG12 ILE 88 -6.811 4.099 5.273 756 HG13 ILE 88 HG11 ILE 88 -5.805 5.156 4.292 757 HG21 ILE 88 HG21 ILE 88 -8.914 3.184 4.344 758 HG22 ILE 88 HG22 ILE 88 -9.683 3.994 2.980 759 HG23 ILE 88 HG23 ILE 88 -9.531 4.828 4.528 760 HD11 ILE 88 HD11 ILE 88 -7.983 6.723 4.907 761 HD12 ILE 88 HD12 ILE 88 -6.395 6.773 5.678 762 HD13 ILE 88 HD13 ILE 88 -7.690 5.801 6.383 763 H ALA 89 HN ALA 89 -7.918 4.847 0.378 764 HA ALA 89 HA ALA 89 -10.106 3.136 -0.144 765 HB1 ALA 89 HB1 ALA 89 -9.441 4.315 -2.580 766 HB2 ALA 89 HB2 ALA 89 -8.929 5.476 -1.353 767 HB3 ALA 89 HB3 ALA 89 -10.599 4.911 -1.390 768 H LEU 90 HN LEU 90 -6.809 3.195 -1.426 769 HA LEU 90 HA LEU 90 -7.217 1.135 -3.336 770 HB2 LEU 90 HB2 LEU 90 -5.336 2.719 -3.478 771 HB3 LEU 90 HB1 LEU 90 -4.657 2.041 -2.009 772 HG LEU 90 HG LEU 90 -4.348 -0.116 -3.163 773 HD11 LEU 90 HD11 LEU 90 -4.503 0.517 -5.843 774 HD12 LEU 90 HD12 LEU 90 -5.969 1.232 -5.171 775 HD13 LEU 90 HD13 LEU 90 -5.641 -0.487 -4.945 776 HD21 LEU 90 HD21 LEU 90 -2.758 2.008 -3.227 777 HD22 LEU 90 HD22 LEU 90 -3.072 1.872 -4.957 778 HD23 LEU 90 HD23 LEU 90 -2.365 0.515 -4.079 779 H ARG 91 HN ARG 91 -6.163 1.139 0.046 780 HA ARG 91 HA ARG 91 -5.389 -1.589 0.212 781 HB2 ARG 91 HB2 ARG 91 -4.765 0.144 1.873 782 HB3 ARG 91 HB1 ARG 91 -6.445 0.233 2.381 783 HG2 ARG 91 HG2 ARG 91 -6.357 -2.094 3.110 784 HG3 ARG 91 HG1 ARG 91 -4.675 -2.196 2.587 785 HD2 ARG 91 HD2 ARG 91 -5.727 -0.297 4.682 786 HD3 ARG 91 HD1 ARG 91 -4.912 -1.822 5.021 787 HE ARG 91 HE ARG 91 -3.696 0.649 4.149 788 HH11 ARG 91 HH11 ARG 91 -3.332 -2.800 4.491 789 HH12 ARG 91 HH12 ARG 91 -1.602 -2.754 4.453 790 HH21 ARG 91 HH21 ARG 91 -1.418 0.723 4.100 791 HH22 ARG 91 HH22 ARG 91 -0.511 -0.747 4.229 792 H LEU 92 HN LEU 92 -8.470 0.065 0.874 793 HA LEU 92 HA LEU 92 -9.862 -2.218 1.736 794 HB2 LEU 92 HB2 LEU 92 -10.831 0.325 0.429 795 HB3 LEU 92 HB1 LEU 92 -11.918 -0.910 1.038 796 HG LEU 92 HG LEU 92 -9.902 0.553 2.745 797 HD11 LEU 92 HD11 LEU 92 -11.900 1.744 3.636 798 HD12 LEU 92 HD12 LEU 92 -12.836 1.071 2.302 799 HD13 LEU 92 HD13 LEU 92 -11.490 2.163 1.972 800 HD21 LEU 92 HD21 LEU 92 -11.916 -0.380 4.352 801 HD22 LEU 92 HD22 LEU 92 -10.344 -1.147 4.130 802 HD23 LEU 92 HD23 LEU 92 -11.729 -1.684 3.180 803 H LEU 93 HN LEU 93 -9.321 -0.906 -1.490 804 HA LEU 93 HA LEU 93 -11.097 -2.639 -2.865 805 HB2 LEU 93 HB2 LEU 93 -8.626 -1.180 -3.781 806 HB3 LEU 93 HB1 LEU 93 -9.649 -2.108 -4.859 807 HG LEU 93 HG LEU 93 -10.582 0.270 -3.252 808 HD11 LEU 93 HD11 LEU 93 -9.398 1.436 -4.747 809 HD12 LEU 93 HD12 LEU 93 -10.676 0.991 -5.879 810 HD13 LEU 93 HD13 LEU 93 -9.188 0.046 -5.813 811 HD21 LEU 93 HD21 LEU 93 -12.136 -0.342 -5.573 812 HD22 LEU 93 HD22 LEU 93 -12.638 -0.285 -3.884 813 HD23 LEU 93 HD23 LEU 93 -12.002 -1.783 -4.566 814 H ALA 94 HN ALA 94 -7.691 -2.854 -1.981 815 HA ALA 94 HA ALA 94 -7.066 -5.186 -3.425 816 HB1 ALA 94 HB1 ALA 94 -5.037 -5.234 -2.257 817 HB2 ALA 94 HB2 ALA 94 -5.730 -4.427 -0.849 818 HB3 ALA 94 HB3 ALA 94 -5.464 -3.526 -2.343 819 H GLU 95 HN GLU 95 -8.379 -4.737 -0.175 820 HA GLU 95 HA GLU 95 -8.120 -7.394 0.701 821 HB2 GLU 95 HB2 GLU 95 -10.074 -5.203 1.406 822 HB3 GLU 95 HB1 GLU 95 -10.047 -6.760 2.226 823 HG2 GLU 95 HG2 GLU 95 -7.837 -6.360 3.050 824 HG3 GLU 95 HG1 GLU 95 -7.685 -4.900 2.074 825 H GLU 96 HN GLU 96 -10.582 -5.727 -1.170 826 HA GLU 96 HA GLU 96 -12.523 -7.764 -1.234 827 HB2 GLU 96 HB2 GLU 96 -11.863 -5.532 -3.171 828 HB3 GLU 96 HB1 GLU 96 -13.261 -6.589 -3.358 829 HG2 GLU 96 HG2 GLU 96 -12.726 -4.760 -1.023 830 HG3 GLU 96 HG1 GLU 96 -13.881 -4.477 -2.325 831 H ILE 97 HN ILE 97 -9.755 -7.049 -3.297 832 HA ILE 97 HA ILE 97 -10.258 -9.067 -5.234 833 HB ILE 97 HB ILE 97 -7.695 -7.619 -4.543 834 HG12 ILE 97 HG12 ILE 97 -9.683 -7.130 -6.766 835 HG13 ILE 97 HG11 ILE 97 -9.667 -6.247 -5.241 836 HG21 ILE 97 HG21 ILE 97 -8.354 -9.095 -7.092 837 HG22 ILE 97 HG22 ILE 97 -7.374 -9.774 -5.794 838 HG23 ILE 97 HG23 ILE 97 -6.819 -8.337 -6.657 839 HD11 ILE 97 HD11 ILE 97 -8.450 -5.402 -7.447 840 HD12 ILE 97 HD12 ILE 97 -7.132 -6.322 -6.714 841 HD13 ILE 97 HD13 ILE 97 -7.904 -5.011 -5.816 842 H GLY 98 HN GLY 98 -8.180 -8.893 -2.364 843 HA2 GLY 98 HA2 GLY 98 -6.943 -11.408 -2.637 844 HA3 GLY 98 HA1 GLY 98 -7.129 -10.522 -1.131 845 H ASP 99 HN ASP 99 -10.001 -10.482 -1.171 846 HA ASP 99 HA ASP 99 -10.563 -12.880 0.177 847 HB2 ASP 99 HB2 ASP 99 -11.789 -10.748 0.525 848 HB3 ASP 99 HB1 ASP 99 -12.543 -10.952 -1.054 849 H TYR 100 HN TYR 100 -11.190 -11.894 -3.155 850 HA TYR 100 HA TYR 100 -12.624 -14.336 -3.738 851 HB2 TYR 100 HB2 TYR 100 -13.342 -12.254 -4.807 852 HB3 TYR 100 HB1 TYR 100 -11.750 -12.061 -5.535 853 HD1 TYR 100 HD1 TYR 100 -14.703 -14.331 -5.473 854 HD2 TYR 100 HD2 TYR 100 -11.305 -12.969 -7.644 855 HE1 TYR 100 HE1 TYR 100 -15.459 -15.597 -7.441 856 HE2 TYR 100 HE2 TYR 100 -12.054 -14.231 -9.617 857 HH TYR 100 HH TYR 100 -14.606 -16.532 -9.470 858 H LYS 101 HN LYS 101 -11.603 -16.150 -4.157 859 HA LYS 101 HA LYS 101 -8.906 -16.033 -5.326 860 HB2 LYS 101 HB2 LYS 101 -10.201 -18.182 -3.637 861 HB3 LYS 101 HB1 LYS 101 -8.616 -18.328 -4.385 862 HG2 LYS 101 HG2 LYS 101 -7.816 -16.430 -3.069 863 HG3 LYS 101 HG1 LYS 101 -9.405 -16.283 -2.317 864 HD2 LYS 101 HD2 LYS 101 -9.172 -18.538 -1.389 865 HD3 LYS 101 HD1 LYS 101 -7.582 -18.682 -2.142 866 HE2 LYS 101 HE2 LYS 101 -6.779 -16.796 -0.812 867 HE3 LYS 101 HE1 LYS 101 -8.369 -16.640 -0.066 868 HZ1 LYS 101 HZ1 LYS 101 -6.781 -17.851 1.329 869 HZ2 LYS 101 HZ2 LYS 101 -6.629 -19.038 0.135 870 HZ3 LYS 101 HZ3 LYS 101 -8.112 -18.809 0.915 871 H ASP 102 HN ASP 102 -8.461 -17.100 -7.183 872 HA ASP 102 HA ASP 102 -10.154 -19.132 -8.274 873 HB2 ASP 102 HB2 ASP 102 -11.554 -17.264 -8.902 874 HB3 ASP 102 HB1 ASP 102 -10.171 -16.387 -9.549 875 H ASP 103 HN ASP 103 -7.798 -16.621 -9.162 876 HA ASP 103 HA ASP 103 -6.438 -18.460 -10.956 877 HB2 ASP 103 HB2 ASP 103 -6.762 -16.097 -11.616 878 HB3 ASP 103 HB1 ASP 103 -5.782 -15.592 -10.244 879 H ASP 104 HN ASP 104 -5.211 -19.936 -9.961 880 HA ASP 104 HA ASP 104 -3.932 -19.563 -7.460 881 HB2 ASP 104 HB2 ASP 104 -4.594 -21.775 -8.476 882 HB3 ASP 104 HB1 ASP 104 -3.210 -21.620 -9.553 883 H ASP 105 HN ASP 105 -2.955 -18.994 -10.748 884 HA ASP 105 HA ASP 105 -1.107 -18.101 -11.721 885 HB2 ASP 105 HB2 ASP 105 -1.754 -16.323 -9.975 886 HB3 ASP 105 HB1 ASP 105 -0.380 -16.920 -9.051 887 H LYS 106 HN LYS 106 -0.695 -20.701 -11.044 888 HA LYS 106 HA LYS 106 2.171 -20.702 -10.455 889 HB2 LYS 106 HB2 LYS 106 0.057 -22.192 -8.964 890 HB3 LYS 106 HB1 LYS 106 1.590 -23.005 -9.255 891 HG2 LYS 106 HG2 LYS 106 1.566 -20.256 -8.085 892 HG3 LYS 106 HG1 LYS 106 1.230 -21.659 -7.065 893 HD2 LYS 106 HD2 LYS 106 3.365 -22.649 -7.697 894 HD3 LYS 106 HD1 LYS 106 3.695 -21.286 -8.768 895 HE2 LYS 106 HE2 LYS 106 4.890 -21.022 -6.673 896 HE3 LYS 106 HE1 LYS 106 3.658 -19.771 -6.841 897 HZ1 LYS 106 HZ1 LYS 106 2.417 -20.638 -5.162 898 HZ2 LYS 106 HZ2 LYS 106 3.946 -21.123 -4.626 899 HZ3 LYS 106 HZ3 LYS 106 2.938 -22.228 -5.419 Start of MODEL 10 1 H1 MET 1 HT1 MET 1 -15.051 -10.458 -19.705 2 H2 MET 1 HT2 MET 1 -13.583 -11.080 -19.142 3 H3 MET 1 HT3 MET 1 -13.949 -9.442 -18.920 4 HA MET 1 HA MET 1 -14.947 -9.843 -17.016 5 HB2 MET 1 HB2 MET 1 -16.468 -12.035 -18.447 6 HB3 MET 1 HB1 MET 1 -16.886 -11.345 -16.884 7 HG2 MET 1 HG2 MET 1 -16.873 -9.896 -19.523 8 HG3 MET 1 HG1 MET 1 -18.294 -10.442 -18.636 9 HE1 MET 1 HE1 MET 1 -17.638 -9.034 -15.339 10 HE2 MET 1 HE2 MET 1 -18.759 -9.921 -16.373 11 HE3 MET 1 HE3 MET 1 -19.041 -8.215 -16.026 12 H ALA 2 HN ALA 2 -14.725 -11.099 -15.152 13 HA ALA 2 HA ALA 2 -13.577 -12.475 -13.750 14 HB1 ALA 2 HB1 ALA 2 -15.197 -14.040 -15.423 15 HB2 ALA 2 HB2 ALA 2 -14.591 -14.444 -13.817 16 HB3 ALA 2 HB3 ALA 2 -13.673 -14.910 -15.248 17 HA PRO 3 HA PRO 3 -9.695 -12.247 -16.464 18 HB2 PRO 3 HB2 PRO 3 -8.812 -10.691 -14.089 19 HB3 PRO 3 HB1 PRO 3 -8.576 -10.350 -15.807 20 HG2 PRO 3 HG2 PRO 3 -10.332 -8.940 -14.410 21 HG3 PRO 3 HG1 PRO 3 -10.723 -9.470 -16.059 22 HD2 PRO 3 HD2 PRO 3 -11.595 -10.650 -13.436 23 HD3 PRO 3 HD1 PRO 3 -12.556 -10.329 -14.898 24 H LEU 4 HN LEU 4 -7.964 -13.567 -16.226 25 HA LEU 4 HA LEU 4 -7.956 -15.301 -13.890 26 HB2 LEU 4 HB2 LEU 4 -6.300 -15.445 -16.412 27 HB3 LEU 4 HB1 LEU 4 -6.420 -16.689 -15.183 28 HG LEU 4 HG LEU 4 -8.649 -15.761 -16.997 29 HD11 LEU 4 HD11 LEU 4 -7.969 -18.554 -17.115 30 HD12 LEU 4 HD12 LEU 4 -6.567 -17.547 -17.477 31 HD13 LEU 4 HD13 LEU 4 -8.053 -17.359 -18.410 32 HD21 LEU 4 HD21 LEU 4 -9.668 -17.944 -15.952 33 HD22 LEU 4 HD22 LEU 4 -9.835 -16.382 -15.149 34 HD23 LEU 4 HD23 LEU 4 -8.608 -17.527 -14.604 35 H ARG 5 HN ARG 5 -6.405 -12.508 -14.883 36 HA ARG 5 HA ARG 5 -3.819 -13.033 -13.735 37 HB2 ARG 5 HB2 ARG 5 -5.148 -10.738 -15.072 38 HB3 ARG 5 HB1 ARG 5 -3.858 -10.348 -13.944 39 HG2 ARG 5 HG2 ARG 5 -2.902 -10.487 -16.111 40 HG3 ARG 5 HG1 ARG 5 -2.379 -11.912 -15.212 41 HD2 ARG 5 HD2 ARG 5 -3.923 -13.305 -16.362 42 HD3 ARG 5 HD1 ARG 5 -4.744 -11.917 -17.075 43 HE ARG 5 HE ARG 5 -2.101 -11.817 -17.914 44 HH11 ARG 5 HH11 ARG 5 -4.838 -13.945 -18.243 45 HH12 ARG 5 HH12 ARG 5 -4.359 -14.537 -19.799 46 HH21 ARG 5 HH21 ARG 5 -1.456 -12.585 -19.960 47 HH22 ARG 5 HH22 ARG 5 -2.429 -13.761 -20.777 48 H LYS 6 HN LYS 6 -3.015 -12.297 -11.779 49 HA LYS 6 HA LYS 6 -5.027 -11.794 -9.748 50 HB2 LYS 6 HB2 LYS 6 -2.035 -12.132 -9.464 51 HB3 LYS 6 HB1 LYS 6 -3.197 -12.100 -8.146 52 HG2 LYS 6 HG2 LYS 6 -3.073 -14.179 -10.326 53 HG3 LYS 6 HG1 LYS 6 -2.482 -14.375 -8.677 54 HD2 LYS 6 HD2 LYS 6 -4.772 -14.019 -7.838 55 HD3 LYS 6 HD1 LYS 6 -5.344 -13.882 -9.503 56 HE2 LYS 6 HE2 LYS 6 -3.973 -16.300 -8.332 57 HE3 LYS 6 HE1 LYS 6 -5.714 -16.126 -8.534 58 HZ1 LYS 6 HZ1 LYS 6 -4.694 -15.555 -11.002 59 HZ2 LYS 6 HZ2 LYS 6 -5.407 -17.018 -10.538 60 HZ3 LYS 6 HZ3 LYS 6 -3.725 -16.835 -10.463 61 H THR 7 HN THR 7 -3.047 -9.962 -11.736 62 HA THR 7 HA THR 7 -2.754 -7.761 -9.860 63 HB THR 7 HB THR 7 -1.821 -6.647 -12.055 64 HG1 THR 7 HG1 THR 7 -2.388 -8.253 -13.512 65 HG21 THR 7 HG21 THR 7 0.349 -8.150 -11.604 66 HG22 THR 7 HG22 THR 7 -0.587 -8.571 -10.171 67 HG23 THR 7 HG23 THR 7 -0.185 -6.885 -10.498 68 H ALA 8 HN ALA 8 -4.180 -6.218 -9.659 69 HA ALA 8 HA ALA 8 -6.414 -6.018 -11.498 70 HB1 ALA 8 HB1 ALA 8 -7.290 -4.392 -9.856 71 HB2 ALA 8 HB2 ALA 8 -5.813 -4.595 -8.912 72 HB3 ALA 8 HB3 ALA 8 -6.904 -5.960 -9.143 73 H VAL 9 HN VAL 9 -7.084 -4.027 -12.461 74 HA VAL 9 HA VAL 9 -4.781 -2.306 -13.101 75 HB VAL 9 HB VAL 9 -7.219 -2.875 -14.787 76 HG11 VAL 9 HG11 VAL 9 -4.957 -0.944 -15.074 77 HG12 VAL 9 HG12 VAL 9 -6.664 -0.744 -15.466 78 HG13 VAL 9 HG13 VAL 9 -5.624 -1.696 -16.522 79 HG21 VAL 9 HG21 VAL 9 -6.002 -4.366 -16.003 80 HG22 VAL 9 HG22 VAL 9 -5.208 -4.581 -14.443 81 HG23 VAL 9 HG23 VAL 9 -4.471 -3.553 -15.674 82 H LEU 10 HN LEU 10 -4.900 -0.320 -12.367 83 HA LEU 10 HA LEU 10 -7.539 0.844 -11.710 84 HB2 LEU 10 HB2 LEU 10 -6.083 0.411 -9.740 85 HB3 LEU 10 HB1 LEU 10 -4.854 1.439 -10.447 86 HG LEU 10 HG LEU 10 -6.422 3.361 -10.275 87 HD11 LEU 10 HD11 LEU 10 -8.546 2.194 -10.305 88 HD12 LEU 10 HD12 LEU 10 -8.402 3.134 -8.819 89 HD13 LEU 10 HD13 LEU 10 -8.150 1.388 -8.787 90 HD21 LEU 10 HD21 LEU 10 -5.574 3.836 -8.282 91 HD22 LEU 10 HD22 LEU 10 -4.854 2.228 -8.346 92 HD23 LEU 10 HD23 LEU 10 -6.391 2.475 -7.517 93 H LYS 11 HN LYS 11 -8.050 2.714 -12.848 94 HA LYS 11 HA LYS 11 -5.845 3.779 -14.481 95 HB2 LYS 11 HB2 LYS 11 -8.788 3.620 -15.147 96 HB3 LYS 11 HB1 LYS 11 -7.615 4.532 -16.088 97 HG2 LYS 11 HG2 LYS 11 -6.387 2.465 -16.549 98 HG3 LYS 11 HG1 LYS 11 -7.587 1.557 -15.630 99 HD2 LYS 11 HD2 LYS 11 -9.327 2.268 -17.190 100 HD3 LYS 11 HD1 LYS 11 -8.136 3.197 -18.103 101 HE2 LYS 11 HE2 LYS 11 -6.917 1.143 -18.608 102 HE3 LYS 11 HE1 LYS 11 -8.096 0.210 -17.687 103 HZ1 LYS 11 HZ1 LYS 11 -9.402 0.117 -19.457 104 HZ2 LYS 11 HZ2 LYS 11 -8.207 0.893 -20.369 105 HZ3 LYS 11 HZ3 LYS 11 -9.416 1.801 -19.612 106 H LEU 12 HN LEU 12 -5.413 5.868 -14.411 107 HA LEU 12 HA LEU 12 -7.119 7.542 -12.701 108 HB2 LEU 12 HB2 LEU 12 -4.518 6.986 -12.312 109 HB3 LEU 12 HB1 LEU 12 -4.341 8.371 -13.367 110 HG LEU 12 HG LEU 12 -5.283 8.236 -10.552 111 HD11 LEU 12 HD11 LEU 12 -3.919 10.168 -10.309 112 HD12 LEU 12 HD12 LEU 12 -3.801 10.380 -12.056 113 HD13 LEU 12 HD13 LEU 12 -3.019 9.002 -11.280 114 HD21 LEU 12 HD21 LEU 12 -6.196 10.640 -10.984 115 HD22 LEU 12 HD22 LEU 12 -7.238 9.238 -11.236 116 HD23 LEU 12 HD23 LEU 12 -6.475 10.032 -12.617 117 H TYR 13 HN TYR 13 -8.186 9.210 -13.800 118 HA TYR 13 HA TYR 13 -7.303 9.785 -16.538 119 HB2 TYR 13 HB2 TYR 13 -9.850 10.469 -15.054 120 HB3 TYR 13 HB1 TYR 13 -9.512 10.885 -16.731 121 HD1 TYR 13 HD1 TYR 13 -10.434 8.213 -14.422 122 HD2 TYR 13 HD2 TYR 13 -9.447 9.135 -18.457 123 HE1 TYR 13 HE1 TYR 13 -11.324 6.036 -15.132 124 HE2 TYR 13 HE2 TYR 13 -10.337 6.958 -19.177 125 HH TYR 13 HH TYR 13 -11.392 5.094 -18.555 126 H VAL 14 HN VAL 14 -6.101 11.590 -16.866 127 HA VAL 14 HA VAL 14 -6.389 13.799 -14.931 128 HB VAL 14 HB VAL 14 -4.014 14.298 -15.197 129 HG11 VAL 14 HG11 VAL 14 -4.560 12.934 -13.328 130 HG12 VAL 14 HG12 VAL 14 -3.103 12.250 -14.054 131 HG13 VAL 14 HG13 VAL 14 -4.670 11.489 -14.334 132 HG21 VAL 14 HG21 VAL 14 -2.503 12.968 -16.435 133 HG22 VAL 14 HG22 VAL 14 -3.868 13.265 -17.513 134 HG23 VAL 14 HG23 VAL 14 -3.710 11.707 -16.699 135 H ALA 15 HN ALA 15 -5.808 15.939 -15.823 136 HA ALA 15 HA ALA 15 -6.275 16.042 -18.725 137 HB1 ALA 15 HB1 ALA 15 -7.960 17.030 -16.661 138 HB2 ALA 15 HB2 ALA 15 -8.187 17.104 -18.408 139 HB3 ALA 15 HB3 ALA 15 -7.324 18.397 -17.575 140 H GLY 16 HN GLY 16 -4.156 16.493 -19.328 141 HA2 GLY 16 HA2 GLY 16 -2.596 18.070 -20.012 142 HA3 GLY 16 HA1 GLY 16 -3.409 19.263 -19.019 143 H ASN 17 HN ASN 17 -2.693 16.557 -17.164 144 HA ASN 17 HA ASN 17 -1.187 16.139 -15.508 145 HB2 ASN 17 HB2 ASN 17 0.332 16.074 -17.606 146 HB3 ASN 17 HB1 ASN 17 0.897 17.652 -17.065 147 HD21 ASN 17 HD21 ASN 17 2.946 17.076 -16.541 148 HD22 ASN 17 HD22 ASN 17 3.339 15.983 -15.264 149 H THR 18 HN THR 18 -2.817 18.182 -15.032 150 HA THR 18 HA THR 18 -1.529 20.613 -14.259 151 HB THR 18 HB THR 18 -3.663 21.107 -13.123 152 HG1 THR 18 HG1 THR 18 -5.367 19.476 -13.424 153 HG21 THR 18 HG21 THR 18 -3.268 21.209 -15.703 154 HG22 THR 18 HG22 THR 18 -4.884 21.466 -15.043 155 HG23 THR 18 HG23 THR 18 -4.452 19.901 -15.734 156 HA PRO 19 HA PRO 19 0.089 19.816 -10.248 157 HB2 PRO 19 HB2 PRO 19 -1.938 21.689 -9.080 158 HB3 PRO 19 HB1 PRO 19 -0.186 21.642 -8.850 159 HG2 PRO 19 HG2 PRO 19 -1.215 23.461 -10.458 160 HG3 PRO 19 HG1 PRO 19 0.242 22.580 -10.956 161 HD2 PRO 19 HD2 PRO 19 -2.597 22.184 -11.822 162 HD3 PRO 19 HD1 PRO 19 -1.108 22.158 -12.792 163 H ASN 20 HN ASN 20 -3.470 19.878 -10.272 164 HA ASN 20 HA ASN 20 -3.802 18.240 -7.968 165 HB2 ASN 20 HB2 ASN 20 -5.655 18.586 -10.359 166 HB3 ASN 20 HB1 ASN 20 -6.073 17.720 -8.888 167 HD21 ASN 20 HD21 ASN 20 -5.647 19.041 -6.836 168 HD22 ASN 20 HD22 ASN 20 -6.203 20.674 -6.877 169 H SER 21 HN SER 21 -3.664 17.555 -11.424 170 HA SER 21 HA SER 21 -3.828 14.716 -11.346 171 HB2 SER 21 HB2 SER 21 -2.567 16.583 -13.368 172 HB3 SER 21 HB1 SER 21 -2.878 14.867 -13.630 173 HG SER 21 HG SER 21 -4.689 17.007 -13.440 174 H VAL 22 HN VAL 22 -1.044 16.912 -11.356 175 HA VAL 22 HA VAL 22 0.889 14.860 -11.441 176 HB VAL 22 HB VAL 22 1.051 17.700 -10.398 177 HG11 VAL 22 HG11 VAL 22 3.551 17.368 -10.556 178 HG12 VAL 22 HG12 VAL 22 3.228 15.634 -10.621 179 HG13 VAL 22 HG13 VAL 22 2.746 16.568 -9.200 180 HG21 VAL 22 HG21 VAL 22 1.393 18.287 -12.514 181 HG22 VAL 22 HG22 VAL 22 1.024 16.630 -12.991 182 HG23 VAL 22 HG23 VAL 22 2.693 17.106 -12.677 183 H ARG 23 HN ARG 23 -0.618 16.601 -8.775 184 HA ARG 23 HA ARG 23 0.815 15.450 -6.651 185 HB2 ARG 23 HB2 ARG 23 -0.939 17.408 -6.791 186 HB3 ARG 23 HB1 ARG 23 -2.088 16.122 -6.424 187 HG2 ARG 23 HG2 ARG 23 -1.667 16.654 -4.299 188 HG3 ARG 23 HG1 ARG 23 -0.196 15.704 -4.523 189 HD2 ARG 23 HD2 ARG 23 1.037 17.713 -5.099 190 HD3 ARG 23 HD1 ARG 23 -0.435 18.675 -4.969 191 HE ARG 23 HE ARG 23 -0.040 17.360 -2.536 192 HH11 ARG 23 HH11 ARG 23 1.472 19.824 -4.476 193 HH12 ARG 23 HH12 ARG 23 2.158 20.659 -3.122 194 HH21 ARG 23 HH21 ARG 23 0.855 18.444 -0.741 195 HH22 ARG 23 HH22 ARG 23 1.807 19.870 -0.992 196 H ALA 24 HN ALA 24 -2.269 14.585 -8.173 197 HA ALA 24 HA ALA 24 -2.844 12.379 -6.528 198 HB1 ALA 24 HB1 ALA 24 -4.649 12.004 -7.880 199 HB2 ALA 24 HB2 ALA 24 -3.756 12.359 -9.359 200 HB3 ALA 24 HB3 ALA 24 -4.288 13.677 -8.313 201 H LEU 25 HN LEU 25 -1.188 12.616 -9.646 202 HA LEU 25 HA LEU 25 -0.772 9.877 -10.104 203 HB2 LEU 25 HB2 LEU 25 -0.487 11.531 -11.852 204 HB3 LEU 25 HB1 LEU 25 0.828 12.284 -10.974 205 HG LEU 25 HG LEU 25 2.201 10.267 -11.302 206 HD11 LEU 25 HD11 LEU 25 0.716 8.481 -11.469 207 HD12 LEU 25 HD12 LEU 25 1.315 8.673 -13.117 208 HD13 LEU 25 HD13 LEU 25 -0.277 9.293 -12.680 209 HD21 LEU 25 HD21 LEU 25 2.336 12.116 -12.889 210 HD22 LEU 25 HD22 LEU 25 1.043 11.396 -13.847 211 HD23 LEU 25 HD23 LEU 25 2.590 10.566 -13.692 212 H LYS 26 HN LYS 26 1.336 12.277 -8.541 213 HA LYS 26 HA LYS 26 3.465 10.505 -8.001 214 HB2 LYS 26 HB2 LYS 26 2.602 13.105 -6.736 215 HB3 LYS 26 HB1 LYS 26 4.054 12.245 -6.234 216 HG2 LYS 26 HG2 LYS 26 5.094 12.559 -8.316 217 HG3 LYS 26 HG1 LYS 26 3.579 13.018 -9.095 218 HD2 LYS 26 HD2 LYS 26 4.900 14.993 -8.771 219 HD3 LYS 26 HD1 LYS 26 3.527 15.051 -7.670 220 HE2 LYS 26 HE2 LYS 26 5.499 15.775 -6.514 221 HE3 LYS 26 HE1 LYS 26 4.990 14.218 -5.864 222 HZ1 LYS 26 HZ1 LYS 26 7.491 14.798 -6.644 223 HZ2 LYS 26 HZ2 LYS 26 6.887 14.054 -8.037 224 HZ3 LYS 26 HZ3 LYS 26 6.860 13.230 -6.561 225 H THR 27 HN THR 27 0.593 11.410 -6.157 226 HA THR 27 HA THR 27 1.223 10.072 -3.755 227 HB THR 27 HB THR 27 -1.459 10.791 -4.955 228 HG1 THR 27 HG1 THR 27 -0.349 12.659 -4.613 229 HG21 THR 27 HG21 THR 27 -1.978 10.903 -2.387 230 HG22 THR 27 HG22 THR 27 -0.679 9.709 -2.291 231 HG23 THR 27 HG23 THR 27 -2.109 9.379 -3.268 232 H LEU 28 HN LEU 28 -0.671 9.060 -6.603 233 HA LEU 28 HA LEU 28 -1.347 6.510 -5.548 234 HB2 LEU 28 HB2 LEU 28 -1.564 7.858 -8.174 235 HB3 LEU 28 HB1 LEU 28 -1.618 6.105 -8.180 236 HG LEU 28 HG LEU 28 -3.416 7.656 -6.357 237 HD11 LEU 28 HD11 LEU 28 -3.684 8.579 -8.625 238 HD12 LEU 28 HD12 LEU 28 -5.112 7.708 -8.066 239 HD13 LEU 28 HD13 LEU 28 -4.013 6.952 -9.220 240 HD21 LEU 28 HD21 LEU 28 -4.806 5.687 -6.555 241 HD22 LEU 28 HD22 LEU 28 -3.172 5.217 -6.081 242 HD23 LEU 28 HD23 LEU 28 -3.703 4.998 -7.748 243 H ALA 29 HN ALA 29 1.169 7.531 -7.886 244 HA ALA 29 HA ALA 29 2.066 4.951 -8.502 245 HB1 ALA 29 HB1 ALA 29 4.246 6.254 -9.064 246 HB2 ALA 29 HB2 ALA 29 3.250 7.674 -8.739 247 HB3 ALA 29 HB3 ALA 29 2.775 6.535 -10.000 248 H ASN 30 HN ASN 30 3.136 7.182 -5.942 249 HA ASN 30 HA ASN 30 5.363 5.618 -5.105 250 HB2 ASN 30 HB2 ASN 30 5.091 7.979 -4.454 251 HB3 ASN 30 HB1 ASN 30 3.666 7.557 -3.510 252 HD21 ASN 30 HD21 ASN 30 7.137 7.076 -3.784 253 HD22 ASN 30 HD22 ASN 30 7.402 6.721 -2.115 254 H ILE 31 HN ILE 31 1.999 5.697 -4.034 255 HA ILE 31 HA ILE 31 2.277 3.832 -1.971 256 HB ILE 31 HB ILE 31 -0.094 4.699 -3.581 257 HG12 ILE 31 HG12 ILE 31 0.618 5.091 -0.677 258 HG13 ILE 31 HG11 ILE 31 1.039 6.229 -1.954 259 HG21 ILE 31 HG21 ILE 31 0.036 2.262 -2.225 260 HG22 ILE 31 HG22 ILE 31 -1.410 3.098 -2.794 261 HG23 ILE 31 HG23 ILE 31 -0.833 3.355 -1.147 262 HD11 ILE 31 HD11 ILE 31 -1.127 6.890 -2.260 263 HD12 ILE 31 HD12 ILE 31 -1.078 6.599 -0.521 264 HD13 ILE 31 HD13 ILE 31 -1.788 5.395 -1.598 265 H LEU 32 HN LEU 32 1.319 3.492 -5.346 266 HA LEU 32 HA LEU 32 0.879 0.704 -5.276 267 HB2 LEU 32 HB2 LEU 32 1.299 2.641 -7.533 268 HB3 LEU 32 HB1 LEU 32 0.936 0.942 -7.786 269 HG LEU 32 HG LEU 32 -0.845 2.820 -6.215 270 HD11 LEU 32 HD11 LEU 32 -2.185 3.115 -8.099 271 HD12 LEU 32 HD12 LEU 32 -1.404 1.803 -8.981 272 HD13 LEU 32 HD13 LEU 32 -0.545 3.321 -8.712 273 HD21 LEU 32 HD21 LEU 32 -0.865 -0.050 -6.853 274 HD22 LEU 32 HD22 LEU 32 -2.398 0.797 -7.067 275 HD23 LEU 32 HD23 LEU 32 -1.584 0.827 -5.503 276 H GLU 33 HN GLU 33 3.786 2.597 -5.953 277 HA GLU 33 HA GLU 33 5.197 0.285 -6.986 278 HB2 GLU 33 HB2 GLU 33 6.247 3.027 -6.270 279 HB3 GLU 33 HB1 GLU 33 7.162 1.771 -7.089 280 HG2 GLU 33 HG2 GLU 33 5.498 1.857 -8.936 281 HG3 GLU 33 HG1 GLU 33 4.746 3.230 -8.115 282 H LYS 34 HN LYS 34 4.506 1.399 -3.867 283 HA LYS 34 HA LYS 34 6.798 -0.146 -2.840 284 HB2 LYS 34 HB2 LYS 34 6.768 2.448 -2.509 285 HB3 LYS 34 HB1 LYS 34 5.606 2.087 -1.242 286 HG2 LYS 34 HG2 LYS 34 7.632 2.174 -0.118 287 HG3 LYS 34 HG1 LYS 34 7.372 0.446 -0.362 288 HD2 LYS 34 HD2 LYS 34 8.802 0.603 -2.410 289 HD3 LYS 34 HD1 LYS 34 9.171 2.269 -1.957 290 HE2 LYS 34 HE2 LYS 34 9.734 -0.179 -0.286 291 HE3 LYS 34 HE1 LYS 34 10.923 0.716 -1.231 292 HZ1 LYS 34 HZ1 LYS 34 11.212 1.639 0.821 293 HZ2 LYS 34 HZ2 LYS 34 9.591 1.469 1.270 294 HZ3 LYS 34 HZ3 LYS 34 10.045 2.697 0.201 295 H GLU 35 HN GLU 35 3.716 1.206 -1.667 296 HA GLU 35 HA GLU 35 3.350 -0.706 0.366 297 HB2 GLU 35 HB2 GLU 35 1.448 1.179 -1.028 298 HB3 GLU 35 HB1 GLU 35 0.952 0.150 0.312 299 HG2 GLU 35 HG2 GLU 35 3.099 2.263 0.401 300 HG3 GLU 35 HG1 GLU 35 1.473 2.404 1.065 301 H PHE 36 HN PHE 36 2.075 -0.570 -2.950 302 HA PHE 36 HA PHE 36 1.159 -3.345 -2.574 303 HB2 PHE 36 HB2 PHE 36 -0.203 -1.148 -4.135 304 HB3 PHE 36 HB1 PHE 36 -0.670 -2.844 -4.205 305 HD1 PHE 36 HD1 PHE 36 -0.710 0.202 -2.216 306 HD2 PHE 36 HD2 PHE 36 -1.671 -3.942 -2.269 307 HE1 PHE 36 HE1 PHE 36 -2.114 0.507 -0.220 308 HE2 PHE 36 HE2 PHE 36 -3.079 -3.644 -0.273 309 HZ PHE 36 HZ PHE 36 -3.300 -1.417 0.754 310 H LYS 37 HN LYS 37 3.716 -2.445 -3.602 311 HA LYS 37 HA LYS 37 3.913 -2.469 -6.373 312 HB2 LYS 37 HB2 LYS 37 5.783 -1.910 -4.879 313 HB3 LYS 37 HB1 LYS 37 5.875 -3.589 -4.362 314 HG2 LYS 37 HG2 LYS 37 6.483 -4.265 -6.625 315 HG3 LYS 37 HG1 LYS 37 6.365 -2.589 -7.162 316 HD2 LYS 37 HD2 LYS 37 8.162 -1.968 -5.620 317 HD3 LYS 37 HD1 LYS 37 8.275 -3.643 -5.075 318 HE2 LYS 37 HE2 LYS 37 8.885 -4.339 -7.338 319 HE3 LYS 37 HE1 LYS 37 8.762 -2.669 -7.889 320 HZ1 LYS 37 HZ1 LYS 37 11.034 -3.107 -7.500 321 HZ2 LYS 37 HZ2 LYS 37 10.733 -3.805 -5.989 322 HZ3 LYS 37 HZ3 LYS 37 10.520 -2.140 -6.209 323 H GLY 38 HN GLY 38 3.654 -3.959 -7.893 324 HA2 GLY 38 HA2 GLY 38 3.727 -6.044 -8.919 325 HA3 GLY 38 HA1 GLY 38 4.136 -6.763 -7.371 326 H VAL 39 HN VAL 39 1.480 -4.890 -6.781 327 HA VAL 39 HA VAL 39 -0.283 -7.204 -7.236 328 HB VAL 39 HB VAL 39 -0.609 -5.017 -5.167 329 HG11 VAL 39 HG11 VAL 39 -2.158 -7.587 -5.502 330 HG12 VAL 39 HG12 VAL 39 -2.737 -5.992 -5.979 331 HG13 VAL 39 HG13 VAL 39 -2.424 -6.345 -4.279 332 HG21 VAL 39 HG21 VAL 39 1.298 -6.589 -4.776 333 HG22 VAL 39 HG22 VAL 39 0.127 -7.907 -4.723 334 HG23 VAL 39 HG23 VAL 39 0.057 -6.617 -3.521 335 H TYR 40 HN TYR 40 -0.206 -3.637 -7.358 336 HA TYR 40 HA TYR 40 -2.588 -3.836 -9.045 337 HB2 TYR 40 HB2 TYR 40 -2.005 -2.146 -6.804 338 HB3 TYR 40 HB1 TYR 40 -2.171 -1.123 -8.218 339 HD1 TYR 40 HD1 TYR 40 -3.868 -2.668 -5.569 340 HD2 TYR 40 HD2 TYR 40 -4.341 -1.550 -9.646 341 HE1 TYR 40 HE1 TYR 40 -6.306 -2.630 -5.270 342 HE2 TYR 40 HE2 TYR 40 -6.783 -1.521 -9.359 343 HH TYR 40 HH TYR 40 -8.355 -1.131 -7.137 344 H ALA 41 HN ALA 41 -2.655 -2.805 -11.022 345 HA ALA 41 HA ALA 41 -0.101 -1.687 -11.968 346 HB1 ALA 41 HB1 ALA 41 -1.127 -3.702 -13.121 347 HB2 ALA 41 HB2 ALA 41 -0.717 -2.337 -14.161 348 HB3 ALA 41 HB3 ALA 41 -2.392 -2.612 -13.690 349 H LEU 42 HN LEU 42 -0.001 0.463 -12.373 350 HA LEU 42 HA LEU 42 -2.494 1.973 -12.253 351 HB2 LEU 42 HB2 LEU 42 -0.685 2.644 -10.748 352 HB3 LEU 42 HB1 LEU 42 0.382 2.895 -12.113 353 HG LEU 42 HG LEU 42 -1.040 4.760 -12.877 354 HD11 LEU 42 HD11 LEU 42 -2.563 5.474 -10.717 355 HD12 LEU 42 HD12 LEU 42 -2.792 3.727 -10.779 356 HD13 LEU 42 HD13 LEU 42 -3.173 4.716 -12.188 357 HD21 LEU 42 HD21 LEU 42 -0.670 5.777 -10.240 358 HD22 LEU 42 HD22 LEU 42 0.304 6.054 -11.684 359 HD23 LEU 42 HD23 LEU 42 0.661 4.687 -10.629 360 H LYS 43 HN LYS 43 -3.418 2.834 -13.951 361 HA LYS 43 HA LYS 43 -1.860 3.251 -16.406 362 HB2 LYS 43 HB2 LYS 43 -4.187 1.568 -15.980 363 HB3 LYS 43 HB1 LYS 43 -4.522 2.817 -17.169 364 HG2 LYS 43 HG2 LYS 43 -3.714 1.246 -18.565 365 HG3 LYS 43 HG1 LYS 43 -2.178 1.988 -18.115 366 HD2 LYS 43 HD2 LYS 43 -1.663 0.255 -16.611 367 HD3 LYS 43 HD1 LYS 43 -3.327 -0.335 -16.594 368 HE2 LYS 43 HE2 LYS 43 -2.070 -1.855 -17.919 369 HE3 LYS 43 HE1 LYS 43 -3.052 -0.893 -19.025 370 HZ1 LYS 43 HZ1 LYS 43 -1.249 0.007 -19.964 371 HZ2 LYS 43 HZ2 LYS 43 -0.412 -1.300 -19.292 372 HZ3 LYS 43 HZ3 LYS 43 -0.427 0.193 -18.497 373 H VAL 44 HN VAL 44 -1.735 5.323 -16.743 374 HA VAL 44 HA VAL 44 -3.892 7.107 -15.839 375 HB VAL 44 HB VAL 44 -1.050 7.655 -16.684 376 HG11 VAL 44 HG11 VAL 44 -2.253 9.595 -17.299 377 HG12 VAL 44 HG12 VAL 44 -1.557 9.961 -15.719 378 HG13 VAL 44 HG13 VAL 44 -3.261 9.521 -15.853 379 HG21 VAL 44 HG21 VAL 44 -2.005 8.320 -13.980 380 HG22 VAL 44 HG22 VAL 44 -0.457 7.661 -14.511 381 HG23 VAL 44 HG23 VAL 44 -1.859 6.603 -14.353 382 H ILE 45 HN ILE 45 -5.195 8.091 -17.122 383 HA ILE 45 HA ILE 45 -4.808 7.831 -20.030 384 HB ILE 45 HB ILE 45 -7.353 8.198 -18.447 385 HG12 ILE 45 HG12 ILE 45 -6.381 6.025 -17.957 386 HG13 ILE 45 HG11 ILE 45 -7.829 5.831 -18.938 387 HG21 ILE 45 HG21 ILE 45 -7.395 9.029 -20.803 388 HG22 ILE 45 HG22 ILE 45 -8.565 7.750 -20.464 389 HG23 ILE 45 HG23 ILE 45 -7.074 7.378 -21.334 390 HD11 ILE 45 HD11 ILE 45 -6.048 4.319 -19.612 391 HD12 ILE 45 HD12 ILE 45 -4.997 5.697 -19.940 392 HD13 ILE 45 HD13 ILE 45 -6.454 5.452 -20.903 393 H ASP 46 HN ASP 46 -4.206 9.768 -20.926 394 HA ASP 46 HA ASP 46 -4.826 12.245 -19.557 395 HB2 ASP 46 HB2 ASP 46 -2.621 11.801 -20.716 396 HB3 ASP 46 HB1 ASP 46 -3.486 11.944 -22.244 397 H VAL 47 HN VAL 47 -6.915 12.836 -19.767 398 HA VAL 47 HA VAL 47 -8.527 12.168 -21.988 399 HB VAL 47 HB VAL 47 -10.249 13.567 -20.984 400 HG11 VAL 47 HG11 VAL 47 -9.760 12.510 -18.509 401 HG12 VAL 47 HG12 VAL 47 -8.745 11.505 -19.546 402 HG13 VAL 47 HG13 VAL 47 -10.476 11.637 -19.864 403 HG21 VAL 47 HG21 VAL 47 -9.848 14.838 -18.957 404 HG22 VAL 47 HG22 VAL 47 -8.816 15.433 -20.258 405 HG23 VAL 47 HG23 VAL 47 -8.139 14.403 -18.994 406 H LEU 48 HN LEU 48 -6.665 15.121 -21.323 407 HA LEU 48 HA LEU 48 -7.990 16.651 -23.329 408 HB2 LEU 48 HB2 LEU 48 -5.359 17.067 -21.942 409 HB3 LEU 48 HB1 LEU 48 -5.971 18.166 -23.163 410 HG LEU 48 HG LEU 48 -7.366 17.513 -20.566 411 HD11 LEU 48 HD11 LEU 48 -6.779 19.824 -19.950 412 HD12 LEU 48 HD12 LEU 48 -5.806 19.946 -21.416 413 HD13 LEU 48 HD13 LEU 48 -5.361 18.795 -20.156 414 HD21 LEU 48 HD21 LEU 48 -9.126 18.155 -21.852 415 HD22 LEU 48 HD22 LEU 48 -8.119 19.073 -22.971 416 HD23 LEU 48 HD23 LEU 48 -8.536 19.753 -21.398 417 H LYS 49 HN LYS 49 -5.027 14.691 -23.393 418 HA LYS 49 HA LYS 49 -4.325 15.489 -26.040 419 HB2 LYS 49 HB2 LYS 49 -3.452 13.138 -24.371 420 HB3 LYS 49 HB1 LYS 49 -2.852 13.428 -25.997 421 HG2 LYS 49 HG2 LYS 49 -2.115 15.703 -25.190 422 HG3 LYS 49 HG1 LYS 49 -2.481 15.144 -23.557 423 HD2 LYS 49 HD2 LYS 49 -0.599 13.736 -25.443 424 HD3 LYS 49 HD1 LYS 49 -0.082 14.911 -24.234 425 HE2 LYS 49 HE2 LYS 49 -1.059 13.484 -22.475 426 HE3 LYS 49 HE1 LYS 49 -1.493 12.297 -23.705 427 HZ1 LYS 49 HZ1 LYS 49 1.092 12.572 -24.209 428 HZ2 LYS 49 HZ2 LYS 49 0.489 11.437 -23.110 429 HZ3 LYS 49 HZ3 LYS 49 1.106 12.910 -22.552 430 H ASN 50 HN ASN 50 -6.251 12.868 -24.711 431 HA ASN 50 HA ASN 50 -7.029 12.189 -27.470 432 HB2 ASN 50 HB2 ASN 50 -6.755 10.283 -25.137 433 HB3 ASN 50 HB1 ASN 50 -7.399 9.858 -26.717 434 HD21 ASN 50 HD21 ASN 50 -4.622 10.179 -24.814 435 HD22 ASN 50 HD22 ASN 50 -3.449 9.868 -26.043 436 HA PRO 51 HA PRO 51 -10.731 13.753 -25.241 437 HB2 PRO 51 HB2 PRO 51 -11.400 14.372 -28.071 438 HB3 PRO 51 HB1 PRO 51 -11.505 15.406 -26.641 439 HG2 PRO 51 HG2 PRO 51 -9.561 15.797 -28.403 440 HG3 PRO 51 HG1 PRO 51 -9.209 15.880 -26.665 441 HD2 PRO 51 HD2 PRO 51 -8.724 13.628 -28.582 442 HD3 PRO 51 HD1 PRO 51 -7.631 14.318 -27.359 443 H GLN 52 HN GLN 52 -10.380 11.791 -28.121 444 HA GLN 52 HA GLN 52 -13.008 10.782 -28.283 445 HB2 GLN 52 HB2 GLN 52 -10.364 9.650 -29.209 446 HB3 GLN 52 HB1 GLN 52 -11.909 8.892 -29.559 447 HG2 GLN 52 HG2 GLN 52 -11.637 10.088 -31.469 448 HG3 GLN 52 HG1 GLN 52 -12.484 11.290 -30.497 449 HE21 GLN 52 HE21 GLN 52 -9.175 10.166 -31.125 450 HE22 GLN 52 HE22 GLN 52 -8.469 11.742 -31.173 451 H LEU 53 HN LEU 53 -10.126 9.652 -26.569 452 HA LEU 53 HA LEU 53 -11.384 7.260 -25.715 453 HB2 LEU 53 HB2 LEU 53 -8.906 8.662 -24.711 454 HB3 LEU 53 HB1 LEU 53 -9.458 7.120 -24.082 455 HG LEU 53 HG LEU 53 -8.706 7.626 -26.962 456 HD11 LEU 53 HD11 LEU 53 -7.160 6.249 -24.771 457 HD12 LEU 53 HD12 LEU 53 -6.761 7.799 -25.509 458 HD13 LEU 53 HD13 LEU 53 -6.698 6.323 -26.471 459 HD21 LEU 53 HD21 LEU 53 -9.835 5.320 -25.492 460 HD22 LEU 53 HD22 LEU 53 -8.574 4.979 -26.678 461 HD23 LEU 53 HD23 LEU 53 -10.046 5.815 -27.173 462 H ALA 54 HN ALA 54 -11.002 10.494 -24.400 463 HA ALA 54 HA ALA 54 -11.966 9.973 -21.800 464 HB1 ALA 54 HB1 ALA 54 -10.751 12.053 -22.636 465 HB2 ALA 54 HB2 ALA 54 -12.093 12.294 -21.514 466 HB3 ALA 54 HB3 ALA 54 -12.322 12.579 -23.241 467 H GLU 55 HN GLU 55 -13.505 10.923 -24.822 468 HA GLU 55 HA GLU 55 -16.148 11.193 -23.804 469 HB2 GLU 55 HB2 GLU 55 -15.413 12.161 -25.966 470 HB3 GLU 55 HB1 GLU 55 -15.256 10.538 -26.622 471 HG2 GLU 55 HG2 GLU 55 -17.646 10.170 -26.324 472 HG3 GLU 55 HG1 GLU 55 -17.815 11.780 -25.630 473 H GLU 56 HN GLU 56 -14.338 8.495 -25.160 474 HA GLU 56 HA GLU 56 -16.463 6.675 -25.383 475 HB2 GLU 56 HB2 GLU 56 -13.514 6.230 -24.886 476 HB3 GLU 56 HB1 GLU 56 -14.648 4.921 -25.187 477 HG2 GLU 56 HG2 GLU 56 -14.006 7.186 -27.079 478 HG3 GLU 56 HG1 GLU 56 -13.432 5.520 -27.207 479 H ASP 57 HN ASP 57 -14.306 7.410 -22.645 480 HA ASP 57 HA ASP 57 -15.948 5.648 -20.983 481 HB2 ASP 57 HB2 ASP 57 -13.267 6.989 -20.472 482 HB3 ASP 57 HB1 ASP 57 -14.174 6.180 -19.197 483 H LYS 58 HN LYS 58 -16.415 8.529 -22.036 484 HA LYS 58 HA LYS 58 -17.480 10.415 -21.376 485 HB2 LYS 58 HB2 LYS 58 -18.731 8.513 -19.397 486 HB3 LYS 58 HB1 LYS 58 -19.375 10.085 -19.853 487 HG2 LYS 58 HG2 LYS 58 -20.533 9.039 -21.432 488 HG3 LYS 58 HG1 LYS 58 -19.004 8.772 -22.272 489 HD2 LYS 58 HD2 LYS 58 -18.736 6.652 -21.017 490 HD3 LYS 58 HD1 LYS 58 -20.322 6.915 -20.287 491 HE2 LYS 58 HE2 LYS 58 -20.620 5.419 -22.115 492 HE3 LYS 58 HE1 LYS 58 -21.278 6.982 -22.599 493 HZ1 LYS 58 HZ1 LYS 58 -19.923 5.916 -24.337 494 HZ2 LYS 58 HZ2 LYS 58 -18.566 5.998 -23.324 495 HZ3 LYS 58 HZ3 LYS 58 -19.307 7.421 -23.869 496 H ILE 59 HN ILE 59 -15.041 10.629 -20.419 497 HA ILE 59 HA ILE 59 -15.159 11.190 -17.555 498 HB ILE 59 HB ILE 59 -12.845 11.522 -19.473 499 HG12 ILE 59 HG12 ILE 59 -13.561 9.190 -19.373 500 HG13 ILE 59 HG11 ILE 59 -12.019 9.393 -18.547 501 HG21 ILE 59 HG21 ILE 59 -11.636 11.212 -17.151 502 HG22 ILE 59 HG22 ILE 59 -13.157 11.847 -16.528 503 HG23 ILE 59 HG23 ILE 59 -12.209 12.795 -17.675 504 HD11 ILE 59 HD11 ILE 59 -13.686 9.692 -16.473 505 HD12 ILE 59 HD12 ILE 59 -13.035 8.136 -16.986 506 HD13 ILE 59 HD13 ILE 59 -14.653 8.623 -17.488 507 H LEU 60 HN LEU 60 -16.107 13.064 -17.039 508 HA LEU 60 HA LEU 60 -15.512 15.437 -18.673 509 HB2 LEU 60 HB2 LEU 60 -17.829 14.942 -16.803 510 HB3 LEU 60 HB1 LEU 60 -17.565 16.409 -17.724 511 HG LEU 60 HG LEU 60 -18.094 13.681 -18.910 512 HD11 LEU 60 HD11 LEU 60 -20.259 14.639 -19.554 513 HD12 LEU 60 HD12 LEU 60 -19.871 16.102 -18.649 514 HD13 LEU 60 HD13 LEU 60 -20.062 14.566 -17.803 515 HD21 LEU 60 HD21 LEU 60 -16.822 14.817 -20.502 516 HD22 LEU 60 HD22 LEU 60 -17.552 16.374 -20.112 517 HD23 LEU 60 HD23 LEU 60 -18.486 15.153 -20.977 518 H ALA 61 HN ALA 61 -14.407 14.037 -15.967 519 HA ALA 61 HA ALA 61 -13.633 16.605 -14.820 520 HB1 ALA 61 HB1 ALA 61 -14.517 14.527 -12.877 521 HB2 ALA 61 HB2 ALA 61 -15.738 15.517 -13.677 522 HB3 ALA 61 HB3 ALA 61 -14.476 16.282 -12.713 523 H THR 62 HN THR 62 -11.743 16.535 -13.567 524 HA THR 62 HA THR 62 -10.286 14.034 -13.300 525 HB THR 62 HB THR 62 -8.228 15.027 -14.290 526 HG1 THR 62 HG1 THR 62 -9.387 17.256 -14.127 527 HG21 THR 62 HG21 THR 62 -9.440 13.524 -15.709 528 HG22 THR 62 HG22 THR 62 -8.925 14.897 -16.693 529 HG23 THR 62 HG23 THR 62 -10.598 14.782 -16.141 530 HA PRO 63 HA PRO 63 -8.238 13.528 -12.704 531 HB2 PRO 63 HB2 PRO 63 -7.481 12.781 -9.988 532 HB3 PRO 63 HB1 PRO 63 -6.439 13.069 -11.384 533 HG2 PRO 63 HG2 PRO 63 -6.494 14.733 -9.247 534 HG3 PRO 63 HG1 PRO 63 -6.180 15.305 -10.896 535 HD2 PRO 63 HD2 PRO 63 -8.746 15.376 -9.331 536 HD3 PRO 63 HD1 PRO 63 -7.994 16.657 -10.312 537 H THR 64 HN THR 64 -9.102 11.474 -12.719 538 HA THR 64 HA THR 64 -11.177 10.881 -10.725 539 HB THR 64 HB THR 64 -11.472 10.414 -13.704 540 HG1 THR 64 HG1 THR 64 -12.294 12.372 -13.571 541 HG21 THR 64 HG21 THR 64 -13.548 9.376 -13.279 542 HG22 THR 64 HG22 THR 64 -13.544 9.881 -11.589 543 HG23 THR 64 HG23 THR 64 -12.425 8.633 -12.139 544 H LEU 65 HN LEU 65 -11.035 8.917 -9.866 545 HA LEU 65 HA LEU 65 -9.039 7.042 -10.964 546 HB2 LEU 65 HB2 LEU 65 -9.967 7.737 -8.254 547 HB3 LEU 65 HB1 LEU 65 -9.679 6.032 -8.546 548 HG LEU 65 HG LEU 65 -7.658 8.237 -8.960 549 HD11 LEU 65 HD11 LEU 65 -7.053 8.001 -6.835 550 HD12 LEU 65 HD12 LEU 65 -7.005 6.245 -6.983 551 HD13 LEU 65 HD13 LEU 65 -8.520 7.055 -6.585 552 HD21 LEU 65 HD21 LEU 65 -6.871 6.664 -10.399 553 HD22 LEU 65 HD22 LEU 65 -7.706 5.342 -9.587 554 HD23 LEU 65 HD23 LEU 65 -6.217 5.992 -8.906 555 H ALA 66 HN ALA 66 -9.715 5.260 -11.932 556 HA ALA 66 HA ALA 66 -12.207 4.010 -11.019 557 HB1 ALA 66 HB1 ALA 66 -13.268 3.983 -13.074 558 HB2 ALA 66 HB2 ALA 66 -11.777 4.263 -13.970 559 HB3 ALA 66 HB3 ALA 66 -12.532 5.585 -13.081 560 H LYS 67 HN LYS 67 -11.998 1.917 -10.789 561 HA LYS 67 HA LYS 67 -9.612 0.640 -11.908 562 HB2 LYS 67 HB2 LYS 67 -9.889 0.403 -9.490 563 HB3 LYS 67 HB1 LYS 67 -11.518 -0.208 -9.707 564 HG2 LYS 67 HG2 LYS 67 -9.545 -1.817 -11.113 565 HG3 LYS 67 HG1 LYS 67 -9.230 -1.712 -9.381 566 HD2 LYS 67 HD2 LYS 67 -12.043 -2.187 -10.075 567 HD3 LYS 67 HD1 LYS 67 -10.942 -3.477 -10.559 568 HE2 LYS 67 HE2 LYS 67 -11.160 -2.323 -7.779 569 HE3 LYS 67 HE1 LYS 67 -11.876 -3.841 -8.317 570 HZ1 LYS 67 HZ1 LYS 67 -9.293 -4.104 -9.040 571 HZ2 LYS 67 HZ2 LYS 67 -9.972 -4.733 -7.624 572 HZ3 LYS 67 HZ3 LYS 67 -9.159 -3.245 -7.586 573 H VAL 68 HN VAL 68 -10.128 0.011 -13.924 574 HA VAL 68 HA VAL 68 -12.714 -0.885 -14.680 575 HB VAL 68 HB VAL 68 -10.090 -0.992 -16.122 576 HG11 VAL 68 HG11 VAL 68 -12.470 -1.167 -17.779 577 HG12 VAL 68 HG12 VAL 68 -12.267 -2.563 -16.720 578 HG13 VAL 68 HG13 VAL 68 -10.981 -2.110 -17.839 579 HG21 VAL 68 HG21 VAL 68 -12.469 0.799 -16.532 580 HG22 VAL 68 HG22 VAL 68 -10.928 0.882 -17.383 581 HG23 VAL 68 HG23 VAL 68 -11.004 1.248 -15.660 582 H LEU 69 HN LEU 69 -9.712 -2.499 -13.801 583 HA LEU 69 HA LEU 69 -11.197 -5.053 -13.955 584 HB2 LEU 69 HB2 LEU 69 -8.313 -4.632 -14.728 585 HB3 LEU 69 HB1 LEU 69 -9.108 -6.189 -14.631 586 HG LEU 69 HG LEU 69 -9.923 -3.981 -16.523 587 HD11 LEU 69 HD11 LEU 69 -7.923 -6.149 -16.729 588 HD12 LEU 69 HD12 LEU 69 -7.984 -4.576 -17.525 589 HD13 LEU 69 HD13 LEU 69 -8.978 -5.905 -18.122 590 HD21 LEU 69 HD21 LEU 69 -10.838 -6.808 -16.099 591 HD22 LEU 69 HD22 LEU 69 -11.060 -5.981 -17.640 592 HD23 LEU 69 HD23 LEU 69 -11.801 -5.332 -16.178 593 HA PRO 70 HA PRO 70 -11.257 -6.990 -13.319 594 HB2 PRO 70 HB2 PRO 70 -12.509 -8.273 -11.317 595 HB3 PRO 70 HB1 PRO 70 -10.853 -8.680 -11.788 596 HG2 PRO 70 HG2 PRO 70 -11.807 -6.963 -9.524 597 HG3 PRO 70 HG1 PRO 70 -10.556 -8.221 -9.520 598 HD2 PRO 70 HD2 PRO 70 -9.989 -5.566 -9.687 599 HD3 PRO 70 HD1 PRO 70 -8.968 -6.819 -10.421 600 HA PRO 71 HA PRO 71 -14.960 -4.538 -13.244 601 HB2 PRO 71 HB2 PRO 71 -16.738 -6.279 -14.341 602 HB3 PRO 71 HB1 PRO 71 -15.482 -5.469 -15.287 603 HG2 PRO 71 HG2 PRO 71 -15.483 -8.232 -14.120 604 HG3 PRO 71 HG1 PRO 71 -14.999 -7.708 -15.744 605 HD2 PRO 71 HD2 PRO 71 -13.185 -8.186 -13.819 606 HD3 PRO 71 HD1 PRO 71 -12.961 -6.887 -15.009 607 HA PRO 72 HA PRO 72 -17.305 -4.014 -13.338 608 HB2 PRO 72 HB2 PRO 72 -18.629 -2.398 -11.637 609 HB3 PRO 72 HB1 PRO 72 -19.347 -3.883 -12.276 610 HG2 PRO 72 HG2 PRO 72 -18.018 -3.413 -9.627 611 HG3 PRO 72 HG1 PRO 72 -19.545 -4.250 -9.975 612 HD2 PRO 72 HD2 PRO 72 -17.225 -5.578 -9.547 613 HD3 PRO 72 HD1 PRO 72 -18.476 -6.180 -10.650 614 H VAL 73 HN VAL 73 -16.885 -1.710 -13.546 615 HA VAL 73 HA VAL 73 -14.271 -1.013 -12.654 616 HB VAL 73 HB VAL 73 -16.352 0.699 -14.038 617 HG11 VAL 73 HG11 VAL 73 -13.389 1.139 -14.138 618 HG12 VAL 73 HG12 VAL 73 -14.373 1.836 -12.849 619 HG13 VAL 73 HG13 VAL 73 -14.694 2.259 -14.532 620 HG21 VAL 73 HG21 VAL 73 -14.242 -0.080 -15.767 621 HG22 VAL 73 HG22 VAL 73 -15.955 -0.483 -15.874 622 HG23 VAL 73 HG23 VAL 73 -14.859 -1.529 -14.974 623 H ARG 74 HN ARG 74 -13.686 0.013 -10.844 624 HA ARG 74 HA ARG 74 -15.742 1.143 -9.084 625 HB2 ARG 74 HB2 ARG 74 -12.797 0.834 -8.501 626 HB3 ARG 74 HB1 ARG 74 -14.095 1.078 -7.346 627 HG2 ARG 74 HG2 ARG 74 -13.730 -1.383 -9.034 628 HG3 ARG 74 HG1 ARG 74 -13.215 -1.211 -7.355 629 HD2 ARG 74 HD2 ARG 74 -16.062 -0.883 -8.300 630 HD3 ARG 74 HD1 ARG 74 -15.405 -2.386 -7.656 631 HE ARG 74 HE ARG 74 -14.876 -0.450 -5.764 632 HH11 ARG 74 HH11 ARG 74 -17.699 -1.803 -7.286 633 HH12 ARG 74 HH12 ARG 74 -18.724 -1.551 -5.914 634 HH21 ARG 74 HH21 ARG 74 -16.209 -0.114 -3.946 635 HH22 ARG 74 HH22 ARG 74 -17.873 -0.587 -4.008 636 H ARG 75 HN ARG 75 -16.177 3.261 -9.303 637 HA ARG 75 HA ARG 75 -13.992 4.999 -10.186 638 HB2 ARG 75 HB2 ARG 75 -16.969 5.459 -10.140 639 HB3 ARG 75 HB1 ARG 75 -15.785 6.681 -10.576 640 HG2 ARG 75 HG2 ARG 75 -14.989 5.142 -12.381 641 HG3 ARG 75 HG1 ARG 75 -16.383 4.118 -12.021 642 HD2 ARG 75 HD2 ARG 75 -16.505 7.023 -12.821 643 HD3 ARG 75 HD1 ARG 75 -16.787 5.660 -13.904 644 HE ARG 75 HE ARG 75 -18.576 6.665 -11.849 645 HH11 ARG 75 HH11 ARG 75 -17.830 4.104 -14.093 646 HH12 ARG 75 HH12 ARG 75 -19.441 3.467 -14.105 647 HH21 ARG 75 HH21 ARG 75 -20.697 5.837 -11.854 648 HH22 ARG 75 HH22 ARG 75 -21.076 4.455 -12.829 649 H ILE 76 HN ILE 76 -12.969 6.151 -8.789 650 HA ILE 76 HA ILE 76 -14.205 6.740 -6.177 651 HB ILE 76 HB ILE 76 -11.279 6.555 -6.892 652 HG12 ILE 76 HG12 ILE 76 -12.987 4.685 -5.234 653 HG13 ILE 76 HG11 ILE 76 -12.554 4.400 -6.918 654 HG21 ILE 76 HG21 ILE 76 -11.375 6.380 -4.200 655 HG22 ILE 76 HG22 ILE 76 -12.726 7.478 -4.489 656 HG23 ILE 76 HG23 ILE 76 -11.114 7.892 -5.072 657 HD11 ILE 76 HD11 ILE 76 -11.169 3.176 -5.286 658 HD12 ILE 76 HD12 ILE 76 -10.567 4.729 -4.702 659 HD13 ILE 76 HD13 ILE 76 -10.253 4.230 -6.364 660 H ILE 77 HN ILE 77 -14.788 8.827 -5.923 661 HA ILE 77 HA ILE 77 -13.230 10.894 -7.327 662 HB ILE 77 HB ILE 77 -16.187 11.009 -6.747 663 HG12 ILE 77 HG12 ILE 77 -15.749 11.129 -9.511 664 HG13 ILE 77 HG11 ILE 77 -14.709 9.826 -8.940 665 HG21 ILE 77 HG21 ILE 77 -16.245 13.069 -7.861 666 HG22 ILE 77 HG22 ILE 77 -14.634 12.845 -8.544 667 HG23 ILE 77 HG23 ILE 77 -14.824 13.168 -6.821 668 HD11 ILE 77 HD11 ILE 77 -16.945 9.073 -9.655 669 HD12 ILE 77 HD12 ILE 77 -17.653 10.037 -8.358 670 HD13 ILE 77 HD13 ILE 77 -16.583 8.688 -7.972 671 H GLY 78 HN GLY 78 -12.340 12.408 -6.057 672 HA2 GLY 78 HA2 GLY 78 -13.435 13.746 -3.934 673 HA3 GLY 78 HA1 GLY 78 -12.717 12.310 -3.217 674 H ASP 79 HN ASP 79 -11.360 13.902 -2.071 675 HA ASP 79 HA ASP 79 -9.396 15.349 -3.629 676 HB2 ASP 79 HB2 ASP 79 -10.258 16.249 -1.474 677 HB3 ASP 79 HB1 ASP 79 -9.538 14.879 -0.635 678 H LEU 80 HN LEU 80 -8.051 14.010 -4.703 679 HA LEU 80 HA LEU 80 -7.007 11.638 -3.397 680 HB2 LEU 80 HB2 LEU 80 -6.556 12.707 -6.187 681 HB3 LEU 80 HB1 LEU 80 -5.994 11.157 -5.594 682 HG LEU 80 HG LEU 80 -8.891 11.966 -5.867 683 HD11 LEU 80 HD11 LEU 80 -8.527 11.544 -8.031 684 HD12 LEU 80 HD12 LEU 80 -8.453 9.852 -7.540 685 HD13 LEU 80 HD13 LEU 80 -6.966 10.783 -7.718 686 HD21 LEU 80 HD21 LEU 80 -7.529 9.485 -4.879 687 HD22 LEU 80 HD22 LEU 80 -9.145 9.421 -5.582 688 HD23 LEU 80 HD23 LEU 80 -8.846 10.398 -4.144 689 H SER 81 HN SER 81 -6.083 14.833 -3.480 690 HA SER 81 HA SER 81 -3.268 14.536 -3.851 691 HB2 SER 81 HB2 SER 81 -4.868 16.714 -2.470 692 HB3 SER 81 HB1 SER 81 -3.138 16.807 -2.804 693 HG SER 81 HG SER 81 -3.588 17.332 -4.784 694 H ASN 82 HN ASN 82 -5.427 13.946 -1.269 695 HA ASN 82 HA ASN 82 -3.422 13.966 0.804 696 HB2 ASN 82 HB2 ASN 82 -5.744 14.548 1.342 697 HB3 ASN 82 HB1 ASN 82 -6.270 12.963 0.798 698 HD21 ASN 82 HD21 ASN 82 -4.418 14.671 3.233 699 HD22 ASN 82 HD22 ASN 82 -4.519 13.439 4.440 700 H ARG 83 HN ARG 83 -2.002 12.388 1.028 701 HA ARG 83 HA ARG 83 -2.054 10.057 -0.488 702 HB2 ARG 83 HB2 ARG 83 -0.443 10.743 1.975 703 HB3 ARG 83 HB1 ARG 83 -0.201 9.256 1.072 704 HG2 ARG 83 HG2 ARG 83 0.480 10.469 -0.875 705 HG3 ARG 83 HG1 ARG 83 0.045 12.007 -0.129 706 HD2 ARG 83 HD2 ARG 83 2.156 10.131 0.928 707 HD3 ARG 83 HD1 ARG 83 2.488 11.517 -0.111 708 HE ARG 83 HE ARG 83 1.034 12.446 2.070 709 HH11 ARG 83 HH11 ARG 83 4.124 10.972 1.441 710 HH12 ARG 83 HH12 ARG 83 4.909 11.728 2.788 711 HH21 ARG 83 HH21 ARG 83 2.050 13.451 3.847 712 HH22 ARG 83 HH22 ARG 83 3.725 13.141 4.160 713 H GLU 84 HN GLU 84 -3.192 10.581 2.813 714 HA GLU 84 HA GLU 84 -3.543 7.884 3.522 715 HB2 GLU 84 HB2 GLU 84 -4.916 10.405 4.402 716 HB3 GLU 84 HB1 GLU 84 -5.378 8.828 5.034 717 HG2 GLU 84 HG2 GLU 84 -3.192 8.475 5.927 718 HG3 GLU 84 HG1 GLU 84 -2.590 9.950 5.166 719 H LYS 85 HN LYS 85 -5.837 10.115 1.869 720 HA LYS 85 HA LYS 85 -7.896 8.167 1.805 721 HB2 LYS 85 HB2 LYS 85 -7.412 10.592 0.056 722 HB3 LYS 85 HB1 LYS 85 -8.822 9.557 -0.129 723 HG2 LYS 85 HG2 LYS 85 -9.509 10.102 2.158 724 HG3 LYS 85 HG1 LYS 85 -8.108 11.166 2.314 725 HD2 LYS 85 HD2 LYS 85 -8.938 12.471 0.367 726 HD3 LYS 85 HD1 LYS 85 -10.369 11.441 0.333 727 HE2 LYS 85 HE2 LYS 85 -9.526 13.170 2.658 728 HE3 LYS 85 HE1 LYS 85 -10.789 13.568 1.493 729 HZ1 LYS 85 HZ1 LYS 85 -11.654 11.209 2.280 730 HZ2 LYS 85 HZ2 LYS 85 -12.063 12.635 3.092 731 HZ3 LYS 85 HZ3 LYS 85 -10.823 11.649 3.687 732 H VAL 86 HN VAL 86 -5.352 8.938 -0.523 733 HA VAL 86 HA VAL 86 -6.222 7.121 -2.499 734 HB VAL 86 HB VAL 86 -3.451 8.186 -1.906 735 HG11 VAL 86 HG11 VAL 86 -4.315 6.794 -4.434 736 HG12 VAL 86 HG12 VAL 86 -3.488 5.958 -3.119 737 HG13 VAL 86 HG13 VAL 86 -2.690 7.290 -3.957 738 HG21 VAL 86 HG21 VAL 86 -4.309 10.022 -2.835 739 HG22 VAL 86 HG22 VAL 86 -5.797 9.185 -3.276 740 HG23 VAL 86 HG23 VAL 86 -4.398 9.120 -4.348 741 H LEU 87 HN LEU 87 -3.964 6.727 0.227 742 HA LEU 87 HA LEU 87 -3.300 4.028 -0.328 743 HB2 LEU 87 HB2 LEU 87 -1.882 5.407 1.076 744 HB3 LEU 87 HB1 LEU 87 -3.193 5.671 2.207 745 HG LEU 87 HG LEU 87 -3.138 3.274 2.786 746 HD11 LEU 87 HD11 LEU 87 -2.236 2.328 0.773 747 HD12 LEU 87 HD12 LEU 87 -1.153 1.954 2.114 748 HD13 LEU 87 HD13 LEU 87 -0.735 3.234 0.972 749 HD21 LEU 87 HD21 LEU 87 -0.408 4.474 3.127 750 HD22 LEU 87 HD22 LEU 87 -1.300 3.442 4.242 751 HD23 LEU 87 HD23 LEU 87 -1.824 5.105 3.968 752 H ILE 88 HN ILE 88 -5.704 5.473 1.854 753 HA ILE 88 HA ILE 88 -6.623 3.029 2.912 754 HB ILE 88 HB ILE 88 -7.929 5.729 2.689 755 HG12 ILE 88 HG12 ILE 88 -6.954 4.218 5.115 756 HG13 ILE 88 HG11 ILE 88 -5.914 5.285 4.179 757 HG21 ILE 88 HG21 ILE 88 -9.624 4.889 4.294 758 HG22 ILE 88 HG22 ILE 88 -9.002 3.257 4.046 759 HG23 ILE 88 HG23 ILE 88 -9.738 4.134 2.703 760 HD11 ILE 88 HD11 ILE 88 -6.576 6.901 5.532 761 HD12 ILE 88 HD12 ILE 88 -7.877 5.909 6.198 762 HD13 ILE 88 HD13 ILE 88 -8.139 6.826 4.714 763 H ALA 89 HN ALA 89 -7.833 4.978 0.176 764 HA ALA 89 HA ALA 89 -9.967 3.248 -0.494 765 HB1 ALA 89 HB1 ALA 89 -9.134 5.698 -1.363 766 HB2 ALA 89 HB2 ALA 89 -10.409 4.735 -2.111 767 HB3 ALA 89 HB3 ALA 89 -8.765 4.671 -2.749 768 H LEU 90 HN LEU 90 -6.600 3.368 -1.560 769 HA LEU 90 HA LEU 90 -6.824 1.330 -3.526 770 HB2 LEU 90 HB2 LEU 90 -4.919 3.127 -2.950 771 HB3 LEU 90 HB1 LEU 90 -4.244 1.753 -2.101 772 HG LEU 90 HG LEU 90 -3.492 2.228 -4.520 773 HD11 LEU 90 HD11 LEU 90 -3.399 -0.252 -4.970 774 HD12 LEU 90 HD12 LEU 90 -4.334 -0.461 -3.488 775 HD13 LEU 90 HD13 LEU 90 -2.737 0.292 -3.426 776 HD21 LEU 90 HD21 LEU 90 -6.058 2.269 -5.165 777 HD22 LEU 90 HD22 LEU 90 -5.791 0.535 -5.348 778 HD23 LEU 90 HD23 LEU 90 -4.832 1.680 -6.288 779 H ARG 91 HN ARG 91 -6.022 1.308 -0.078 780 HA ARG 91 HA ARG 91 -5.285 -1.426 0.133 781 HB2 ARG 91 HB2 ARG 91 -4.779 0.272 1.856 782 HB3 ARG 91 HB1 ARG 91 -6.495 0.410 2.211 783 HG2 ARG 91 HG2 ARG 91 -6.549 -1.896 2.969 784 HG3 ARG 91 HG1 ARG 91 -4.843 -2.084 2.560 785 HD2 ARG 91 HD2 ARG 91 -4.255 -0.371 4.196 786 HD3 ARG 91 HD1 ARG 91 -5.959 -0.151 4.589 787 HE ARG 91 HE ARG 91 -5.320 -2.846 4.955 788 HH11 ARG 91 HH11 ARG 91 -4.559 0.259 6.333 789 HH12 ARG 91 HH12 ARG 91 -4.268 -0.368 7.923 790 HH21 ARG 91 HH21 ARG 91 -4.943 -3.689 7.039 791 HH22 ARG 91 HH22 ARG 91 -4.487 -2.621 8.324 792 H LEU 92 HN LEU 92 -8.399 0.241 0.575 793 HA LEU 92 HA LEU 92 -9.856 -2.048 1.320 794 HB2 LEU 92 HB2 LEU 92 -10.725 0.524 0.006 795 HB3 LEU 92 HB1 LEU 92 -11.855 -0.714 0.519 796 HG LEU 92 HG LEU 92 -9.942 0.698 2.381 797 HD11 LEU 92 HD11 LEU 92 -12.046 1.839 3.174 798 HD12 LEU 92 HD12 LEU 92 -12.814 1.269 1.693 799 HD13 LEU 92 HD13 LEU 92 -11.432 2.363 1.606 800 HD21 LEU 92 HD21 LEU 92 -11.714 -0.191 4.040 801 HD22 LEU 92 HD22 LEU 92 -10.505 -1.309 3.408 802 HD23 LEU 92 HD23 LEU 92 -12.137 -1.308 2.742 803 H LEU 93 HN LEU 93 -9.138 -0.662 -1.846 804 HA LEU 93 HA LEU 93 -10.823 -2.376 -3.348 805 HB2 LEU 93 HB2 LEU 93 -8.315 -0.878 -4.090 806 HB3 LEU 93 HB1 LEU 93 -9.256 -1.797 -5.248 807 HG LEU 93 HG LEU 93 -10.340 0.524 -3.651 808 HD11 LEU 93 HD11 LEU 93 -8.586 0.514 -5.894 809 HD12 LEU 93 HD12 LEU 93 -9.324 1.888 -5.072 810 HD13 LEU 93 HD13 LEU 93 -10.164 1.106 -6.412 811 HD21 LEU 93 HD21 LEU 93 -11.713 -0.017 -6.090 812 HD22 LEU 93 HD22 LEU 93 -12.328 -0.071 -4.439 813 HD23 LEU 93 HD23 LEU 93 -11.604 -1.510 -5.157 814 H ALA 94 HN ALA 94 -7.449 -2.601 -2.322 815 HA ALA 94 HA ALA 94 -6.797 -4.935 -3.745 816 HB1 ALA 94 HB1 ALA 94 -5.544 -4.175 -1.125 817 HB2 ALA 94 HB2 ALA 94 -5.209 -3.297 -2.620 818 HB3 ALA 94 HB3 ALA 94 -4.810 -5.011 -2.495 819 H GLU 95 HN GLU 95 -8.198 -4.473 -0.527 820 HA GLU 95 HA GLU 95 -7.993 -7.139 0.333 821 HB2 GLU 95 HB2 GLU 95 -9.916 -4.923 1.039 822 HB3 GLU 95 HB1 GLU 95 -9.934 -6.489 1.840 823 HG2 GLU 95 HG2 GLU 95 -7.727 -6.149 2.699 824 HG3 GLU 95 HG1 GLU 95 -7.533 -4.679 1.744 825 H GLU 96 HN GLU 96 -10.415 -5.425 -1.555 826 HA GLU 96 HA GLU 96 -12.376 -7.444 -1.663 827 HB2 GLU 96 HB2 GLU 96 -11.656 -5.209 -3.575 828 HB3 GLU 96 HB1 GLU 96 -13.053 -6.255 -3.806 829 HG2 GLU 96 HG2 GLU 96 -14.062 -5.473 -1.784 830 HG3 GLU 96 HG1 GLU 96 -12.604 -4.586 -1.341 831 H ILE 97 HN ILE 97 -9.563 -6.734 -3.633 832 HA ILE 97 HA ILE 97 -9.944 -8.659 -5.657 833 HB ILE 97 HB ILE 97 -7.443 -7.330 -4.606 834 HG12 ILE 97 HG12 ILE 97 -8.985 -6.794 -7.139 835 HG13 ILE 97 HG11 ILE 97 -9.342 -5.977 -5.620 836 HG21 ILE 97 HG21 ILE 97 -7.839 -9.043 -7.060 837 HG22 ILE 97 HG22 ILE 97 -6.715 -9.317 -5.729 838 HG23 ILE 97 HG23 ILE 97 -6.460 -7.965 -6.833 839 HD11 ILE 97 HD11 ILE 97 -7.480 -4.718 -5.699 840 HD12 ILE 97 HD12 ILE 97 -7.744 -4.945 -7.428 841 HD13 ILE 97 HD13 ILE 97 -6.550 -5.933 -6.578 842 H GLY 98 HN GLY 98 -8.117 -8.720 -2.615 843 HA2 GLY 98 HA2 GLY 98 -7.030 -11.305 -2.870 844 HA3 GLY 98 HA1 GLY 98 -7.277 -10.451 -1.356 845 H ASP 99 HN ASP 99 -10.123 -10.204 -1.618 846 HA ASP 99 HA ASP 99 -10.963 -12.609 -0.421 847 HB2 ASP 99 HB2 ASP 99 -12.062 -10.410 -0.065 848 HB3 ASP 99 HB1 ASP 99 -12.689 -10.481 -1.708 849 H TYR 100 HN TYR 100 -11.275 -11.409 -3.727 850 HA TYR 100 HA TYR 100 -12.897 -13.554 -4.650 851 HB2 TYR 100 HB2 TYR 100 -12.879 -11.387 -5.798 852 HB3 TYR 100 HB1 TYR 100 -11.169 -11.579 -6.165 853 HD1 TYR 100 HD1 TYR 100 -14.502 -13.114 -6.798 854 HD2 TYR 100 HD2 TYR 100 -10.501 -12.606 -8.158 855 HE1 TYR 100 HE1 TYR 100 -15.089 -14.206 -8.922 856 HE2 TYR 100 HE2 TYR 100 -11.079 -13.697 -10.284 857 HH TYR 100 HH TYR 100 -13.153 -15.542 -10.901 858 H LYS 101 HN LYS 101 -12.293 -15.529 -5.173 859 HA LYS 101 HA LYS 101 -9.422 -16.100 -5.386 860 HB2 LYS 101 HB2 LYS 101 -11.681 -18.024 -4.803 861 HB3 LYS 101 HB1 LYS 101 -9.965 -18.403 -4.783 862 HG2 LYS 101 HG2 LYS 101 -11.373 -16.498 -2.920 863 HG3 LYS 101 HG1 LYS 101 -10.843 -18.135 -2.529 864 HD2 LYS 101 HD2 LYS 101 -8.516 -17.465 -2.961 865 HD3 LYS 101 HD1 LYS 101 -9.066 -15.822 -3.302 866 HE2 LYS 101 HE2 LYS 101 -9.977 -15.679 -1.020 867 HE3 LYS 101 HE1 LYS 101 -9.360 -17.295 -0.686 868 HZ1 LYS 101 HZ1 LYS 101 -7.853 -14.796 -1.131 869 HZ2 LYS 101 HZ2 LYS 101 -7.113 -16.304 -1.362 870 HZ3 LYS 101 HZ3 LYS 101 -7.736 -15.893 0.156 871 H ASP 102 HN ASP 102 -8.570 -17.002 -7.169 872 HA ASP 102 HA ASP 102 -10.411 -17.564 -9.397 873 HB2 ASP 102 HB2 ASP 102 -9.018 -15.731 -10.001 874 HB3 ASP 102 HB1 ASP 102 -7.577 -16.524 -9.375 875 H ASP 103 HN ASP 103 -7.285 -18.581 -8.022 876 HA ASP 103 HA ASP 103 -7.504 -21.143 -9.401 877 HB2 ASP 103 HB2 ASP 103 -5.331 -19.867 -9.318 878 HB3 ASP 103 HB1 ASP 103 -5.283 -20.179 -7.586 879 H ASP 104 HN ASP 104 -8.734 -22.623 -8.438 880 HA ASP 104 HA ASP 104 -8.957 -22.665 -5.522 881 HB2 ASP 104 HB2 ASP 104 -10.951 -22.767 -7.191 882 HB3 ASP 104 HB1 ASP 104 -10.504 -24.462 -7.365 883 H ASP 105 HN ASP 105 -6.681 -23.809 -7.332 884 HA ASP 105 HA ASP 105 -6.474 -26.322 -5.830 885 HB2 ASP 105 HB2 ASP 105 -7.254 -26.543 -8.342 886 HB3 ASP 105 HB1 ASP 105 -5.545 -26.294 -8.676 887 H LYS 106 HN LYS 106 -4.223 -27.180 -5.829 888 HA LYS 106 HA LYS 106 -2.363 -24.972 -5.482 889 HB2 LYS 106 HB2 LYS 106 -1.961 -27.921 -4.936 890 HB3 LYS 106 HB1 LYS 106 -0.905 -26.615 -4.419 891 HG2 LYS 106 HG2 LYS 106 -3.755 -27.007 -3.523 892 HG3 LYS 106 HG1 LYS 106 -2.316 -27.450 -2.600 893 HD2 LYS 106 HD2 LYS 106 -1.619 -25.088 -2.595 894 HD3 LYS 106 HD1 LYS 106 -3.089 -24.664 -3.475 895 HE2 LYS 106 HE2 LYS 106 -4.440 -25.515 -1.615 896 HE3 LYS 106 HE1 LYS 106 -2.967 -25.923 -0.737 897 HZ1 LYS 106 HZ1 LYS 106 -3.871 -23.205 -1.514 898 HZ2 LYS 106 HZ2 LYS 106 -2.375 -23.544 -0.802 899 HZ3 LYS 106 HZ3 LYS 106 -3.804 -23.842 0.052 Start of MODEL 11 1 H1 MET 1 HT1 MET 1 -1.566 -15.670 -21.649 2 H2 MET 1 HT2 MET 1 -1.827 -16.073 -20.026 3 H3 MET 1 HT3 MET 1 -0.253 -15.832 -20.594 4 HA MET 1 HA MET 1 -1.021 -13.940 -19.306 5 HB2 MET 1 HB2 MET 1 -0.673 -12.198 -21.139 6 HB3 MET 1 HB1 MET 1 0.607 -13.385 -20.921 7 HG2 MET 1 HG2 MET 1 -0.280 -14.665 -22.819 8 HG3 MET 1 HG1 MET 1 -1.521 -13.434 -23.051 9 HE1 MET 1 HE1 MET 1 -0.704 -12.915 -25.704 10 HE2 MET 1 HE2 MET 1 0.167 -14.398 -25.310 11 HE3 MET 1 HE3 MET 1 1.019 -13.048 -26.059 12 H ALA 2 HN ALA 2 -3.344 -15.372 -21.104 13 HA ALA 2 HA ALA 2 -5.131 -13.302 -21.732 14 HB1 ALA 2 HB1 ALA 2 -5.420 -16.241 -21.346 15 HB2 ALA 2 HB2 ALA 2 -5.680 -15.259 -22.788 16 HB3 ALA 2 HB3 ALA 2 -6.866 -15.242 -21.482 17 HA PRO 3 HA PRO 3 -7.263 -14.006 -17.460 18 HB2 PRO 3 HB2 PRO 3 -5.915 -15.254 -15.493 19 HB3 PRO 3 HB1 PRO 3 -6.915 -16.131 -16.660 20 HG2 PRO 3 HG2 PRO 3 -3.956 -15.689 -16.662 21 HG3 PRO 3 HG1 PRO 3 -4.854 -17.192 -16.938 22 HD2 PRO 3 HD2 PRO 3 -3.873 -15.725 -18.973 23 HD3 PRO 3 HD1 PRO 3 -5.408 -16.608 -19.109 24 H LEU 4 HN LEU 4 -7.218 -12.638 -15.651 25 HA LEU 4 HA LEU 4 -5.063 -10.702 -15.718 26 HB2 LEU 4 HB2 LEU 4 -7.589 -10.748 -14.065 27 HB3 LEU 4 HB1 LEU 4 -6.489 -9.391 -14.221 28 HG LEU 4 HG LEU 4 -8.164 -10.575 -16.439 29 HD11 LEU 4 HD11 LEU 4 -8.839 -7.929 -16.122 30 HD12 LEU 4 HD12 LEU 4 -8.642 -8.499 -14.464 31 HD13 LEU 4 HD13 LEU 4 -9.766 -9.316 -15.550 32 HD21 LEU 4 HD21 LEU 4 -6.334 -9.777 -17.577 33 HD22 LEU 4 HD22 LEU 4 -6.022 -8.497 -16.403 34 HD23 LEU 4 HD23 LEU 4 -7.367 -8.348 -17.534 35 H ARG 5 HN ARG 5 -5.780 -13.485 -13.986 36 HA ARG 5 HA ARG 5 -4.968 -14.479 -12.120 37 HB2 ARG 5 HB2 ARG 5 -2.834 -13.626 -13.411 38 HB3 ARG 5 HB1 ARG 5 -2.677 -12.553 -12.030 39 HG2 ARG 5 HG2 ARG 5 -1.338 -14.436 -11.566 40 HG3 ARG 5 HG1 ARG 5 -2.784 -14.612 -10.571 41 HD2 ARG 5 HD2 ARG 5 -2.302 -16.741 -11.525 42 HD3 ARG 5 HD1 ARG 5 -3.723 -16.102 -12.346 43 HE ARG 5 HE ARG 5 -1.431 -15.393 -13.802 44 HH11 ARG 5 HH11 ARG 5 -3.296 -18.210 -12.959 45 HH12 ARG 5 HH12 ARG 5 -2.902 -19.071 -14.410 46 HH21 ARG 5 HH21 ARG 5 -0.897 -16.513 -15.716 47 HH22 ARG 5 HH22 ARG 5 -1.531 -18.102 -15.981 48 H LYS 6 HN LYS 6 -3.141 -12.534 -10.351 49 HA LYS 6 HA LYS 6 -5.407 -11.656 -8.710 50 HB2 LYS 6 HB2 LYS 6 -2.489 -11.922 -7.964 51 HB3 LYS 6 HB1 LYS 6 -3.808 -11.540 -6.865 52 HG2 LYS 6 HG2 LYS 6 -3.456 -14.126 -8.370 53 HG3 LYS 6 HG1 LYS 6 -3.132 -13.868 -6.656 54 HD2 LYS 6 HD2 LYS 6 -5.527 -13.263 -6.353 55 HD3 LYS 6 HD1 LYS 6 -5.806 -13.686 -8.044 56 HE2 LYS 6 HE2 LYS 6 -4.765 -15.550 -5.912 57 HE3 LYS 6 HE1 LYS 6 -6.417 -15.516 -6.527 58 HZ1 LYS 6 HZ1 LYS 6 -5.804 -16.452 -8.507 59 HZ2 LYS 6 HZ2 LYS 6 -4.666 -17.179 -7.482 60 HZ3 LYS 6 HZ3 LYS 6 -4.217 -15.859 -8.435 61 H THR 7 HN THR 7 -3.521 -10.364 -11.018 62 HA THR 7 HA THR 7 -3.008 -7.850 -9.656 63 HB THR 7 HB THR 7 -2.228 -7.243 -12.103 64 HG1 THR 7 HG1 THR 7 -3.068 -9.453 -12.764 65 HG21 THR 7 HG21 THR 7 -0.582 -7.172 -10.494 66 HG22 THR 7 HG22 THR 7 -0.019 -8.516 -11.490 67 HG23 THR 7 HG23 THR 7 -0.868 -8.837 -9.976 68 H ALA 8 HN ALA 8 -4.172 -6.125 -9.785 69 HA ALA 8 HA ALA 8 -6.494 -6.075 -11.591 70 HB1 ALA 8 HB1 ALA 8 -7.595 -4.705 -10.006 71 HB2 ALA 8 HB2 ALA 8 -6.098 -4.405 -9.119 72 HB3 ALA 8 HB3 ALA 8 -6.834 -6.008 -9.088 73 H VAL 9 HN VAL 9 -7.077 -4.048 -12.586 74 HA VAL 9 HA VAL 9 -4.688 -2.418 -13.131 75 HB VAL 9 HB VAL 9 -7.101 -2.861 -14.889 76 HG11 VAL 9 HG11 VAL 9 -5.378 -1.732 -16.558 77 HG12 VAL 9 HG12 VAL 9 -4.774 -1.000 -15.072 78 HG13 VAL 9 HG13 VAL 9 -6.452 -0.757 -15.556 79 HG21 VAL 9 HG21 VAL 9 -5.212 -4.668 -14.519 80 HG22 VAL 9 HG22 VAL 9 -4.337 -3.646 -15.660 81 HG23 VAL 9 HG23 VAL 9 -5.884 -4.357 -16.119 82 H LEU 10 HN LEU 10 -4.721 -0.400 -12.490 83 HA LEU 10 HA LEU 10 -7.295 0.854 -11.771 84 HB2 LEU 10 HB2 LEU 10 -5.344 0.344 -10.031 85 HB3 LEU 10 HB1 LEU 10 -4.675 1.820 -10.691 86 HG LEU 10 HG LEU 10 -5.846 2.300 -8.635 87 HD11 LEU 10 HD11 LEU 10 -6.056 4.166 -9.909 88 HD12 LEU 10 HD12 LEU 10 -7.760 3.775 -9.659 89 HD13 LEU 10 HD13 LEU 10 -6.968 3.342 -11.175 90 HD21 LEU 10 HD21 LEU 10 -7.922 0.588 -9.819 91 HD22 LEU 10 HD22 LEU 10 -8.509 2.016 -8.963 92 HD23 LEU 10 HD23 LEU 10 -7.481 0.847 -8.131 93 H LYS 11 HN LYS 11 -7.805 2.716 -12.917 94 HA LYS 11 HA LYS 11 -5.631 3.766 -14.603 95 HB2 LYS 11 HB2 LYS 11 -8.563 3.501 -15.276 96 HB3 LYS 11 HB1 LYS 11 -7.447 4.494 -16.201 97 HG2 LYS 11 HG2 LYS 11 -6.105 2.499 -16.691 98 HG3 LYS 11 HG1 LYS 11 -7.268 1.515 -15.805 99 HD2 LYS 11 HD2 LYS 11 -9.024 2.167 -17.367 100 HD3 LYS 11 HD1 LYS 11 -7.881 3.189 -18.240 101 HE2 LYS 11 HE2 LYS 11 -6.541 1.220 -18.793 102 HE3 LYS 11 HE1 LYS 11 -7.676 0.197 -17.914 103 HZ1 LYS 11 HZ1 LYS 11 -7.796 0.920 -20.574 104 HZ2 LYS 11 HZ2 LYS 11 -9.039 1.788 -19.824 105 HZ3 LYS 11 HZ3 LYS 11 -8.982 0.103 -19.685 106 H LEU 12 HN LEU 12 -5.198 5.840 -14.466 107 HA LEU 12 HA LEU 12 -6.953 7.483 -12.780 108 HB2 LEU 12 HB2 LEU 12 -4.238 7.030 -12.598 109 HB3 LEU 12 HB1 LEU 12 -4.305 8.562 -13.445 110 HG LEU 12 HG LEU 12 -5.450 7.950 -10.721 111 HD11 LEU 12 HD11 LEU 12 -3.713 9.119 -9.826 112 HD12 LEU 12 HD12 LEU 12 -3.491 10.112 -11.267 113 HD13 LEU 12 HD13 LEU 12 -2.909 8.448 -11.245 114 HD21 LEU 12 HD21 LEU 12 -7.005 9.461 -11.506 115 HD22 LEU 12 HD22 LEU 12 -5.841 10.281 -12.547 116 HD23 LEU 12 HD23 LEU 12 -5.794 10.532 -10.802 117 H TYR 13 HN TYR 13 -8.079 9.132 -13.818 118 HA TYR 13 HA TYR 13 -7.311 9.720 -16.587 119 HB2 TYR 13 HB2 TYR 13 -9.823 10.334 -15.014 120 HB3 TYR 13 HB1 TYR 13 -9.552 10.778 -16.695 121 HD1 TYR 13 HD1 TYR 13 -10.340 8.053 -14.393 122 HD2 TYR 13 HD2 TYR 13 -9.513 9.059 -18.444 123 HE1 TYR 13 HE1 TYR 13 -11.216 5.870 -15.109 124 HE2 TYR 13 HE2 TYR 13 -10.387 6.878 -19.170 125 HH TYR 13 HH TYR 13 -11.399 4.992 -18.546 126 H VAL 14 HN VAL 14 -6.113 11.509 -16.896 127 HA VAL 14 HA VAL 14 -6.391 13.714 -14.956 128 HB VAL 14 HB VAL 14 -4.007 14.214 -15.251 129 HG11 VAL 14 HG11 VAL 14 -4.706 11.457 -14.263 130 HG12 VAL 14 HG12 VAL 14 -4.557 12.943 -13.324 131 HG13 VAL 14 HG13 VAL 14 -3.122 12.196 -14.027 132 HG21 VAL 14 HG21 VAL 14 -3.789 11.573 -16.689 133 HG22 VAL 14 HG22 VAL 14 -2.505 12.743 -16.383 134 HG23 VAL 14 HG23 VAL 14 -3.808 13.137 -17.504 135 H ALA 15 HN ALA 15 -5.740 15.813 -15.798 136 HA ALA 15 HA ALA 15 -6.226 16.026 -18.692 137 HB1 ALA 15 HB1 ALA 15 -6.857 18.451 -17.244 138 HB2 ALA 15 HB2 ALA 15 -7.802 17.087 -16.645 139 HB3 ALA 15 HB3 ALA 15 -7.861 17.517 -18.354 140 H GLY 16 HN GLY 16 -4.264 16.325 -19.536 141 HA2 GLY 16 HA2 GLY 16 -2.258 17.328 -20.012 142 HA3 GLY 16 HA1 GLY 16 -2.880 18.748 -19.180 143 H ASN 17 HN ASN 17 -1.378 19.391 -17.772 144 HA ASN 17 HA ASN 17 -0.352 17.394 -15.879 145 HB2 ASN 17 HB2 ASN 17 1.281 18.186 -17.812 146 HB3 ASN 17 HB1 ASN 17 1.464 19.598 -16.777 147 HD21 ASN 17 HD21 ASN 17 3.487 19.310 -16.053 148 HD22 ASN 17 HD22 ASN 17 4.013 17.944 -15.137 149 H THR 18 HN THR 18 -2.444 18.786 -15.174 150 HA THR 18 HA THR 18 -1.839 21.326 -13.979 151 HB THR 18 HB THR 18 -4.051 21.115 -12.902 152 HG1 THR 18 HG1 THR 18 -5.317 19.220 -13.561 153 HG21 THR 18 HG21 THR 18 -3.681 21.817 -15.343 154 HG22 THR 18 HG22 THR 18 -5.319 21.415 -14.832 155 HG23 THR 18 HG23 THR 18 -4.370 20.245 -15.752 156 HA PRO 19 HA PRO 19 -0.098 20.166 -10.139 157 HB2 PRO 19 HB2 PRO 19 -1.682 21.610 -8.371 158 HB3 PRO 19 HB1 PRO 19 -0.286 22.253 -9.238 159 HG2 PRO 19 HG2 PRO 19 -3.194 22.464 -9.906 160 HG3 PRO 19 HG1 PRO 19 -1.923 23.694 -10.036 161 HD2 PRO 19 HD2 PRO 19 -2.797 22.405 -12.189 162 HD3 PRO 19 HD1 PRO 19 -1.071 22.776 -11.994 163 H ASN 20 HN ASN 20 -3.615 20.085 -10.315 164 HA ASN 20 HA ASN 20 -3.983 18.339 -8.099 165 HB2 ASN 20 HB2 ASN 20 -5.778 18.739 -10.525 166 HB3 ASN 20 HB1 ASN 20 -6.222 17.855 -9.072 167 HD21 ASN 20 HD21 ASN 20 -5.743 19.197 -6.999 168 HD22 ASN 20 HD22 ASN 20 -6.351 20.813 -7.037 169 H SER 21 HN SER 21 -3.643 17.811 -11.596 170 HA SER 21 HA SER 21 -3.837 14.958 -11.545 171 HB2 SER 21 HB2 SER 21 -2.553 16.830 -13.551 172 HB3 SER 21 HB1 SER 21 -2.843 15.110 -13.811 173 HG SER 21 HG SER 21 -4.618 17.243 -13.826 174 H VAL 22 HN VAL 22 -1.095 17.190 -11.458 175 HA VAL 22 HA VAL 22 0.856 15.147 -11.503 176 HB VAL 22 HB VAL 22 0.978 17.994 -10.466 177 HG11 VAL 22 HG11 VAL 22 3.476 17.691 -10.565 178 HG12 VAL 22 HG12 VAL 22 3.178 15.954 -10.656 179 HG13 VAL 22 HG13 VAL 22 2.649 16.867 -9.240 180 HG21 VAL 22 HG21 VAL 22 1.816 16.666 -13.024 181 HG22 VAL 22 HG22 VAL 22 2.470 18.226 -12.523 182 HG23 VAL 22 HG23 VAL 22 0.736 18.042 -12.794 183 H ARG 23 HN ARG 23 -0.749 16.847 -8.861 184 HA ARG 23 HA ARG 23 0.692 15.697 -6.735 185 HB2 ARG 23 HB2 ARG 23 -1.155 17.629 -6.935 186 HB3 ARG 23 HB1 ARG 23 -2.197 16.312 -6.400 187 HG2 ARG 23 HG2 ARG 23 -1.657 17.068 -4.365 188 HG3 ARG 23 HG1 ARG 23 -0.198 16.100 -4.608 189 HD2 ARG 23 HD2 ARG 23 0.983 18.055 -5.436 190 HD3 ARG 23 HD1 ARG 23 -0.482 19.025 -5.278 191 HE ARG 23 HE ARG 23 0.087 17.920 -2.780 192 HH11 ARG 23 HH11 ARG 23 1.473 20.192 -5.024 193 HH12 ARG 23 HH12 ARG 23 2.258 21.129 -3.798 194 HH21 ARG 23 HH21 ARG 23 1.114 19.142 -1.152 195 HH22 ARG 23 HH22 ARG 23 2.054 20.530 -1.589 196 H ALA 24 HN ALA 24 -2.418 14.841 -8.218 197 HA ALA 24 HA ALA 24 -2.956 12.619 -6.579 198 HB1 ALA 24 HB1 ALA 24 -4.855 12.477 -7.749 199 HB2 ALA 24 HB2 ALA 24 -4.006 12.386 -9.292 200 HB3 ALA 24 HB3 ALA 24 -4.313 13.954 -8.545 201 H LEU 25 HN LEU 25 -1.383 12.869 -9.741 202 HA LEU 25 HA LEU 25 -1.005 10.124 -10.220 203 HB2 LEU 25 HB2 LEU 25 -0.772 11.807 -11.963 204 HB3 LEU 25 HB1 LEU 25 0.609 12.503 -11.143 205 HG LEU 25 HG LEU 25 1.887 10.441 -11.555 206 HD11 LEU 25 HD11 LEU 25 0.839 8.924 -13.371 207 HD12 LEU 25 HD12 LEU 25 -0.696 9.575 -12.796 208 HD13 LEU 25 HD13 LEU 25 0.360 8.698 -11.688 209 HD21 LEU 25 HD21 LEU 25 2.147 10.743 -13.978 210 HD22 LEU 25 HD22 LEU 25 2.061 12.282 -13.122 211 HD23 LEU 25 HD23 LEU 25 0.658 11.688 -14.008 212 H LYS 26 HN LYS 26 1.154 12.502 -8.685 213 HA LYS 26 HA LYS 26 3.283 10.702 -8.236 214 HB2 LYS 26 HB2 LYS 26 2.566 13.417 -7.392 215 HB3 LYS 26 HB1 LYS 26 3.516 12.535 -6.204 216 HG2 LYS 26 HG2 LYS 26 4.972 13.813 -7.639 217 HG3 LYS 26 HG1 LYS 26 5.220 12.089 -7.920 218 HD2 LYS 26 HD2 LYS 26 4.277 12.158 -10.015 219 HD3 LYS 26 HD1 LYS 26 3.261 13.550 -9.628 220 HE2 LYS 26 HE2 LYS 26 5.022 14.161 -11.202 221 HE3 LYS 26 HE1 LYS 26 5.227 15.000 -9.664 222 HZ1 LYS 26 HZ1 LYS 26 6.785 13.038 -9.125 223 HZ2 LYS 26 HZ2 LYS 26 7.346 14.269 -10.140 224 HZ3 LYS 26 HZ3 LYS 26 6.825 12.801 -10.800 225 H THR 27 HN THR 27 0.508 11.652 -6.248 226 HA THR 27 HA THR 27 1.222 10.295 -3.888 227 HB THR 27 HB THR 27 -1.503 11.026 -4.974 228 HG1 THR 27 HG1 THR 27 -0.381 12.893 -4.675 229 HG21 THR 27 HG21 THR 27 -1.872 11.128 -2.357 230 HG22 THR 27 HG22 THR 27 -0.613 9.889 -2.375 231 HG23 THR 27 HG23 THR 27 -2.113 9.635 -3.266 232 H LEU 28 HN LEU 28 -0.892 9.296 -6.592 233 HA LEU 28 HA LEU 28 -1.507 6.768 -5.472 234 HB2 LEU 28 HB2 LEU 28 -2.916 7.831 -7.148 235 HB3 LEU 28 HB1 LEU 28 -1.634 7.708 -8.336 236 HG LEU 28 HG LEU 28 -1.797 5.239 -8.230 237 HD11 LEU 28 HD11 LEU 28 -4.063 5.836 -6.341 238 HD12 LEU 28 HD12 LEU 28 -2.622 4.867 -6.032 239 HD13 LEU 28 HD13 LEU 28 -3.850 4.288 -7.158 240 HD21 LEU 28 HD21 LEU 28 -4.319 6.748 -8.873 241 HD22 LEU 28 HD22 LEU 28 -4.010 5.077 -9.344 242 HD23 LEU 28 HD23 LEU 28 -2.988 6.372 -9.966 243 H ALA 29 HN ALA 29 0.912 7.767 -7.915 244 HA ALA 29 HA ALA 29 1.801 5.187 -8.565 245 HB1 ALA 29 HB1 ALA 29 2.741 6.467 -10.114 246 HB2 ALA 29 HB2 ALA 29 3.997 6.826 -8.928 247 HB3 ALA 29 HB3 ALA 29 2.616 7.909 -9.106 248 H ASN 30 HN ASN 30 2.946 7.455 -6.076 249 HA ASN 30 HA ASN 30 5.243 5.982 -5.289 250 HB2 ASN 30 HB2 ASN 30 4.881 8.328 -4.646 251 HB3 ASN 30 HB1 ASN 30 3.504 7.849 -3.660 252 HD21 ASN 30 HD21 ASN 30 6.984 7.512 -4.032 253 HD22 ASN 30 HD22 ASN 30 7.312 7.188 -2.367 254 H ILE 31 HN ILE 31 1.923 5.965 -4.130 255 HA ILE 31 HA ILE 31 2.316 4.130 -2.058 256 HB ILE 31 HB ILE 31 -0.133 4.987 -3.549 257 HG12 ILE 31 HG12 ILE 31 0.732 5.359 -0.683 258 HG13 ILE 31 HG11 ILE 31 1.135 6.485 -1.974 259 HG21 ILE 31 HG21 ILE 31 -0.491 2.659 -2.834 260 HG22 ILE 31 HG22 ILE 31 -1.511 3.799 -1.957 261 HG23 ILE 31 HG23 ILE 31 -0.079 3.120 -1.182 262 HD11 ILE 31 HD11 ILE 31 -1.706 5.779 -1.552 263 HD12 ILE 31 HD12 ILE 31 -0.981 7.281 -2.123 264 HD13 ILE 31 HD13 ILE 31 -0.920 6.868 -0.410 265 H LEU 32 HN LEU 32 1.255 3.695 -5.414 266 HA LEU 32 HA LEU 32 0.918 0.898 -5.275 267 HB2 LEU 32 HB2 LEU 32 1.326 2.791 -7.568 268 HB3 LEU 32 HB1 LEU 32 1.136 1.064 -7.812 269 HG LEU 32 HG LEU 32 -0.922 2.735 -6.350 270 HD11 LEU 32 HD11 LEU 32 -0.401 3.304 -8.859 271 HD12 LEU 32 HD12 LEU 32 -2.067 3.123 -8.309 272 HD13 LEU 32 HD13 LEU 32 -1.273 1.801 -9.163 273 HD21 LEU 32 HD21 LEU 32 -1.261 0.510 -5.808 274 HD22 LEU 32 HD22 LEU 32 -0.751 -0.063 -7.395 275 HD23 LEU 32 HD23 LEU 32 -2.311 0.736 -7.206 276 H GLU 33 HN GLU 33 3.714 2.886 -6.070 277 HA GLU 33 HA GLU 33 5.352 0.832 -7.096 278 HB2 GLU 33 HB2 GLU 33 6.020 3.501 -5.877 279 HB3 GLU 33 HB1 GLU 33 7.247 2.414 -6.514 280 HG2 GLU 33 HG2 GLU 33 6.296 2.538 -8.712 281 HG3 GLU 33 HG1 GLU 33 4.929 3.473 -8.105 282 H LYS 34 HN LYS 34 4.856 1.911 -3.750 283 HA LYS 34 HA LYS 34 6.841 -0.128 -2.966 284 HB2 LYS 34 HB2 LYS 34 5.975 2.300 -1.389 285 HB3 LYS 34 HB1 LYS 34 7.194 1.130 -0.903 286 HG2 LYS 34 HG2 LYS 34 7.372 2.928 -3.314 287 HG3 LYS 34 HG1 LYS 34 8.174 3.204 -1.768 288 HD2 LYS 34 HD2 LYS 34 9.405 1.092 -2.048 289 HD3 LYS 34 HD1 LYS 34 8.618 0.853 -3.610 290 HE2 LYS 34 HE2 LYS 34 10.842 1.769 -3.922 291 HE3 LYS 34 HE1 LYS 34 9.623 2.941 -4.421 292 HZ1 LYS 34 HZ1 LYS 34 10.296 4.382 -2.883 293 HZ2 LYS 34 HZ2 LYS 34 11.681 3.425 -2.721 294 HZ3 LYS 34 HZ3 LYS 34 10.376 3.209 -1.667 295 H GLU 35 HN GLU 35 3.830 1.384 -1.798 296 HA GLU 35 HA GLU 35 3.358 -0.540 0.211 297 HB2 GLU 35 HB2 GLU 35 1.567 1.475 -1.133 298 HB3 GLU 35 HB1 GLU 35 1.012 0.432 0.174 299 HG2 GLU 35 HG2 GLU 35 3.266 2.426 0.334 300 HG3 GLU 35 HG1 GLU 35 1.647 2.633 0.996 301 H PHE 36 HN PHE 36 2.122 -0.324 -3.141 302 HA PHE 36 HA PHE 36 1.061 -3.038 -2.722 303 HB2 PHE 36 HB2 PHE 36 -0.175 -0.796 -4.308 304 HB3 PHE 36 HB1 PHE 36 -0.702 -2.470 -4.431 305 HD1 PHE 36 HD1 PHE 36 -0.667 0.526 -2.365 306 HD2 PHE 36 HD2 PHE 36 -1.828 -3.561 -2.568 307 HE1 PHE 36 HE1 PHE 36 -2.130 0.849 -0.417 308 HE2 PHE 36 HE2 PHE 36 -3.295 -3.245 -0.619 309 HZ PHE 36 HZ PHE 36 -3.445 -1.037 0.460 310 H LYS 37 HN LYS 37 3.676 -2.256 -3.830 311 HA LYS 37 HA LYS 37 3.749 -2.513 -6.609 312 HB2 LYS 37 HB2 LYS 37 5.639 -1.931 -4.936 313 HB3 LYS 37 HB1 LYS 37 5.886 -3.669 -4.839 314 HG2 LYS 37 HG2 LYS 37 5.780 -2.493 -7.551 315 HG3 LYS 37 HG1 LYS 37 7.187 -2.098 -6.561 316 HD2 LYS 37 HD2 LYS 37 7.547 -4.523 -6.188 317 HD3 LYS 37 HD1 LYS 37 6.204 -4.860 -7.285 318 HE2 LYS 37 HE2 LYS 37 7.392 -3.729 -9.093 319 HE3 LYS 37 HE1 LYS 37 8.724 -3.361 -7.998 320 HZ1 LYS 37 HZ1 LYS 37 9.564 -5.393 -8.245 321 HZ2 LYS 37 HZ2 LYS 37 8.536 -5.558 -9.577 322 HZ3 LYS 37 HZ3 LYS 37 8.062 -6.152 -8.065 323 H GLY 38 HN GLY 38 3.385 -4.145 -7.954 324 HA2 GLY 38 HA2 GLY 38 3.531 -6.354 -8.733 325 HA3 GLY 38 HA1 GLY 38 3.840 -6.889 -7.092 326 H VAL 39 HN VAL 39 1.274 -4.969 -6.634 327 HA VAL 39 HA VAL 39 -0.551 -7.227 -7.068 328 HB VAL 39 HB VAL 39 -0.839 -4.958 -5.079 329 HG11 VAL 39 HG11 VAL 39 -2.829 -5.886 -4.330 330 HG12 VAL 39 HG12 VAL 39 -2.495 -7.453 -5.069 331 HG13 VAL 39 HG13 VAL 39 -2.952 -6.080 -6.080 332 HG21 VAL 39 HG21 VAL 39 -0.242 -6.478 -3.373 333 HG22 VAL 39 HG22 VAL 39 0.962 -6.687 -4.644 334 HG23 VAL 39 HG23 VAL 39 -0.342 -7.860 -4.463 335 H TYR 40 HN TYR 40 -0.405 -3.664 -7.309 336 HA TYR 40 HA TYR 40 -2.713 -3.915 -9.095 337 HB2 TYR 40 HB2 TYR 40 -2.153 -2.053 -6.940 338 HB3 TYR 40 HB1 TYR 40 -2.429 -1.182 -8.438 339 HD1 TYR 40 HD1 TYR 40 -3.945 -2.887 -5.673 340 HD2 TYR 40 HD2 TYR 40 -4.608 -1.567 -9.662 341 HE1 TYR 40 HE1 TYR 40 -6.373 -2.977 -5.294 342 HE2 TYR 40 HE2 TYR 40 -7.036 -1.661 -9.297 343 HH TYR 40 HH TYR 40 -8.572 -3.161 -7.461 344 H ALA 41 HN ALA 41 -2.689 -2.967 -11.101 345 HA ALA 41 HA ALA 41 -0.075 -1.979 -12.023 346 HB1 ALA 41 HB1 ALA 41 -0.642 -2.705 -14.180 347 HB2 ALA 41 HB2 ALA 41 -2.364 -2.758 -13.806 348 HB3 ALA 41 HB3 ALA 41 -1.277 -3.969 -13.126 349 H LEU 42 HN LEU 42 0.137 0.155 -12.564 350 HA LEU 42 HA LEU 42 -2.293 1.766 -12.449 351 HB2 LEU 42 HB2 LEU 42 -0.582 2.496 -10.942 352 HB3 LEU 42 HB1 LEU 42 0.614 2.525 -12.222 353 HG LEU 42 HG LEU 42 -0.581 4.408 -13.285 354 HD11 LEU 42 HD11 LEU 42 -2.830 4.020 -12.552 355 HD12 LEU 42 HD12 LEU 42 -2.311 5.599 -11.960 356 HD13 LEU 42 HD13 LEU 42 -2.363 4.218 -10.863 357 HD21 LEU 42 HD21 LEU 42 -0.263 5.472 -10.584 358 HD22 LEU 42 HD22 LEU 42 0.590 5.874 -12.075 359 HD23 LEU 42 HD23 LEU 42 1.086 4.474 -11.124 360 H LYS 43 HN LYS 43 -3.196 2.650 -14.094 361 HA LYS 43 HA LYS 43 -1.654 3.133 -16.557 362 HB2 LYS 43 HB2 LYS 43 -4.052 1.543 -16.153 363 HB3 LYS 43 HB1 LYS 43 -4.355 2.871 -17.263 364 HG2 LYS 43 HG2 LYS 43 -3.664 1.371 -18.778 365 HG3 LYS 43 HG1 LYS 43 -2.072 1.962 -18.305 366 HD2 LYS 43 HD2 LYS 43 -1.590 0.066 -17.087 367 HD3 LYS 43 HD1 LYS 43 -3.292 -0.313 -16.808 368 HE2 LYS 43 HE2 LYS 43 -2.161 -0.380 -19.575 369 HE3 LYS 43 HE1 LYS 43 -1.917 -1.746 -18.485 370 HZ1 LYS 43 HZ1 LYS 43 -4.016 -1.517 -20.081 371 HZ2 LYS 43 HZ2 LYS 43 -4.638 -0.741 -18.713 372 HZ3 LYS 43 HZ3 LYS 43 -4.078 -2.333 -18.600 373 H VAL 44 HN VAL 44 -1.961 5.100 -17.510 374 HA VAL 44 HA VAL 44 -3.837 6.967 -16.173 375 HB VAL 44 HB VAL 44 -1.613 7.599 -15.527 376 HG11 VAL 44 HG11 VAL 44 -0.065 8.360 -17.526 377 HG12 VAL 44 HG12 VAL 44 -0.961 7.096 -18.369 378 HG13 VAL 44 HG13 VAL 44 -0.048 6.707 -16.910 379 HG21 VAL 44 HG21 VAL 44 -1.519 9.855 -16.280 380 HG22 VAL 44 HG22 VAL 44 -3.217 9.386 -16.177 381 HG23 VAL 44 HG23 VAL 44 -2.414 9.455 -17.746 382 H ILE 45 HN ILE 45 -5.172 8.066 -17.329 383 HA ILE 45 HA ILE 45 -4.964 7.836 -20.250 384 HB ILE 45 HB ILE 45 -7.430 8.197 -18.551 385 HG12 ILE 45 HG12 ILE 45 -6.460 6.010 -18.126 386 HG13 ILE 45 HG11 ILE 45 -7.946 5.840 -19.052 387 HG21 ILE 45 HG21 ILE 45 -7.242 7.432 -21.463 388 HG22 ILE 45 HG22 ILE 45 -7.570 9.064 -20.881 389 HG23 ILE 45 HG23 ILE 45 -8.713 7.759 -20.541 390 HD11 ILE 45 HD11 ILE 45 -6.669 5.451 -21.068 391 HD12 ILE 45 HD12 ILE 45 -6.179 4.324 -19.801 392 HD13 ILE 45 HD13 ILE 45 -5.164 5.713 -20.186 393 H ASP 46 HN ASP 46 -4.059 9.755 -20.839 394 HA ASP 46 HA ASP 46 -4.690 12.250 -19.567 395 HB2 ASP 46 HB2 ASP 46 -2.508 11.745 -20.704 396 HB3 ASP 46 HB1 ASP 46 -3.355 11.813 -22.246 397 H VAL 47 HN VAL 47 -6.805 12.858 -19.765 398 HA VAL 47 HA VAL 47 -8.421 12.251 -22.003 399 HB VAL 47 HB VAL 47 -10.127 13.654 -20.992 400 HG11 VAL 47 HG11 VAL 47 -10.409 11.757 -19.842 401 HG12 VAL 47 HG12 VAL 47 -9.614 12.588 -18.505 402 HG13 VAL 47 HG13 VAL 47 -8.675 11.555 -19.584 403 HG21 VAL 47 HG21 VAL 47 -8.622 15.491 -20.257 404 HG22 VAL 47 HG22 VAL 47 -8.059 14.453 -18.947 405 HG23 VAL 47 HG23 VAL 47 -9.748 14.959 -19.008 406 H LEU 48 HN LEU 48 -6.520 15.145 -21.254 407 HA LEU 48 HA LEU 48 -7.747 16.737 -23.278 408 HB2 LEU 48 HB2 LEU 48 -5.136 17.054 -21.819 409 HB3 LEU 48 HB1 LEU 48 -5.689 18.188 -23.035 410 HG LEU 48 HG LEU 48 -7.168 17.542 -20.483 411 HD11 LEU 48 HD11 LEU 48 -6.503 19.822 -19.810 412 HD12 LEU 48 HD12 LEU 48 -5.472 19.915 -21.237 413 HD13 LEU 48 HD13 LEU 48 -5.131 18.727 -19.979 414 HD21 LEU 48 HD21 LEU 48 -8.220 19.845 -21.294 415 HD22 LEU 48 HD22 LEU 48 -8.863 18.285 -21.803 416 HD23 LEU 48 HD23 LEU 48 -7.787 19.185 -22.871 417 H LYS 49 HN LYS 49 -4.946 14.618 -23.223 418 HA LYS 49 HA LYS 49 -3.967 15.363 -25.789 419 HB2 LYS 49 HB2 LYS 49 -2.571 14.259 -24.061 420 HB3 LYS 49 HB1 LYS 49 -3.524 12.794 -24.251 421 HG2 LYS 49 HG2 LYS 49 -1.502 12.508 -25.463 422 HG3 LYS 49 HG1 LYS 49 -2.803 12.721 -26.637 423 HD2 LYS 49 HD2 LYS 49 -2.179 15.064 -26.917 424 HD3 LYS 49 HD1 LYS 49 -0.898 14.876 -25.717 425 HE2 LYS 49 HE2 LYS 49 -1.086 13.394 -28.338 426 HE3 LYS 49 HE1 LYS 49 -0.040 14.776 -28.017 427 HZ1 LYS 49 HZ1 LYS 49 0.720 13.204 -26.051 428 HZ2 LYS 49 HZ2 LYS 49 1.414 13.113 -27.591 429 HZ3 LYS 49 HZ3 LYS 49 0.219 12.006 -27.137 430 H ASN 50 HN ASN 50 -6.116 12.810 -24.615 431 HA ASN 50 HA ASN 50 -6.873 12.304 -27.417 432 HB2 ASN 50 HB2 ASN 50 -6.687 10.257 -25.197 433 HB3 ASN 50 HB1 ASN 50 -7.302 9.943 -26.813 434 HD21 ASN 50 HD21 ASN 50 -5.659 10.776 -28.561 435 HD22 ASN 50 HD22 ASN 50 -4.037 10.237 -28.320 436 HA PRO 51 HA PRO 51 -10.559 13.853 -25.160 437 HB2 PRO 51 HB2 PRO 51 -11.198 14.564 -27.977 438 HB3 PRO 51 HB1 PRO 51 -11.302 15.556 -26.517 439 HG2 PRO 51 HG2 PRO 51 -9.334 15.971 -28.242 440 HG3 PRO 51 HG1 PRO 51 -9.000 15.992 -26.500 441 HD2 PRO 51 HD2 PRO 51 -8.523 13.800 -28.487 442 HD3 PRO 51 HD1 PRO 51 -7.439 14.430 -27.224 443 H GLN 52 HN GLN 52 -10.259 11.959 -28.098 444 HA GLN 52 HA GLN 52 -12.911 11.020 -28.283 445 HB2 GLN 52 HB2 GLN 52 -11.223 10.851 -30.109 446 HB3 GLN 52 HB1 GLN 52 -10.370 9.633 -29.169 447 HG2 GLN 52 HG2 GLN 52 -12.332 8.176 -29.283 448 HG3 GLN 52 HG1 GLN 52 -13.171 9.390 -30.247 449 HE21 GLN 52 HE21 GLN 52 -13.217 8.873 -32.307 450 HE22 GLN 52 HE22 GLN 52 -11.959 8.089 -33.191 451 H LEU 53 HN LEU 53 -10.061 9.786 -26.604 452 HA LEU 53 HA LEU 53 -11.349 7.387 -25.798 453 HB2 LEU 53 HB2 LEU 53 -8.859 8.735 -24.747 454 HB3 LEU 53 HB1 LEU 53 -9.417 7.160 -24.208 455 HG LEU 53 HG LEU 53 -8.628 7.846 -27.040 456 HD11 LEU 53 HD11 LEU 53 -6.749 7.812 -25.406 457 HD12 LEU 53 HD12 LEU 53 -6.636 6.579 -26.662 458 HD13 LEU 53 HD13 LEU 53 -7.163 6.138 -25.038 459 HD21 LEU 53 HD21 LEU 53 -9.898 5.498 -25.792 460 HD22 LEU 53 HD22 LEU 53 -8.585 5.168 -26.922 461 HD23 LEU 53 HD23 LEU 53 -9.987 6.100 -27.448 462 H ALA 54 HN ALA 54 -10.915 10.588 -24.412 463 HA ALA 54 HA ALA 54 -11.872 10.028 -21.816 464 HB1 ALA 54 HB1 ALA 54 -10.636 12.102 -22.595 465 HB2 ALA 54 HB2 ALA 54 -11.999 12.356 -21.504 466 HB3 ALA 54 HB3 ALA 54 -12.185 12.657 -23.233 467 H GLU 55 HN GLU 55 -13.411 11.063 -24.809 468 HA GLU 55 HA GLU 55 -16.044 11.343 -23.771 469 HB2 GLU 55 HB2 GLU 55 -15.305 12.372 -25.901 470 HB3 GLU 55 HB1 GLU 55 -15.173 10.769 -26.612 471 HG2 GLU 55 HG2 GLU 55 -17.567 10.426 -26.323 472 HG3 GLU 55 HG1 GLU 55 -17.713 12.010 -25.567 473 H GLU 56 HN GLU 56 -14.276 8.658 -25.207 474 HA GLU 56 HA GLU 56 -16.429 6.882 -25.505 475 HB2 GLU 56 HB2 GLU 56 -13.491 6.370 -24.994 476 HB3 GLU 56 HB1 GLU 56 -14.646 5.093 -25.356 477 HG2 GLU 56 HG2 GLU 56 -13.936 7.411 -27.157 478 HG3 GLU 56 HG1 GLU 56 -13.389 5.741 -27.334 479 H ASP 57 HN ASP 57 -14.292 7.492 -22.718 480 HA ASP 57 HA ASP 57 -15.968 5.682 -21.146 481 HB2 ASP 57 HB2 ASP 57 -13.307 7.012 -20.535 482 HB3 ASP 57 HB1 ASP 57 -14.237 6.161 -19.306 483 H LYS 58 HN LYS 58 -16.399 8.605 -22.112 484 HA LYS 58 HA LYS 58 -17.489 10.464 -21.421 485 HB2 LYS 58 HB2 LYS 58 -18.730 8.440 -19.562 486 HB3 LYS 58 HB1 LYS 58 -19.353 10.065 -19.810 487 HG2 LYS 58 HG2 LYS 58 -19.690 9.572 -22.187 488 HG3 LYS 58 HG1 LYS 58 -19.076 7.938 -21.928 489 HD2 LYS 58 HD2 LYS 58 -20.909 7.518 -20.341 490 HD3 LYS 58 HD1 LYS 58 -21.532 9.140 -20.647 491 HE2 LYS 58 HE2 LYS 58 -21.220 6.963 -22.714 492 HE3 LYS 58 HE1 LYS 58 -22.733 7.418 -21.931 493 HZ1 LYS 58 HZ1 LYS 58 -22.813 8.591 -23.891 494 HZ2 LYS 58 HZ2 LYS 58 -21.153 8.910 -23.913 495 HZ3 LYS 58 HZ3 LYS 58 -22.159 9.750 -22.845 496 H ILE 59 HN ILE 59 -15.038 10.621 -20.439 497 HA ILE 59 HA ILE 59 -15.133 11.103 -17.570 498 HB ILE 59 HB ILE 59 -12.872 11.586 -19.519 499 HG12 ILE 59 HG12 ILE 59 -13.515 9.231 -19.502 500 HG13 ILE 59 HG11 ILE 59 -11.963 9.447 -18.698 501 HG21 ILE 59 HG21 ILE 59 -13.008 11.555 -16.512 502 HG22 ILE 59 HG22 ILE 59 -12.462 12.858 -17.568 503 HG23 ILE 59 HG23 ILE 59 -11.495 11.394 -17.402 504 HD11 ILE 59 HD11 ILE 59 -13.565 9.599 -16.573 505 HD12 ILE 59 HD12 ILE 59 -12.927 8.076 -17.192 506 HD13 ILE 59 HD13 ILE 59 -14.565 8.584 -17.611 507 H LEU 60 HN LEU 60 -16.217 12.905 -17.027 508 HA LEU 60 HA LEU 60 -15.711 15.365 -18.554 509 HB2 LEU 60 HB2 LEU 60 -17.970 14.708 -16.663 510 HB3 LEU 60 HB1 LEU 60 -17.782 16.218 -17.532 511 HG LEU 60 HG LEU 60 -18.223 13.517 -18.812 512 HD11 LEU 60 HD11 LEU 60 -20.438 14.410 -19.382 513 HD12 LEU 60 HD12 LEU 60 -20.092 15.851 -18.424 514 HD13 LEU 60 HD13 LEU 60 -20.205 14.276 -17.639 515 HD21 LEU 60 HD21 LEU 60 -18.720 15.058 -20.811 516 HD22 LEU 60 HD22 LEU 60 -17.035 14.757 -20.386 517 HD23 LEU 60 HD23 LEU 60 -17.804 16.272 -19.917 518 H ALA 61 HN ALA 61 -14.504 13.908 -15.922 519 HA ALA 61 HA ALA 61 -13.840 16.465 -14.676 520 HB1 ALA 61 HB1 ALA 61 -15.818 15.080 -13.541 521 HB2 ALA 61 HB2 ALA 61 -14.653 16.015 -12.603 522 HB3 ALA 61 HB3 ALA 61 -14.448 14.272 -12.778 523 H THR 62 HN THR 62 -11.898 16.471 -13.524 524 HA THR 62 HA THR 62 -10.284 14.065 -13.403 525 HB THR 62 HB THR 62 -8.321 15.268 -14.416 526 HG1 THR 62 HG1 THR 62 -9.648 17.368 -14.242 527 HG21 THR 62 HG21 THR 62 -8.956 14.920 -16.755 528 HG22 THR 62 HG22 THR 62 -10.656 14.845 -16.285 529 HG23 THR 62 HG23 THR 62 -9.533 13.601 -15.733 530 HA PRO 63 HA PRO 63 -8.288 13.583 -12.840 531 HB2 PRO 63 HB2 PRO 63 -7.431 12.806 -10.171 532 HB3 PRO 63 HB1 PRO 63 -6.437 13.165 -11.585 533 HG2 PRO 63 HG2 PRO 63 -6.495 14.762 -9.390 534 HG3 PRO 63 HG1 PRO 63 -6.213 15.386 -11.026 535 HD2 PRO 63 HD2 PRO 63 -8.755 15.365 -9.426 536 HD3 PRO 63 HD1 PRO 63 -8.046 16.682 -10.390 537 H THR 64 HN THR 64 -9.075 11.478 -12.807 538 HA THR 64 HA THR 64 -11.151 10.900 -10.801 539 HB THR 64 HB THR 64 -11.315 10.163 -13.734 540 HG1 THR 64 HG1 THR 64 -12.138 12.150 -13.741 541 HG21 THR 64 HG21 THR 64 -13.486 9.216 -13.220 542 HG22 THR 64 HG22 THR 64 -13.301 9.652 -11.520 543 HG23 THR 64 HG23 THR 64 -12.249 8.431 -12.237 544 H LEU 65 HN LEU 65 -10.891 9.051 -9.775 545 HA LEU 65 HA LEU 65 -8.753 7.219 -10.647 546 HB2 LEU 65 HB2 LEU 65 -8.732 8.368 -8.376 547 HB3 LEU 65 HB1 LEU 65 -10.129 7.395 -7.969 548 HG LEU 65 HG LEU 65 -8.709 5.354 -8.407 549 HD11 LEU 65 HD11 LEU 65 -6.611 7.495 -8.608 550 HD12 LEU 65 HD12 LEU 65 -6.973 6.204 -9.753 551 HD13 LEU 65 HD13 LEU 65 -6.229 5.822 -8.200 552 HD21 LEU 65 HD21 LEU 65 -9.169 6.538 -6.143 553 HD22 LEU 65 HD22 LEU 65 -7.478 7.026 -6.252 554 HD23 LEU 65 HD23 LEU 65 -7.902 5.315 -6.236 555 H ALA 66 HN ALA 66 -9.433 5.362 -11.631 556 HA ALA 66 HA ALA 66 -11.856 4.083 -10.579 557 HB1 ALA 66 HB1 ALA 66 -12.232 5.589 -12.723 558 HB2 ALA 66 HB2 ALA 66 -13.038 4.032 -12.537 559 HB3 ALA 66 HB3 ALA 66 -11.597 4.161 -13.543 560 H LYS 67 HN LYS 67 -11.879 1.959 -10.595 561 HA LYS 67 HA LYS 67 -9.473 0.601 -11.562 562 HB2 LYS 67 HB2 LYS 67 -10.019 0.265 -9.184 563 HB3 LYS 67 HB1 LYS 67 -11.629 -0.279 -9.614 564 HG2 LYS 67 HG2 LYS 67 -9.494 -1.839 -10.867 565 HG3 LYS 67 HG1 LYS 67 -9.488 -1.894 -9.105 566 HD2 LYS 67 HD2 LYS 67 -12.160 -2.177 -10.224 567 HD3 LYS 67 HD1 LYS 67 -11.052 -3.429 -10.787 568 HE2 LYS 67 HE2 LYS 67 -10.475 -3.963 -8.474 569 HE3 LYS 67 HE1 LYS 67 -11.569 -2.705 -7.906 570 HZ1 LYS 67 HZ1 LYS 67 -13.395 -3.939 -8.391 571 HZ2 LYS 67 HZ2 LYS 67 -12.317 -5.205 -8.085 572 HZ3 LYS 67 HZ3 LYS 67 -12.665 -4.758 -9.684 573 H VAL 68 HN VAL 68 -9.807 -0.020 -13.637 574 HA VAL 68 HA VAL 68 -12.455 -0.674 -14.560 575 HB VAL 68 HB VAL 68 -11.376 -1.049 -16.749 576 HG11 VAL 68 HG11 VAL 68 -10.395 1.544 -15.604 577 HG12 VAL 68 HG12 VAL 68 -12.113 1.215 -15.830 578 HG13 VAL 68 HG13 VAL 68 -11.026 1.219 -17.219 579 HG21 VAL 68 HG21 VAL 68 -8.807 0.093 -15.976 580 HG22 VAL 68 HG22 VAL 68 -9.167 -1.258 -17.048 581 HG23 VAL 68 HG23 VAL 68 -9.088 -1.512 -15.305 582 H LEU 69 HN LEU 69 -9.622 -2.419 -13.526 583 HA LEU 69 HA LEU 69 -11.118 -4.914 -13.994 584 HB2 LEU 69 HB2 LEU 69 -8.199 -4.510 -14.652 585 HB3 LEU 69 HB1 LEU 69 -9.023 -6.054 -14.672 586 HG LEU 69 HG LEU 69 -9.745 -3.728 -16.459 587 HD11 LEU 69 HD11 LEU 69 -7.699 -5.820 -16.687 588 HD12 LEU 69 HD12 LEU 69 -7.832 -4.262 -17.504 589 HD13 LEU 69 HD13 LEU 69 -8.750 -5.648 -18.093 590 HD21 LEU 69 HD21 LEU 69 -11.635 -5.117 -16.216 591 HD22 LEU 69 HD22 LEU 69 -10.662 -6.588 -16.295 592 HD23 LEU 69 HD23 LEU 69 -10.882 -5.597 -17.737 593 HA PRO 70 HA PRO 70 -11.090 -6.910 -13.541 594 HB2 PRO 70 HB2 PRO 70 -12.189 -8.564 -11.754 595 HB3 PRO 70 HB1 PRO 70 -10.488 -8.719 -12.214 596 HG2 PRO 70 HG2 PRO 70 -11.684 -7.430 -9.785 597 HG3 PRO 70 HG1 PRO 70 -10.285 -8.515 -9.899 598 HD2 PRO 70 HD2 PRO 70 -10.091 -5.783 -9.738 599 HD3 PRO 70 HD1 PRO 70 -8.868 -6.816 -10.502 600 HA PRO 71 HA PRO 71 -15.017 -4.811 -13.281 601 HB2 PRO 71 HB2 PRO 71 -16.181 -7.337 -14.327 602 HB3 PRO 71 HB1 PRO 71 -16.281 -5.699 -14.984 603 HG2 PRO 71 HG2 PRO 71 -14.723 -7.505 -16.144 604 HG3 PRO 71 HG1 PRO 71 -14.175 -5.826 -15.967 605 HD2 PRO 71 HD2 PRO 71 -13.446 -8.235 -14.335 606 HD3 PRO 71 HD1 PRO 71 -12.406 -6.937 -14.953 607 HA PRO 72 HA PRO 72 -17.463 -4.460 -13.151 608 HB2 PRO 72 HB2 PRO 72 -18.321 -3.297 -10.587 609 HB3 PRO 72 HB1 PRO 72 -19.286 -3.739 -12.000 610 HG2 PRO 72 HG2 PRO 72 -19.415 -5.163 -9.739 611 HG3 PRO 72 HG1 PRO 72 -19.497 -5.949 -11.329 612 HD2 PRO 72 HD2 PRO 72 -17.151 -5.692 -9.467 613 HD3 PRO 72 HD1 PRO 72 -17.726 -7.122 -10.352 614 H VAL 73 HN VAL 73 -17.073 -2.214 -13.403 615 HA VAL 73 HA VAL 73 -14.464 -1.385 -12.570 616 HB VAL 73 HB VAL 73 -16.620 0.141 -14.053 617 HG11 VAL 73 HG11 VAL 73 -13.809 0.830 -13.329 618 HG12 VAL 73 HG12 VAL 73 -15.253 1.845 -13.338 619 HG13 VAL 73 HG13 VAL 73 -14.474 1.404 -14.858 620 HG21 VAL 73 HG21 VAL 73 -14.648 -0.405 -15.857 621 HG22 VAL 73 HG22 VAL 73 -16.131 -1.340 -15.666 622 HG23 VAL 73 HG23 VAL 73 -14.648 -1.866 -14.869 623 H ARG 74 HN ARG 74 -13.925 -0.224 -10.839 624 HA ARG 74 HA ARG 74 -16.067 1.016 -9.243 625 HB2 ARG 74 HB2 ARG 74 -14.917 -0.652 -7.978 626 HB3 ARG 74 HB1 ARG 74 -13.349 -0.052 -8.491 627 HG2 ARG 74 HG2 ARG 74 -13.735 0.565 -6.204 628 HG3 ARG 74 HG1 ARG 74 -13.750 2.015 -7.208 629 HD2 ARG 74 HD2 ARG 74 -15.548 2.139 -5.607 630 HD3 ARG 74 HD1 ARG 74 -16.224 1.930 -7.221 631 HE ARG 74 HE ARG 74 -15.904 -0.581 -5.960 632 HH11 ARG 74 HH11 ARG 74 -17.888 2.281 -5.884 633 HH12 ARG 74 HH12 ARG 74 -19.287 1.457 -5.283 634 HH21 ARG 74 HH21 ARG 74 -17.735 -1.682 -5.167 635 HH22 ARG 74 HH22 ARG 74 -19.199 -0.804 -4.873 636 H ARG 75 HN ARG 75 -16.237 3.130 -9.293 637 HA ARG 75 HA ARG 75 -13.882 4.680 -10.090 638 HB2 ARG 75 HB2 ARG 75 -16.802 5.433 -10.118 639 HB3 ARG 75 HB1 ARG 75 -15.480 6.507 -10.555 640 HG2 ARG 75 HG2 ARG 75 -14.856 4.952 -12.364 641 HG3 ARG 75 HG1 ARG 75 -16.271 3.971 -11.967 642 HD2 ARG 75 HD2 ARG 75 -17.717 5.891 -12.425 643 HD3 ARG 75 HD1 ARG 75 -16.300 6.860 -12.821 644 HE ARG 75 HE ARG 75 -16.160 5.791 -14.859 645 HH11 ARG 75 HH11 ARG 75 -18.502 4.182 -12.841 646 HH12 ARG 75 HH12 ARG 75 -19.133 3.206 -14.126 647 HH21 ARG 75 HH21 ARG 75 -16.981 4.516 -16.558 648 HH22 ARG 75 HH22 ARG 75 -18.265 3.397 -16.244 649 H ILE 76 HN ILE 76 -12.888 5.884 -8.687 650 HA ILE 76 HA ILE 76 -14.156 6.382 -6.069 651 HB ILE 76 HB ILE 76 -11.218 6.268 -6.748 652 HG12 ILE 76 HG12 ILE 76 -12.927 4.310 -5.197 653 HG13 ILE 76 HG11 ILE 76 -12.393 4.079 -6.861 654 HG21 ILE 76 HG21 ILE 76 -11.452 7.744 -4.923 655 HG22 ILE 76 HG22 ILE 76 -11.021 6.187 -4.213 656 HG23 ILE 76 HG23 ILE 76 -12.694 6.744 -4.171 657 HD11 ILE 76 HD11 ILE 76 -10.908 2.830 -5.600 658 HD12 ILE 76 HD12 ILE 76 -10.774 4.076 -4.358 659 HD13 ILE 76 HD13 ILE 76 -10.034 4.324 -5.937 660 H ILE 77 HN ILE 77 -14.785 8.458 -5.784 661 HA ILE 77 HA ILE 77 -13.258 10.567 -7.159 662 HB ILE 77 HB ILE 77 -16.188 10.715 -6.476 663 HG12 ILE 77 HG12 ILE 77 -15.914 10.720 -9.252 664 HG13 ILE 77 HG11 ILE 77 -14.831 9.442 -8.710 665 HG21 ILE 77 HG21 ILE 77 -14.650 12.809 -6.771 666 HG22 ILE 77 HG22 ILE 77 -16.246 12.767 -7.520 667 HG23 ILE 77 HG23 ILE 77 -14.809 12.435 -8.488 668 HD11 ILE 77 HD11 ILE 77 -17.122 8.677 -9.259 669 HD12 ILE 77 HD12 ILE 77 -17.722 9.651 -7.915 670 HD13 ILE 77 HD13 ILE 77 -16.618 8.309 -7.609 671 H GLY 78 HN GLY 78 -12.330 12.045 -5.889 672 HA2 GLY 78 HA2 GLY 78 -13.399 13.331 -3.700 673 HA3 GLY 78 HA1 GLY 78 -12.590 11.910 -3.050 674 H ASP 79 HN ASP 79 -11.299 13.656 -1.959 675 HA ASP 79 HA ASP 79 -9.426 15.098 -3.632 676 HB2 ASP 79 HB2 ASP 79 -10.286 16.087 -1.519 677 HB3 ASP 79 HB1 ASP 79 -9.491 14.803 -0.616 678 H LEU 80 HN LEU 80 -8.009 13.794 -4.640 679 HA LEU 80 HA LEU 80 -6.855 11.528 -3.240 680 HB2 LEU 80 HB2 LEU 80 -6.455 12.503 -6.071 681 HB3 LEU 80 HB1 LEU 80 -5.815 11.010 -5.417 682 HG LEU 80 HG LEU 80 -8.751 11.652 -5.718 683 HD11 LEU 80 HD11 LEU 80 -8.786 10.434 -7.662 684 HD12 LEU 80 HD12 LEU 80 -7.316 9.545 -7.260 685 HD13 LEU 80 HD13 LEU 80 -7.215 11.224 -7.792 686 HD21 LEU 80 HD21 LEU 80 -8.987 9.193 -5.277 687 HD22 LEU 80 HD22 LEU 80 -8.467 10.151 -3.889 688 HD23 LEU 80 HD23 LEU 80 -7.293 9.187 -4.785 689 H SER 81 HN SER 81 -6.097 14.739 -3.367 690 HA SER 81 HA SER 81 -3.289 14.634 -3.812 691 HB2 SER 81 HB2 SER 81 -4.929 16.674 -2.277 692 HB3 SER 81 HB1 SER 81 -3.250 16.883 -2.778 693 HG SER 81 HG SER 81 -5.519 17.234 -4.206 694 H ASN 82 HN ASN 82 -5.297 13.818 -1.168 695 HA ASN 82 HA ASN 82 -3.159 13.884 0.794 696 HB2 ASN 82 HB2 ASN 82 -5.470 14.472 1.457 697 HB3 ASN 82 HB1 ASN 82 -5.985 12.850 1.024 698 HD21 ASN 82 HD21 ASN 82 -6.701 13.276 3.384 699 HD22 ASN 82 HD22 ASN 82 -5.631 12.667 4.595 700 H ARG 83 HN ARG 83 -1.761 12.286 0.976 701 HA ARG 83 HA ARG 83 -1.884 9.965 -0.545 702 HB2 ARG 83 HB2 ARG 83 -0.218 10.637 1.886 703 HB3 ARG 83 HB1 ARG 83 -0.022 9.127 1.009 704 HG2 ARG 83 HG2 ARG 83 1.436 10.173 -0.290 705 HG3 ARG 83 HG1 ARG 83 0.087 11.100 -0.949 706 HD2 ARG 83 HD2 ARG 83 1.309 11.992 1.613 707 HD3 ARG 83 HD1 ARG 83 2.185 12.293 0.113 708 HE ARG 83 HE ARG 83 -0.294 13.203 -0.445 709 HH11 ARG 83 HH11 ARG 83 1.916 13.801 2.181 710 HH12 ARG 83 HH12 ARG 83 1.355 15.416 2.457 711 HH21 ARG 83 HH21 ARG 83 -1.041 15.317 -0.101 712 HH22 ARG 83 HH22 ARG 83 -0.335 16.283 1.154 713 H GLU 84 HN GLU 84 -2.953 10.513 2.772 714 HA GLU 84 HA GLU 84 -3.307 7.823 3.497 715 HB2 GLU 84 HB2 GLU 84 -4.681 10.341 4.396 716 HB3 GLU 84 HB1 GLU 84 -5.074 8.764 5.070 717 HG2 GLU 84 HG2 GLU 84 -2.880 8.488 5.920 718 HG3 GLU 84 HG1 GLU 84 -2.298 9.911 5.056 719 H LYS 85 HN LYS 85 -5.600 10.052 1.862 720 HA LYS 85 HA LYS 85 -7.687 8.128 1.867 721 HB2 LYS 85 HB2 LYS 85 -7.232 10.570 0.138 722 HB3 LYS 85 HB1 LYS 85 -8.649 9.543 -0.037 723 HG2 LYS 85 HG2 LYS 85 -9.305 10.053 2.256 724 HG3 LYS 85 HG1 LYS 85 -7.881 11.081 2.438 725 HD2 LYS 85 HD2 LYS 85 -8.698 12.464 0.540 726 HD3 LYS 85 HD1 LYS 85 -10.149 11.465 0.482 727 HE2 LYS 85 HE2 LYS 85 -9.255 13.099 2.857 728 HE3 LYS 85 HE1 LYS 85 -10.512 13.566 1.713 729 HZ1 LYS 85 HZ1 LYS 85 -10.600 11.630 3.874 730 HZ2 LYS 85 HZ2 LYS 85 -11.384 11.165 2.449 731 HZ3 LYS 85 HZ3 LYS 85 -11.832 12.595 3.232 732 H VAL 86 HN VAL 86 -5.195 8.880 -0.526 733 HA VAL 86 HA VAL 86 -6.130 7.087 -2.487 734 HB VAL 86 HB VAL 86 -3.319 8.074 -1.936 735 HG11 VAL 86 HG11 VAL 86 -3.725 7.210 -4.633 736 HG12 VAL 86 HG12 VAL 86 -4.095 5.879 -3.535 737 HG13 VAL 86 HG13 VAL 86 -2.520 6.670 -3.464 738 HG21 VAL 86 HG21 VAL 86 -5.661 9.095 -3.361 739 HG22 VAL 86 HG22 VAL 86 -4.178 9.115 -4.315 740 HG23 VAL 86 HG23 VAL 86 -4.239 9.946 -2.759 741 H LEU 87 HN LEU 87 -3.839 6.637 0.196 742 HA LEU 87 HA LEU 87 -3.239 3.923 -0.360 743 HB2 LEU 87 HB2 LEU 87 -1.757 5.247 0.995 744 HB3 LEU 87 HB1 LEU 87 -3.037 5.612 2.132 745 HG LEU 87 HG LEU 87 -3.082 3.235 2.802 746 HD11 LEU 87 HD11 LEU 87 -1.321 2.976 0.527 747 HD12 LEU 87 HD12 LEU 87 -2.183 1.734 1.436 748 HD13 LEU 87 HD13 LEU 87 -0.604 2.294 1.987 749 HD21 LEU 87 HD21 LEU 87 -0.309 4.362 3.064 750 HD22 LEU 87 HD22 LEU 87 -1.199 3.369 4.216 751 HD23 LEU 87 HD23 LEU 87 -1.698 5.036 3.919 752 H ILE 88 HN ILE 88 -5.537 5.403 1.921 753 HA ILE 88 HA ILE 88 -6.456 2.971 3.003 754 HB ILE 88 HB ILE 88 -7.700 5.706 2.886 755 HG12 ILE 88 HG12 ILE 88 -6.608 4.137 5.225 756 HG13 ILE 88 HG11 ILE 88 -5.616 5.211 4.246 757 HG21 ILE 88 HG21 ILE 88 -9.198 4.739 4.748 758 HG22 ILE 88 HG22 ILE 88 -8.799 3.169 4.050 759 HG23 ILE 88 HG23 ILE 88 -9.615 4.388 3.070 760 HD11 ILE 88 HD11 ILE 88 -7.430 5.820 6.400 761 HD12 ILE 88 HD12 ILE 88 -7.795 6.757 4.950 762 HD13 ILE 88 HD13 ILE 88 -6.177 6.817 5.656 763 H ALA 89 HN ALA 89 -7.807 4.973 0.363 764 HA ALA 89 HA ALA 89 -10.024 3.287 -0.135 765 HB1 ALA 89 HB1 ALA 89 -9.181 4.615 -2.534 766 HB2 ALA 89 HB2 ALA 89 -9.046 5.711 -1.159 767 HB3 ALA 89 HB3 ALA 89 -10.588 4.931 -1.518 768 H LEU 90 HN LEU 90 -6.766 3.369 -1.518 769 HA LEU 90 HA LEU 90 -7.219 1.371 -3.475 770 HB2 LEU 90 HB2 LEU 90 -5.314 2.948 -3.547 771 HB3 LEU 90 HB1 LEU 90 -4.628 2.169 -2.136 772 HG LEU 90 HG LEU 90 -4.373 0.085 -3.435 773 HD11 LEU 90 HD11 LEU 90 -5.662 -0.148 -5.243 774 HD12 LEU 90 HD12 LEU 90 -4.529 0.927 -6.064 775 HD13 LEU 90 HD13 LEU 90 -5.991 1.585 -5.328 776 HD21 LEU 90 HD21 LEU 90 -2.903 2.462 -3.596 777 HD22 LEU 90 HD22 LEU 90 -2.967 1.820 -5.237 778 HD23 LEU 90 HD23 LEU 90 -2.340 0.824 -3.923 779 H ARG 91 HN ARG 91 -6.143 1.249 -0.110 780 HA ARG 91 HA ARG 91 -5.436 -1.496 0.000 781 HB2 ARG 91 HB2 ARG 91 -4.822 0.186 1.720 782 HB3 ARG 91 HB1 ARG 91 -6.511 0.292 2.191 783 HG2 ARG 91 HG2 ARG 91 -6.492 -2.019 2.911 784 HG3 ARG 91 HG1 ARG 91 -4.825 -2.199 2.359 785 HD2 ARG 91 HD2 ARG 91 -4.836 -1.866 4.744 786 HD3 ARG 91 HD1 ARG 91 -4.148 -0.443 3.964 787 HE ARG 91 HE ARG 91 -6.926 -0.100 4.382 788 HH11 ARG 91 HH11 ARG 91 -3.886 -0.143 6.077 789 HH12 ARG 91 HH12 ARG 91 -4.419 0.918 7.337 790 HH21 ARG 91 HH21 ARG 91 -7.647 1.298 6.032 791 HH22 ARG 91 HH22 ARG 91 -6.567 1.740 7.311 792 H LEU 92 HN LEU 92 -8.494 0.192 0.647 793 HA LEU 92 HA LEU 92 -9.954 -2.066 1.459 794 HB2 LEU 92 HB2 LEU 92 -10.733 0.235 1.809 795 HB3 LEU 92 HB1 LEU 92 -10.916 0.447 0.079 796 HG LEU 92 HG LEU 92 -12.688 -1.283 0.075 797 HD11 LEU 92 HD11 LEU 92 -12.203 -2.669 1.896 798 HD12 LEU 92 HD12 LEU 92 -13.664 -1.805 2.375 799 HD13 LEU 92 HD13 LEU 92 -12.097 -1.311 3.017 800 HD21 LEU 92 HD21 LEU 92 -14.252 0.270 0.496 801 HD22 LEU 92 HD22 LEU 92 -12.875 1.336 0.776 802 HD23 LEU 92 HD23 LEU 92 -13.676 0.552 2.138 803 H LEU 93 HN LEU 93 -9.410 -0.683 -1.746 804 HA LEU 93 HA LEU 93 -11.162 -2.425 -3.145 805 HB2 LEU 93 HB2 LEU 93 -9.000 -0.527 -3.853 806 HB3 LEU 93 HB1 LEU 93 -9.338 -1.783 -5.029 807 HG LEU 93 HG LEU 93 -10.539 0.311 -5.509 808 HD11 LEU 93 HD11 LEU 93 -12.862 -1.265 -4.892 809 HD12 LEU 93 HD12 LEU 93 -11.556 -2.285 -5.495 810 HD13 LEU 93 HD13 LEU 93 -12.120 -0.916 -6.453 811 HD21 LEU 93 HD21 LEU 93 -10.828 0.910 -3.061 812 HD22 LEU 93 HD22 LEU 93 -12.190 -0.212 -3.054 813 HD23 LEU 93 HD23 LEU 93 -12.214 1.198 -4.115 814 H ALA 94 HN ALA 94 -7.710 -2.558 -2.380 815 HA ALA 94 HA ALA 94 -7.097 -4.889 -3.832 816 HB1 ALA 94 HB1 ALA 94 -5.510 -3.184 -2.745 817 HB2 ALA 94 HB2 ALA 94 -5.035 -4.883 -2.755 818 HB3 ALA 94 HB3 ALA 94 -5.697 -4.160 -1.287 819 H GLU 95 HN GLU 95 -8.310 -4.442 -0.535 820 HA GLU 95 HA GLU 95 -8.015 -7.096 0.350 821 HB2 GLU 95 HB2 GLU 95 -9.948 -4.907 1.107 822 HB3 GLU 95 HB1 GLU 95 -9.892 -6.461 1.930 823 HG2 GLU 95 HG2 GLU 95 -7.660 -6.055 2.686 824 HG3 GLU 95 HG1 GLU 95 -7.540 -4.599 1.699 825 H GLU 96 HN GLU 96 -10.574 -5.460 -1.428 826 HA GLU 96 HA GLU 96 -12.484 -7.528 -1.385 827 HB2 GLU 96 HB2 GLU 96 -11.949 -5.307 -3.372 828 HB3 GLU 96 HB1 GLU 96 -13.334 -6.389 -3.490 829 HG2 GLU 96 HG2 GLU 96 -14.183 -5.612 -1.370 830 HG3 GLU 96 HG1 GLU 96 -12.745 -4.624 -1.121 831 H ILE 97 HN ILE 97 -9.820 -6.787 -3.545 832 HA ILE 97 HA ILE 97 -10.312 -8.767 -5.498 833 HB ILE 97 HB ILE 97 -7.760 -7.361 -4.700 834 HG12 ILE 97 HG12 ILE 97 -9.587 -6.880 -7.054 835 HG13 ILE 97 HG11 ILE 97 -9.740 -6.024 -5.522 836 HG21 ILE 97 HG21 ILE 97 -8.305 -8.863 -7.262 837 HG22 ILE 97 HG22 ILE 97 -7.367 -9.514 -5.919 838 HG23 ILE 97 HG23 ILE 97 -6.796 -8.084 -6.781 839 HD11 ILE 97 HD11 ILE 97 -8.238 -5.248 -7.663 840 HD12 ILE 97 HD12 ILE 97 -7.048 -5.954 -6.568 841 HD13 ILE 97 HD13 ILE 97 -8.097 -4.648 -6.011 842 H GLY 98 HN GLY 98 -8.243 -8.704 -2.611 843 HA2 GLY 98 HA2 GLY 98 -7.081 -11.250 -2.922 844 HA3 GLY 98 HA1 GLY 98 -7.246 -10.385 -1.400 845 H ASP 99 HN ASP 99 -10.107 -10.251 -1.442 846 HA ASP 99 HA ASP 99 -10.756 -12.667 -0.158 847 HB2 ASP 99 HB2 ASP 99 -11.900 -10.501 0.258 848 HB3 ASP 99 HB1 ASP 99 -12.661 -10.626 -1.325 849 H TYR 100 HN TYR 100 -11.344 -11.543 -3.452 850 HA TYR 100 HA TYR 100 -12.858 -13.918 -4.124 851 HB2 TYR 100 HB2 TYR 100 -13.508 -11.767 -5.107 852 HB3 TYR 100 HB1 TYR 100 -11.914 -11.604 -5.838 853 HD1 TYR 100 HD1 TYR 100 -14.939 -13.780 -5.838 854 HD2 TYR 100 HD2 TYR 100 -11.519 -12.436 -7.986 855 HE1 TYR 100 HE1 TYR 100 -15.750 -14.941 -7.848 856 HE2 TYR 100 HE2 TYR 100 -12.324 -13.593 -10.001 857 HH TYR 100 HH TYR 100 -14.269 -15.909 -10.138 858 H LYS 101 HN LYS 101 -11.835 -15.744 -4.508 859 HA LYS 101 HA LYS 101 -9.070 -15.760 -5.378 860 HB2 LYS 101 HB2 LYS 101 -10.934 -18.065 -4.772 861 HB3 LYS 101 HB1 LYS 101 -9.204 -18.193 -5.052 862 HG2 LYS 101 HG2 LYS 101 -10.476 -16.677 -2.779 863 HG3 LYS 101 HG1 LYS 101 -9.804 -18.305 -2.668 864 HD2 LYS 101 HD2 LYS 101 -8.225 -15.877 -3.516 865 HD3 LYS 101 HD1 LYS 101 -8.280 -16.490 -1.863 866 HE2 LYS 101 HE2 LYS 101 -7.407 -18.655 -2.674 867 HE3 LYS 101 HE1 LYS 101 -7.283 -17.973 -4.295 868 HZ1 LYS 101 HZ1 LYS 101 -5.164 -17.725 -3.447 869 HZ2 LYS 101 HZ2 LYS 101 -5.704 -17.323 -1.892 870 HZ3 LYS 101 HZ3 LYS 101 -5.843 -16.201 -3.152 871 H ASP 102 HN ASP 102 -8.345 -16.272 -7.374 872 HA ASP 102 HA ASP 102 -10.224 -17.372 -9.332 873 HB2 ASP 102 HB2 ASP 102 -10.240 -14.862 -9.506 874 HB3 ASP 102 HB1 ASP 102 -8.531 -14.936 -9.925 875 H ASP 103 HN ASP 103 -9.259 -19.183 -9.955 876 HA ASP 103 HA ASP 103 -7.715 -20.691 -10.671 877 HB2 ASP 103 HB2 ASP 103 -7.653 -18.879 -12.503 878 HB3 ASP 103 HB1 ASP 103 -6.121 -18.394 -11.784 879 H ASP 104 HN ASP 104 -7.345 -20.240 -8.076 880 HA ASP 104 HA ASP 104 -4.779 -19.318 -7.318 881 HB2 ASP 104 HB2 ASP 104 -6.734 -19.564 -5.772 882 HB3 ASP 104 HB1 ASP 104 -6.505 -21.309 -5.835 883 H ASP 105 HN ASP 105 -5.932 -22.408 -8.461 884 HA ASP 105 HA ASP 105 -3.435 -23.731 -7.739 885 HB2 ASP 105 HB2 ASP 105 -5.603 -24.924 -7.459 886 HB3 ASP 105 HB1 ASP 105 -5.834 -24.852 -9.204 887 H LYS 106 HN LYS 106 -1.823 -23.046 -9.030 888 HA LYS 106 HA LYS 106 -0.531 -22.717 -10.867 889 HB2 LYS 106 HB2 LYS 106 -2.290 -24.991 -11.714 890 HB3 LYS 106 HB1 LYS 106 -1.155 -24.289 -12.859 891 HG2 LYS 106 HG2 LYS 106 0.704 -24.826 -11.430 892 HG3 LYS 106 HG1 LYS 106 -0.387 -25.384 -10.160 893 HD2 LYS 106 HD2 LYS 106 0.474 -27.310 -11.284 894 HD3 LYS 106 HD1 LYS 106 -1.219 -27.126 -11.749 895 HE2 LYS 106 HE2 LYS 106 -0.553 -26.106 -13.851 896 HE3 LYS 106 HE1 LYS 106 1.144 -26.195 -13.380 897 HZ1 LYS 106 HZ1 LYS 106 1.077 -28.552 -13.469 898 HZ2 LYS 106 HZ2 LYS 106 0.386 -27.989 -14.906 899 HZ3 LYS 106 HZ3 LYS 106 -0.603 -28.575 -13.666 Start of MODEL 12 1 H1 MET 1 HT1 MET 1 3.458 -7.912 -23.163 2 H2 MET 1 HT2 MET 1 1.776 -8.082 -23.105 3 H3 MET 1 HT3 MET 1 2.538 -7.725 -24.571 4 HA MET 1 HA MET 1 1.999 -9.990 -24.678 5 HB2 MET 1 HB2 MET 1 4.898 -9.717 -23.849 6 HB3 MET 1 HB1 MET 1 4.218 -11.064 -24.750 7 HG2 MET 1 HG2 MET 1 3.685 -9.588 -26.602 8 HG3 MET 1 HG1 MET 1 4.298 -8.207 -25.693 9 HE1 MET 1 HE1 MET 1 6.297 -7.455 -27.558 10 HE2 MET 1 HE2 MET 1 5.147 -8.482 -28.414 11 HE3 MET 1 HE3 MET 1 6.880 -8.760 -28.590 12 H ALA 2 HN ALA 2 2.615 -8.863 -21.595 13 HA ALA 2 HA ALA 2 2.642 -11.525 -20.379 14 HB1 ALA 2 HB1 ALA 2 4.180 -9.574 -19.666 15 HB2 ALA 2 HB2 ALA 2 3.406 -10.547 -18.414 16 HB3 ALA 2 HB3 ALA 2 2.751 -8.964 -18.832 17 HA PRO 3 HA PRO 3 -1.791 -11.068 -19.881 18 HB2 PRO 3 HB2 PRO 3 -2.249 -13.489 -18.799 19 HB3 PRO 3 HB1 PRO 3 -1.937 -13.266 -20.525 20 HG2 PRO 3 HG2 PRO 3 -0.050 -14.083 -18.353 21 HG3 PRO 3 HG1 PRO 3 -0.264 -14.790 -19.963 22 HD2 PRO 3 HD2 PRO 3 1.740 -13.072 -19.397 23 HD3 PRO 3 HD1 PRO 3 0.961 -13.119 -20.993 24 H LEU 4 HN LEU 4 -3.249 -10.757 -18.177 25 HA LEU 4 HA LEU 4 -1.970 -10.507 -15.537 26 HB2 LEU 4 HB2 LEU 4 -4.372 -9.021 -16.613 27 HB3 LEU 4 HB1 LEU 4 -3.600 -8.754 -15.061 28 HG LEU 4 HG LEU 4 -2.370 -8.219 -17.767 29 HD11 LEU 4 HD11 LEU 4 -3.358 -6.353 -15.619 30 HD12 LEU 4 HD12 LEU 4 -4.077 -6.603 -17.210 31 HD13 LEU 4 HD13 LEU 4 -2.480 -5.867 -17.069 32 HD21 LEU 4 HD21 LEU 4 -1.257 -8.187 -15.002 33 HD22 LEU 4 HD22 LEU 4 -0.690 -6.998 -16.175 34 HD23 LEU 4 HD23 LEU 4 -0.518 -8.721 -16.513 35 H ARG 5 HN ARG 5 -2.834 -11.562 -13.825 36 HA ARG 5 HA ARG 5 -5.422 -12.910 -14.228 37 HB2 ARG 5 HB2 ARG 5 -3.151 -14.289 -14.222 38 HB3 ARG 5 HB1 ARG 5 -3.366 -14.177 -12.482 39 HG2 ARG 5 HG2 ARG 5 -4.331 -16.222 -13.155 40 HG3 ARG 5 HG1 ARG 5 -5.670 -15.127 -12.808 41 HD2 ARG 5 HD2 ARG 5 -4.658 -15.225 -15.596 42 HD3 ARG 5 HD1 ARG 5 -5.578 -16.613 -15.013 43 HE ARG 5 HE ARG 5 -7.021 -14.335 -14.348 44 HH11 ARG 5 HH11 ARG 5 -5.930 -15.966 -17.223 45 HH12 ARG 5 HH12 ARG 5 -7.253 -15.417 -18.198 46 HH21 ARG 5 HH21 ARG 5 -8.767 -13.603 -15.614 47 HH22 ARG 5 HH22 ARG 5 -8.872 -14.068 -17.279 48 H LYS 6 HN LYS 6 -3.132 -12.449 -11.523 49 HA LYS 6 HA LYS 6 -5.390 -11.856 -9.771 50 HB2 LYS 6 HB2 LYS 6 -2.465 -12.261 -9.116 51 HB3 LYS 6 HB1 LYS 6 -3.758 -12.061 -7.941 52 HG2 LYS 6 HG2 LYS 6 -3.555 -14.328 -9.917 53 HG3 LYS 6 HG1 LYS 6 -3.075 -14.407 -8.221 54 HD2 LYS 6 HD2 LYS 6 -5.403 -13.844 -7.581 55 HD3 LYS 6 HD1 LYS 6 -5.853 -13.891 -9.286 56 HE2 LYS 6 HE2 LYS 6 -4.662 -16.198 -7.752 57 HE3 LYS 6 HE1 LYS 6 -6.382 -15.984 -8.073 58 HZ1 LYS 6 HZ1 LYS 6 -4.313 -16.966 -9.798 59 HZ2 LYS 6 HZ2 LYS 6 -5.245 -15.758 -10.528 60 HZ3 LYS 6 HZ3 LYS 6 -5.993 -17.150 -9.915 61 H THR 7 HN THR 7 -3.339 -10.120 -11.692 62 HA THR 7 HA THR 7 -3.019 -7.888 -9.859 63 HB THR 7 HB THR 7 -2.041 -6.830 -12.050 64 HG1 THR 7 HG1 THR 7 -2.670 -8.404 -13.508 65 HG21 THR 7 HG21 THR 7 -0.912 -8.688 -10.086 66 HG22 THR 7 HG22 THR 7 -0.326 -7.113 -10.630 67 HG23 THR 7 HG23 THR 7 0.023 -8.559 -11.576 68 H ALA 8 HN ALA 8 -4.387 -6.295 -9.698 69 HA ALA 8 HA ALA 8 -6.634 -6.075 -11.522 70 HB1 ALA 8 HB1 ALA 8 -7.635 -4.705 -9.908 71 HB2 ALA 8 HB2 ALA 8 -6.087 -4.282 -9.177 72 HB3 ALA 8 HB3 ALA 8 -6.746 -5.905 -8.968 73 H VAL 9 HN VAL 9 -7.228 -4.108 -12.576 74 HA VAL 9 HA VAL 9 -4.870 -2.478 -13.247 75 HB VAL 9 HB VAL 9 -7.345 -2.978 -14.909 76 HG11 VAL 9 HG11 VAL 9 -5.711 -1.889 -16.673 77 HG12 VAL 9 HG12 VAL 9 -5.013 -1.138 -15.237 78 HG13 VAL 9 HG13 VAL 9 -6.713 -0.881 -15.630 79 HG21 VAL 9 HG21 VAL 9 -5.413 -4.761 -14.556 80 HG22 VAL 9 HG22 VAL 9 -4.626 -3.778 -15.790 81 HG23 VAL 9 HG23 VAL 9 -6.189 -4.523 -16.122 82 H LEU 10 HN LEU 10 -4.895 -0.484 -12.561 83 HA LEU 10 HA LEU 10 -7.471 0.763 -11.838 84 HB2 LEU 10 HB2 LEU 10 -5.940 0.298 -9.921 85 HB3 LEU 10 HB1 LEU 10 -4.726 1.302 -10.683 86 HG LEU 10 HG LEU 10 -6.274 3.248 -10.462 87 HD11 LEU 10 HD11 LEU 10 -8.134 3.008 -8.810 88 HD12 LEU 10 HD12 LEU 10 -7.925 1.260 -8.916 89 HD13 LEU 10 HD13 LEU 10 -8.410 2.177 -10.342 90 HD21 LEU 10 HD21 LEU 10 -4.744 3.394 -8.823 91 HD22 LEU 10 HD22 LEU 10 -5.052 1.758 -8.240 92 HD23 LEU 10 HD23 LEU 10 -6.150 3.070 -7.806 93 H LYS 11 HN LYS 11 -7.969 2.641 -12.954 94 HA LYS 11 HA LYS 11 -5.802 3.665 -14.665 95 HB2 LYS 11 HB2 LYS 11 -8.769 3.545 -15.224 96 HB3 LYS 11 HB1 LYS 11 -7.635 4.489 -16.182 97 HG2 LYS 11 HG2 LYS 11 -6.428 2.438 -16.756 98 HG3 LYS 11 HG1 LYS 11 -7.595 1.500 -15.825 99 HD2 LYS 11 HD2 LYS 11 -9.389 2.258 -17.293 100 HD3 LYS 11 HD1 LYS 11 -8.240 3.236 -18.208 101 HE2 LYS 11 HE2 LYS 11 -7.027 1.216 -18.850 102 HE3 LYS 11 HE1 LYS 11 -8.163 0.233 -17.927 103 HZ1 LYS 11 HZ1 LYS 11 -9.556 1.904 -19.738 104 HZ2 LYS 11 HZ2 LYS 11 -9.548 0.216 -19.639 105 HZ3 LYS 11 HZ3 LYS 11 -8.383 1.013 -20.571 106 H LEU 12 HN LEU 12 -5.302 5.739 -14.528 107 HA LEU 12 HA LEU 12 -6.993 7.401 -12.791 108 HB2 LEU 12 HB2 LEU 12 -4.329 6.819 -12.502 109 HB3 LEU 12 HB1 LEU 12 -4.265 8.353 -13.347 110 HG LEU 12 HG LEU 12 -5.563 7.810 -10.675 111 HD11 LEU 12 HD11 LEU 12 -3.438 9.830 -11.201 112 HD12 LEU 12 HD12 LEU 12 -2.998 8.131 -11.023 113 HD13 LEU 12 HD13 LEU 12 -3.833 8.969 -9.714 114 HD21 LEU 12 HD21 LEU 12 -5.792 10.122 -12.537 115 HD22 LEU 12 HD22 LEU 12 -5.729 10.427 -10.801 116 HD23 LEU 12 HD23 LEU 12 -7.000 9.405 -11.471 117 H TYR 13 HN TYR 13 -8.001 9.131 -13.801 118 HA TYR 13 HA TYR 13 -7.135 9.766 -16.534 119 HB2 TYR 13 HB2 TYR 13 -9.677 10.422 -15.026 120 HB3 TYR 13 HB1 TYR 13 -9.346 10.847 -16.701 121 HD1 TYR 13 HD1 TYR 13 -10.260 8.161 -14.405 122 HD2 TYR 13 HD2 TYR 13 -9.301 9.112 -18.440 123 HE1 TYR 13 HE1 TYR 13 -11.163 5.991 -15.125 124 HE2 TYR 13 HE2 TYR 13 -10.204 6.943 -19.170 125 HH TYR 13 HH TYR 13 -11.270 5.082 -18.555 126 H VAL 14 HN VAL 14 -5.898 11.541 -16.765 127 HA VAL 14 HA VAL 14 -6.202 13.717 -14.794 128 HB VAL 14 HB VAL 14 -3.775 14.206 -15.118 129 HG11 VAL 14 HG11 VAL 14 -4.532 11.564 -13.872 130 HG12 VAL 14 HG12 VAL 14 -4.521 13.145 -13.084 131 HG13 VAL 14 HG13 VAL 14 -3.001 12.400 -13.594 132 HG21 VAL 14 HG21 VAL 14 -3.269 13.059 -17.138 133 HG22 VAL 14 HG22 VAL 14 -3.839 11.523 -16.483 134 HG23 VAL 14 HG23 VAL 14 -2.366 12.259 -15.850 135 H ALA 15 HN ALA 15 -5.468 15.832 -15.595 136 HA ALA 15 HA ALA 15 -5.907 16.062 -18.499 137 HB1 ALA 15 HB1 ALA 15 -6.569 18.437 -16.912 138 HB2 ALA 15 HB2 ALA 15 -7.602 17.043 -16.593 139 HB3 ALA 15 HB3 ALA 15 -7.453 17.675 -18.233 140 H GLY 16 HN GLY 16 -3.925 16.330 -19.289 141 HA2 GLY 16 HA2 GLY 16 -1.922 17.319 -19.763 142 HA3 GLY 16 HA1 GLY 16 -2.587 18.773 -19.040 143 H ASN 17 HN ASN 17 -1.047 19.540 -17.767 144 HA ASN 17 HA ASN 17 0.086 17.727 -15.749 145 HB2 ASN 17 HB2 ASN 17 2.212 18.939 -15.881 146 HB3 ASN 17 HB1 ASN 17 1.794 18.247 -17.443 147 HD21 ASN 17 HD21 ASN 17 3.569 20.465 -16.779 148 HD22 ASN 17 HD22 ASN 17 2.979 21.830 -17.657 149 H THR 18 HN THR 18 -2.225 19.257 -15.387 150 HA THR 18 HA THR 18 -1.670 21.715 -14.067 151 HB THR 18 HB THR 18 -3.962 21.509 -13.141 152 HG1 THR 18 HG1 THR 18 -4.518 19.228 -14.623 153 HG21 THR 18 HG21 THR 18 -3.788 20.816 -16.075 154 HG22 THR 18 HG22 THR 18 -3.626 22.433 -15.387 155 HG23 THR 18 HG23 THR 18 -5.160 21.573 -15.264 156 HA PRO 19 HA PRO 19 -0.102 20.522 -10.162 157 HB2 PRO 19 HB2 PRO 19 -2.297 22.150 -8.930 158 HB3 PRO 19 HB1 PRO 19 -0.557 22.193 -8.620 159 HG2 PRO 19 HG2 PRO 19 -1.652 24.084 -10.100 160 HG3 PRO 19 HG1 PRO 19 -0.107 23.363 -10.596 161 HD2 PRO 19 HD2 PRO 19 -2.863 22.852 -11.660 162 HD3 PRO 19 HD1 PRO 19 -1.326 23.018 -12.539 163 H ASN 20 HN ASN 20 -3.635 20.385 -10.407 164 HA ASN 20 HA ASN 20 -4.016 18.581 -8.239 165 HB2 ASN 20 HB2 ASN 20 -5.769 19.038 -10.685 166 HB3 ASN 20 HB1 ASN 20 -6.224 18.075 -9.286 167 HD21 ASN 20 HD21 ASN 20 -5.869 19.299 -7.142 168 HD22 ASN 20 HD22 ASN 20 -6.489 20.910 -7.111 169 H SER 21 HN SER 21 -3.634 18.096 -11.751 170 HA SER 21 HA SER 21 -3.820 15.249 -11.687 171 HB2 SER 21 HB2 SER 21 -2.606 17.142 -13.713 172 HB3 SER 21 HB1 SER 21 -2.820 15.412 -13.968 173 HG SER 21 HG SER 21 -4.788 17.419 -13.687 174 H VAL 22 HN VAL 22 -1.053 17.479 -11.656 175 HA VAL 22 HA VAL 22 0.873 15.423 -11.739 176 HB VAL 22 HB VAL 22 1.052 18.265 -10.711 177 HG11 VAL 22 HG11 VAL 22 3.545 17.921 -10.860 178 HG12 VAL 22 HG12 VAL 22 3.218 16.189 -10.924 179 HG13 VAL 22 HG13 VAL 22 2.736 17.126 -9.508 180 HG21 VAL 22 HG21 VAL 22 1.013 18.622 -12.927 181 HG22 VAL 22 HG22 VAL 22 1.411 16.946 -13.305 182 HG23 VAL 22 HG23 VAL 22 2.690 18.078 -12.872 183 H ARG 23 HN ARG 23 -0.608 17.158 -9.047 184 HA ARG 23 HA ARG 23 0.833 15.957 -6.951 185 HB2 ARG 23 HB2 ARG 23 -0.651 17.998 -6.858 186 HB3 ARG 23 HB1 ARG 23 -2.027 16.894 -6.893 187 HG2 ARG 23 HG2 ARG 23 -1.616 16.088 -4.785 188 HG3 ARG 23 HG1 ARG 23 0.066 16.623 -4.784 189 HD2 ARG 23 HD2 ARG 23 -2.323 18.467 -4.779 190 HD3 ARG 23 HD1 ARG 23 -1.436 17.984 -3.331 191 HE ARG 23 HE ARG 23 0.402 19.030 -5.144 192 HH11 ARG 23 HH11 ARG 23 -2.326 20.101 -3.264 193 HH12 ARG 23 HH12 ARG 23 -1.751 21.729 -3.111 194 HH21 ARG 23 HH21 ARG 23 1.174 21.167 -4.952 195 HH22 ARG 23 HH22 ARG 23 0.246 22.335 -4.076 196 H ALA 24 HN ALA 24 -2.269 15.140 -8.461 197 HA ALA 24 HA ALA 24 -2.860 12.967 -6.789 198 HB1 ALA 24 HB1 ALA 24 -4.762 12.909 -7.940 199 HB2 ALA 24 HB2 ALA 24 -3.917 12.615 -9.460 200 HB3 ALA 24 HB3 ALA 24 -4.134 14.266 -8.875 201 H LEU 25 HN LEU 25 -1.204 13.098 -9.934 202 HA LEU 25 HA LEU 25 -0.894 10.319 -10.255 203 HB2 LEU 25 HB2 LEU 25 0.667 12.644 -11.344 204 HB3 LEU 25 HB1 LEU 25 1.062 10.986 -11.750 205 HG LEU 25 HG LEU 25 -1.626 12.240 -12.257 206 HD11 LEU 25 HD11 LEU 25 0.895 12.421 -13.721 207 HD12 LEU 25 HD12 LEU 25 -0.577 13.380 -13.873 208 HD13 LEU 25 HD13 LEU 25 -0.449 11.826 -14.695 209 HD21 LEU 25 HD21 LEU 25 -2.279 10.223 -12.939 210 HD22 LEU 25 HD22 LEU 25 -0.816 9.585 -12.184 211 HD23 LEU 25 HD23 LEU 25 -0.816 10.001 -13.899 212 H LYS 26 HN LYS 26 1.230 12.698 -8.685 213 HA LYS 26 HA LYS 26 3.325 10.882 -8.153 214 HB2 LYS 26 HB2 LYS 26 2.483 13.418 -6.744 215 HB3 LYS 26 HB1 LYS 26 3.913 12.502 -6.290 216 HG2 LYS 26 HG2 LYS 26 4.832 12.833 -8.537 217 HG3 LYS 26 HG1 LYS 26 3.400 13.767 -8.976 218 HD2 LYS 26 HD2 LYS 26 3.929 15.399 -7.231 219 HD3 LYS 26 HD1 LYS 26 5.358 14.465 -6.786 220 HE2 LYS 26 HE2 LYS 26 4.861 15.727 -9.480 221 HE3 LYS 26 HE1 LYS 26 5.901 16.390 -8.221 222 HZ1 LYS 26 HZ1 LYS 26 6.922 13.954 -8.450 223 HZ2 LYS 26 HZ2 LYS 26 7.466 15.270 -9.363 224 HZ3 LYS 26 HZ3 LYS 26 6.370 14.170 -10.035 225 H THR 27 HN THR 27 0.401 11.732 -6.372 226 HA THR 27 HA THR 27 0.957 10.278 -4.012 227 HB THR 27 HB THR 27 -1.691 11.097 -5.226 228 HG1 THR 27 HG1 THR 27 -0.513 12.932 -4.814 229 HG21 THR 27 HG21 THR 27 -2.201 11.125 -2.634 230 HG22 THR 27 HG22 THR 27 -0.939 9.890 -2.612 231 HG23 THR 27 HG23 THR 27 -2.386 9.652 -3.589 232 H LEU 28 HN LEU 28 -0.863 9.457 -6.963 233 HA LEU 28 HA LEU 28 -1.674 6.893 -6.022 234 HB2 LEU 28 HB2 LEU 28 -2.054 8.512 -8.368 235 HB3 LEU 28 HB1 LEU 28 -1.682 6.866 -8.836 236 HG LEU 28 HG LEU 28 -4.040 7.027 -8.746 237 HD11 LEU 28 HD11 LEU 28 -3.642 5.821 -6.071 238 HD12 LEU 28 HD12 LEU 28 -2.751 5.125 -7.424 239 HD13 LEU 28 HD13 LEU 28 -4.511 5.210 -7.477 240 HD21 LEU 28 HD21 LEU 28 -4.901 8.706 -7.569 241 HD22 LEU 28 HD22 LEU 28 -3.501 8.784 -6.500 242 HD23 LEU 28 HD23 LEU 28 -4.801 7.639 -6.169 243 H ALA 29 HN ALA 29 0.824 7.883 -8.405 244 HA ALA 29 HA ALA 29 1.660 5.285 -9.041 245 HB1 ALA 29 HB1 ALA 29 2.542 6.603 -10.606 246 HB2 ALA 29 HB2 ALA 29 3.885 6.803 -9.479 247 HB3 ALA 29 HB3 ALA 29 2.593 8.004 -9.535 248 H ASN 30 HN ASN 30 2.883 7.545 -6.577 249 HA ASN 30 HA ASN 30 5.127 5.934 -5.845 250 HB2 ASN 30 HB2 ASN 30 4.806 8.392 -5.287 251 HB3 ASN 30 HB1 ASN 30 3.674 7.878 -4.042 252 HD21 ASN 30 HD21 ASN 30 4.778 8.446 -2.256 253 HD22 ASN 30 HD22 ASN 30 6.320 7.806 -1.819 254 H ILE 31 HN ILE 31 1.843 6.145 -4.561 255 HA ILE 31 HA ILE 31 2.278 4.339 -2.467 256 HB ILE 31 HB ILE 31 -0.228 5.264 -3.813 257 HG12 ILE 31 HG12 ILE 31 0.826 5.600 -1.007 258 HG13 ILE 31 HG11 ILE 31 1.130 6.737 -2.317 259 HG21 ILE 31 HG21 ILE 31 -0.180 2.803 -2.722 260 HG22 ILE 31 HG22 ILE 31 -1.586 3.868 -2.689 261 HG23 ILE 31 HG23 ILE 31 -0.516 3.776 -1.290 262 HD11 ILE 31 HD11 ILE 31 -1.124 7.358 -2.428 263 HD12 ILE 31 HD12 ILE 31 -0.717 7.316 -0.713 264 HD13 ILE 31 HD13 ILE 31 -1.629 5.991 -1.437 265 H LEU 32 HN LEU 32 1.051 3.855 -5.761 266 HA LEU 32 HA LEU 32 0.666 1.067 -5.454 267 HB2 LEU 32 HB2 LEU 32 0.896 2.824 -7.876 268 HB3 LEU 32 HB1 LEU 32 0.638 1.091 -7.993 269 HG LEU 32 HG LEU 32 -1.214 2.934 -6.466 270 HD11 LEU 32 HD11 LEU 32 -2.682 2.903 -8.356 271 HD12 LEU 32 HD12 LEU 32 -1.605 1.824 -9.244 272 HD13 LEU 32 HD13 LEU 32 -1.108 3.482 -8.900 273 HD21 LEU 32 HD21 LEU 32 -2.028 1.015 -5.717 274 HD22 LEU 32 HD22 LEU 32 -0.984 0.078 -6.784 275 HD23 LEU 32 HD23 LEU 32 -2.542 0.664 -7.366 276 H GLU 33 HN GLU 33 3.451 2.969 -6.509 277 HA GLU 33 HA GLU 33 4.969 0.739 -7.459 278 HB2 GLU 33 HB2 GLU 33 5.809 3.518 -6.631 279 HB3 GLU 33 HB1 GLU 33 6.922 2.322 -7.280 280 HG2 GLU 33 HG2 GLU 33 5.620 2.243 -9.351 281 HG3 GLU 33 HG1 GLU 33 4.512 3.445 -8.686 282 H LYS 34 HN LYS 34 4.453 2.047 -4.267 283 HA LYS 34 HA LYS 34 6.621 0.299 -3.297 284 HB2 LYS 34 HB2 LYS 34 6.991 2.670 -2.803 285 HB3 LYS 34 HB1 LYS 34 5.443 2.750 -1.975 286 HG2 LYS 34 HG2 LYS 34 7.191 2.610 -0.346 287 HG3 LYS 34 HG1 LYS 34 6.285 1.095 -0.333 288 HD2 LYS 34 HD2 LYS 34 8.012 0.016 -1.650 289 HD3 LYS 34 HD1 LYS 34 8.896 1.538 -1.784 290 HE2 LYS 34 HE2 LYS 34 9.203 1.569 0.643 291 HE3 LYS 34 HE1 LYS 34 8.317 0.051 0.776 292 HZ1 LYS 34 HZ1 LYS 34 10.025 -1.039 -0.517 293 HZ2 LYS 34 HZ2 LYS 34 10.722 -0.277 0.823 294 HZ3 LYS 34 HZ3 LYS 34 10.862 0.419 -0.711 295 H GLU 35 HN GLU 35 3.519 1.626 -2.153 296 HA GLU 35 HA GLU 35 3.134 -0.310 -0.140 297 HB2 GLU 35 HB2 GLU 35 1.266 1.631 -1.501 298 HB3 GLU 35 HB1 GLU 35 0.745 0.575 -0.188 299 HG2 GLU 35 HG2 GLU 35 2.924 2.650 -0.036 300 HG3 GLU 35 HG1 GLU 35 1.298 2.798 0.624 301 H PHE 36 HN PHE 36 1.901 -0.168 -3.489 302 HA PHE 36 HA PHE 36 0.887 -2.910 -3.059 303 HB2 PHE 36 HB2 PHE 36 -0.300 -0.750 -4.801 304 HB3 PHE 36 HB1 PHE 36 -0.843 -2.423 -4.783 305 HD1 PHE 36 HD1 PHE 36 -0.861 0.759 -3.045 306 HD2 PHE 36 HD2 PHE 36 -1.964 -3.343 -2.814 307 HE1 PHE 36 HE1 PHE 36 -2.361 1.272 -1.165 308 HE2 PHE 36 HE2 PHE 36 -3.467 -2.837 -0.936 309 HZ PHE 36 HZ PHE 36 -3.665 -0.529 -0.111 310 H LYS 37 HN LYS 37 3.536 -2.102 -4.109 311 HA LYS 37 HA LYS 37 3.622 -2.371 -6.896 312 HB2 LYS 37 HB2 LYS 37 5.499 -1.580 -5.435 313 HB3 LYS 37 HB1 LYS 37 5.763 -3.254 -4.962 314 HG2 LYS 37 HG2 LYS 37 6.294 -3.859 -7.236 315 HG3 LYS 37 HG1 LYS 37 5.913 -2.226 -7.787 316 HD2 LYS 37 HD2 LYS 37 7.732 -1.352 -6.371 317 HD3 LYS 37 HD1 LYS 37 8.131 -3.007 -5.897 318 HE2 LYS 37 HE2 LYS 37 9.611 -2.278 -7.659 319 HE3 LYS 37 HE1 LYS 37 8.554 -3.555 -8.253 320 HZ1 LYS 37 HZ1 LYS 37 8.967 -1.251 -9.528 321 HZ2 LYS 37 HZ2 LYS 37 7.582 -0.856 -8.644 322 HZ3 LYS 37 HZ3 LYS 37 7.561 -2.177 -9.699 323 H GLY 38 HN GLY 38 3.375 -4.039 -8.217 324 HA2 GLY 38 HA2 GLY 38 3.614 -6.256 -8.949 325 HA3 GLY 38 HA1 GLY 38 3.924 -6.746 -7.291 326 H VAL 39 HN VAL 39 1.310 -4.908 -6.881 327 HA VAL 39 HA VAL 39 -0.466 -7.208 -7.298 328 HB VAL 39 HB VAL 39 -0.866 -4.928 -5.346 329 HG11 VAL 39 HG11 VAL 39 -2.950 -5.997 -6.134 330 HG12 VAL 39 HG12 VAL 39 -2.656 -6.262 -4.414 331 HG13 VAL 39 HG13 VAL 39 -2.336 -7.554 -5.574 332 HG21 VAL 39 HG21 VAL 39 1.079 -6.535 -4.918 333 HG22 VAL 39 HG22 VAL 39 -0.160 -7.754 -4.617 334 HG23 VAL 39 HG23 VAL 39 -0.087 -6.302 -3.616 335 H TYR 40 HN TYR 40 -0.328 -3.657 -7.627 336 HA TYR 40 HA TYR 40 -2.663 -3.944 -9.371 337 HB2 TYR 40 HB2 TYR 40 -1.846 -1.699 -7.558 338 HB3 TYR 40 HB1 TYR 40 -2.800 -1.329 -8.983 339 HD1 TYR 40 HD1 TYR 40 -2.800 -3.246 -5.809 340 HD2 TYR 40 HD2 TYR 40 -5.106 -1.656 -9.008 341 HE1 TYR 40 HE1 TYR 40 -4.861 -3.701 -4.547 342 HE2 TYR 40 HE2 TYR 40 -7.169 -2.111 -7.760 343 HH TYR 40 HH TYR 40 -8.007 -3.349 -5.996 344 H ALA 41 HN ALA 41 -2.707 -3.021 -11.369 345 HA ALA 41 HA ALA 41 -0.138 -2.006 -12.378 346 HB1 ALA 41 HB1 ALA 41 -2.470 -2.891 -14.065 347 HB2 ALA 41 HB2 ALA 41 -1.290 -4.041 -13.431 348 HB3 ALA 41 HB3 ALA 41 -0.772 -2.755 -14.524 349 H LEU 42 HN LEU 42 -0.004 0.144 -12.804 350 HA LEU 42 HA LEU 42 -2.471 1.687 -12.647 351 HB2 LEU 42 HB2 LEU 42 -0.639 2.365 -11.191 352 HB3 LEU 42 HB1 LEU 42 0.413 2.575 -12.576 353 HG LEU 42 HG LEU 42 -1.018 4.428 -13.368 354 HD11 LEU 42 HD11 LEU 42 -3.155 4.076 -12.567 355 HD12 LEU 42 HD12 LEU 42 -2.573 5.359 -11.505 356 HD13 LEU 42 HD13 LEU 42 -2.593 3.688 -10.940 357 HD21 LEU 42 HD21 LEU 42 -0.105 6.022 -11.958 358 HD22 LEU 42 HD22 LEU 42 0.958 4.637 -11.717 359 HD23 LEU 42 HD23 LEU 42 -0.290 5.009 -10.527 360 H LYS 43 HN LYS 43 -3.409 2.630 -14.276 361 HA LYS 43 HA LYS 43 -1.953 3.009 -16.797 362 HB2 LYS 43 HB2 LYS 43 -4.339 1.432 -16.281 363 HB3 LYS 43 HB1 LYS 43 -4.660 2.713 -17.439 364 HG2 LYS 43 HG2 LYS 43 -4.008 1.101 -18.874 365 HG3 LYS 43 HG1 LYS 43 -2.426 1.795 -18.515 366 HD2 LYS 43 HD2 LYS 43 -1.868 0.041 -17.059 367 HD3 LYS 43 HD1 LYS 43 -3.545 -0.490 -16.922 368 HE2 LYS 43 HE2 LYS 43 -2.438 -2.054 -18.326 369 HE3 LYS 43 HE1 LYS 43 -3.462 -1.061 -19.363 370 HZ1 LYS 43 HZ1 LYS 43 -1.064 -1.534 -20.090 371 HZ2 LYS 43 HZ2 LYS 43 -0.627 -0.364 -18.952 372 HZ3 LYS 43 HZ3 LYS 43 -1.649 0.048 -20.235 373 H VAL 44 HN VAL 44 -1.693 5.087 -16.981 374 HA VAL 44 HA VAL 44 -3.735 6.954 -15.993 375 HB VAL 44 HB VAL 44 -0.899 7.383 -16.928 376 HG11 VAL 44 HG11 VAL 44 -2.377 9.331 -17.370 377 HG12 VAL 44 HG12 VAL 44 -1.108 9.673 -16.195 378 HG13 VAL 44 HG13 VAL 44 -2.760 9.384 -15.649 379 HG21 VAL 44 HG21 VAL 44 -0.225 7.429 -14.742 380 HG22 VAL 44 HG22 VAL 44 -1.512 6.226 -14.658 381 HG23 VAL 44 HG23 VAL 44 -1.822 7.885 -14.145 382 H ILE 45 HN ILE 45 -5.038 8.014 -17.215 383 HA ILE 45 HA ILE 45 -4.716 7.830 -20.134 384 HB ILE 45 HB ILE 45 -7.212 8.275 -18.497 385 HG12 ILE 45 HG12 ILE 45 -6.330 6.056 -18.051 386 HG13 ILE 45 HG11 ILE 45 -7.801 5.939 -19.008 387 HG21 ILE 45 HG21 ILE 45 -6.977 7.521 -21.410 388 HG22 ILE 45 HG22 ILE 45 -7.299 9.151 -20.817 389 HG23 ILE 45 HG23 ILE 45 -8.466 7.856 -20.518 390 HD11 ILE 45 HD11 ILE 45 -5.000 5.701 -20.074 391 HD12 ILE 45 HD12 ILE 45 -6.491 5.506 -20.997 392 HD13 ILE 45 HD13 ILE 45 -6.086 4.358 -19.719 393 H ASP 46 HN ASP 46 -4.003 9.761 -20.958 394 HA ASP 46 HA ASP 46 -4.500 12.236 -19.535 395 HB2 ASP 46 HB2 ASP 46 -2.322 11.725 -20.675 396 HB3 ASP 46 HB1 ASP 46 -3.162 11.839 -22.217 397 H VAL 47 HN VAL 47 -6.606 12.846 -19.704 398 HA VAL 47 HA VAL 47 -8.254 12.334 -21.926 399 HB VAL 47 HB VAL 47 -9.899 13.786 -20.886 400 HG11 VAL 47 HG11 VAL 47 -9.272 12.698 -18.393 401 HG12 VAL 47 HG12 VAL 47 -8.541 11.604 -19.567 402 HG13 VAL 47 HG13 VAL 47 -10.267 11.967 -19.652 403 HG21 VAL 47 HG21 VAL 47 -7.757 14.538 -18.899 404 HG22 VAL 47 HG22 VAL 47 -9.437 15.076 -18.900 405 HG23 VAL 47 HG23 VAL 47 -8.347 15.587 -20.188 406 H LEU 48 HN LEU 48 -6.274 15.178 -21.191 407 HA LEU 48 HA LEU 48 -7.446 16.802 -23.215 408 HB2 LEU 48 HB2 LEU 48 -4.845 17.047 -21.723 409 HB3 LEU 48 HB1 LEU 48 -5.360 18.204 -22.935 410 HG LEU 48 HG LEU 48 -6.891 17.568 -20.411 411 HD11 LEU 48 HD11 LEU 48 -6.167 19.816 -19.692 412 HD12 LEU 48 HD12 LEU 48 -5.110 19.899 -21.100 413 HD13 LEU 48 HD13 LEU 48 -4.827 18.682 -19.856 414 HD21 LEU 48 HD21 LEU 48 -8.542 18.386 -21.739 415 HD22 LEU 48 HD22 LEU 48 -7.423 19.257 -22.786 416 HD23 LEU 48 HD23 LEU 48 -7.852 19.920 -21.210 417 H LYS 49 HN LYS 49 -4.672 14.633 -23.139 418 HA LYS 49 HA LYS 49 -3.652 15.368 -25.693 419 HB2 LYS 49 HB2 LYS 49 -2.294 14.264 -23.965 420 HB3 LYS 49 HB1 LYS 49 -3.270 12.811 -24.146 421 HG2 LYS 49 HG2 LYS 49 -2.529 12.565 -26.436 422 HG3 LYS 49 HG1 LYS 49 -1.597 14.060 -26.310 423 HD2 LYS 49 HD2 LYS 49 -0.211 13.075 -24.585 424 HD3 LYS 49 HD1 LYS 49 -1.169 11.593 -24.636 425 HE2 LYS 49 HE2 LYS 49 0.849 11.276 -25.910 426 HE3 LYS 49 HE1 LYS 49 -0.539 11.310 -26.995 427 HZ1 LYS 49 HZ1 LYS 49 0.093 13.275 -27.905 428 HZ2 LYS 49 HZ2 LYS 49 1.625 12.686 -27.494 429 HZ3 LYS 49 HZ3 LYS 49 0.865 13.826 -26.503 430 H ASN 50 HN ASN 50 -5.825 12.824 -24.547 431 HA ASN 50 HA ASN 50 -6.694 12.452 -27.333 432 HB2 ASN 50 HB2 ASN 50 -5.180 10.557 -26.424 433 HB3 ASN 50 HB1 ASN 50 -6.563 10.147 -25.406 434 HD21 ASN 50 HD21 ASN 50 -5.114 9.011 -27.916 435 HD22 ASN 50 HD22 ASN 50 -6.434 8.528 -28.920 436 HA PRO 51 HA PRO 51 -10.201 13.468 -24.541 437 HB2 PRO 51 HB2 PRO 51 -11.524 14.902 -26.491 438 HB3 PRO 51 HB1 PRO 51 -10.402 15.598 -25.320 439 HG2 PRO 51 HG2 PRO 51 -9.926 14.813 -28.161 440 HG3 PRO 51 HG1 PRO 51 -9.313 16.211 -27.261 441 HD2 PRO 51 HD2 PRO 51 -7.801 14.049 -27.774 442 HD3 PRO 51 HD1 PRO 51 -7.622 15.006 -26.288 443 H GLN 52 HN GLN 52 -9.905 11.970 -27.651 444 HA GLN 52 HA GLN 52 -12.584 11.134 -28.023 445 HB2 GLN 52 HB2 GLN 52 -9.959 9.928 -28.926 446 HB3 GLN 52 HB1 GLN 52 -11.528 9.297 -29.409 447 HG2 GLN 52 HG2 GLN 52 -12.066 11.320 -30.562 448 HG3 GLN 52 HG1 GLN 52 -10.629 12.121 -29.928 449 HE21 GLN 52 HE21 GLN 52 -11.463 11.694 -32.691 450 HE22 GLN 52 HE22 GLN 52 -10.176 10.829 -33.450 451 H LEU 53 HN LEU 53 -9.836 9.752 -26.312 452 HA LEU 53 HA LEU 53 -11.216 7.359 -25.605 453 HB2 LEU 53 HB2 LEU 53 -8.703 8.615 -24.506 454 HB3 LEU 53 HB1 LEU 53 -9.325 7.066 -23.961 455 HG LEU 53 HG LEU 53 -8.550 7.678 -26.809 456 HD11 LEU 53 HD11 LEU 53 -6.995 5.868 -25.014 457 HD12 LEU 53 HD12 LEU 53 -6.720 7.609 -24.942 458 HD13 LEU 53 HD13 LEU 53 -6.476 6.740 -26.457 459 HD21 LEU 53 HD21 LEU 53 -8.473 5.002 -26.579 460 HD22 LEU 53 HD22 LEU 53 -9.888 5.901 -27.128 461 HD23 LEU 53 HD23 LEU 53 -9.774 5.371 -25.449 462 H ALA 54 HN ALA 54 -10.731 10.516 -24.158 463 HA ALA 54 HA ALA 54 -11.732 9.957 -21.574 464 HB1 ALA 54 HB1 ALA 54 -10.444 11.990 -22.184 465 HB2 ALA 54 HB2 ALA 54 -11.948 12.341 -21.332 466 HB3 ALA 54 HB3 ALA 54 -11.850 12.568 -23.079 467 H GLU 55 HN GLU 55 -13.199 11.049 -24.588 468 HA GLU 55 HA GLU 55 -15.843 11.350 -23.592 469 HB2 GLU 55 HB2 GLU 55 -15.059 12.396 -25.699 470 HB3 GLU 55 HB1 GLU 55 -14.936 10.800 -26.428 471 HG2 GLU 55 HG2 GLU 55 -17.338 10.481 -26.173 472 HG3 GLU 55 HG1 GLU 55 -17.475 12.059 -25.405 473 H GLU 56 HN GLU 56 -14.067 8.667 -25.035 474 HA GLU 56 HA GLU 56 -16.227 6.908 -25.382 475 HB2 GLU 56 HB2 GLU 56 -13.309 6.338 -24.799 476 HB3 GLU 56 HB1 GLU 56 -14.477 5.102 -25.246 477 HG2 GLU 56 HG2 GLU 56 -14.853 6.328 -27.387 478 HG3 GLU 56 HG1 GLU 56 -13.536 7.423 -26.934 479 H ASP 57 HN ASP 57 -14.112 7.491 -22.582 480 HA ASP 57 HA ASP 57 -15.797 5.687 -21.018 481 HB2 ASP 57 HB2 ASP 57 -13.132 7.015 -20.405 482 HB3 ASP 57 HB1 ASP 57 -14.063 6.163 -19.175 483 H LYS 58 HN LYS 58 -16.251 8.597 -21.980 484 HA LYS 58 HA LYS 58 -17.347 10.452 -21.291 485 HB2 LYS 58 HB2 LYS 58 -18.585 8.408 -19.456 486 HB3 LYS 58 HB1 LYS 58 -19.213 10.036 -19.681 487 HG2 LYS 58 HG2 LYS 58 -19.538 9.580 -22.067 488 HG3 LYS 58 HG1 LYS 58 -18.923 7.942 -21.830 489 HD2 LYS 58 HD2 LYS 58 -20.763 7.458 -20.300 490 HD3 LYS 58 HD1 LYS 58 -21.369 9.105 -20.495 491 HE2 LYS 58 HE2 LYS 58 -22.642 7.584 -21.885 492 HE3 LYS 58 HE1 LYS 58 -21.698 8.680 -22.895 493 HZ1 LYS 58 HZ1 LYS 58 -20.823 5.933 -22.196 494 HZ2 LYS 58 HZ2 LYS 58 -20.125 6.973 -23.332 495 HZ3 LYS 58 HZ3 LYS 58 -21.660 6.317 -23.615 496 H ILE 59 HN ILE 59 -14.916 10.656 -20.309 497 HA ILE 59 HA ILE 59 -15.021 11.138 -17.440 498 HB ILE 59 HB ILE 59 -12.767 11.610 -19.401 499 HG12 ILE 59 HG12 ILE 59 -13.393 9.250 -19.306 500 HG13 ILE 59 HG11 ILE 59 -11.834 9.505 -18.528 501 HG21 ILE 59 HG21 ILE 59 -12.355 12.943 -17.495 502 HG22 ILE 59 HG22 ILE 59 -11.377 11.492 -17.286 503 HG23 ILE 59 HG23 ILE 59 -12.888 11.672 -16.395 504 HD11 ILE 59 HD11 ILE 59 -14.418 8.661 -17.379 505 HD12 ILE 59 HD12 ILE 59 -13.401 9.708 -16.386 506 HD13 ILE 59 HD13 ILE 59 -12.774 8.168 -16.974 507 H LEU 60 HN LEU 60 -16.062 12.941 -16.854 508 HA LEU 60 HA LEU 60 -15.643 15.391 -18.423 509 HB2 LEU 60 HB2 LEU 60 -17.805 14.735 -16.421 510 HB3 LEU 60 HB1 LEU 60 -17.672 16.237 -17.313 511 HG LEU 60 HG LEU 60 -18.148 13.520 -18.546 512 HD11 LEU 60 HD11 LEU 60 -20.021 15.843 -18.111 513 HD12 LEU 60 HD12 LEU 60 -20.077 14.288 -17.280 514 HD13 LEU 60 HD13 LEU 60 -20.394 14.374 -19.013 515 HD21 LEU 60 HD21 LEU 60 -17.045 14.753 -20.186 516 HD22 LEU 60 HD22 LEU 60 -17.804 16.268 -19.695 517 HD23 LEU 60 HD23 LEU 60 -18.750 15.038 -20.534 518 H ALA 61 HN ALA 61 -14.338 13.961 -15.807 519 HA ALA 61 HA ALA 61 -13.599 16.535 -14.640 520 HB1 ALA 61 HB1 ALA 61 -14.238 16.068 -12.476 521 HB2 ALA 61 HB2 ALA 61 -14.274 14.326 -12.747 522 HB3 ALA 61 HB3 ALA 61 -15.561 15.347 -13.390 523 H THR 62 HN THR 62 -11.608 16.534 -13.565 524 HA THR 62 HA THR 62 -10.034 14.098 -13.474 525 HB THR 62 HB THR 62 -8.094 15.313 -14.565 526 HG1 THR 62 HG1 THR 62 -9.404 17.388 -14.436 527 HG21 THR 62 HG21 THR 62 -9.406 13.547 -15.726 528 HG22 THR 62 HG22 THR 62 -8.721 14.751 -16.820 529 HG23 THR 62 HG23 THR 62 -10.435 14.811 -16.401 530 HA PRO 63 HA PRO 63 -8.115 13.519 -12.960 531 HB2 PRO 63 HB2 PRO 63 -6.958 12.438 -10.799 532 HB3 PRO 63 HB1 PRO 63 -6.147 13.663 -11.780 533 HG2 PRO 63 HG2 PRO 63 -7.539 13.952 -9.157 534 HG3 PRO 63 HG1 PRO 63 -6.039 14.708 -9.728 535 HD2 PRO 63 HD2 PRO 63 -8.504 15.951 -9.701 536 HD3 PRO 63 HD1 PRO 63 -7.156 16.412 -10.759 537 H THR 64 HN THR 64 -8.943 11.454 -12.826 538 HA THR 64 HA THR 64 -10.952 10.937 -10.741 539 HB THR 64 HB THR 64 -11.312 10.273 -13.674 540 HG1 THR 64 HG1 THR 64 -12.064 12.284 -13.604 541 HG21 THR 64 HG21 THR 64 -13.311 9.870 -11.462 542 HG22 THR 64 HG22 THR 64 -12.210 8.597 -11.985 543 HG23 THR 64 HG23 THR 64 -13.382 9.270 -13.118 544 H LEU 65 HN LEU 65 -10.773 8.996 -9.807 545 HA LEU 65 HA LEU 65 -8.732 7.131 -10.855 546 HB2 LEU 65 HB2 LEU 65 -8.377 8.101 -8.603 547 HB3 LEU 65 HB1 LEU 65 -9.896 7.400 -8.083 548 HG LEU 65 HG LEU 65 -8.967 5.140 -8.527 549 HD11 LEU 65 HD11 LEU 65 -6.459 6.706 -9.104 550 HD12 LEU 65 HD12 LEU 65 -7.336 5.648 -10.209 551 HD13 LEU 65 HD13 LEU 65 -6.504 4.968 -8.812 552 HD21 LEU 65 HD21 LEU 65 -7.008 6.458 -6.720 553 HD22 LEU 65 HD22 LEU 65 -7.967 4.998 -6.478 554 HD23 LEU 65 HD23 LEU 65 -8.722 6.584 -6.325 555 H ALA 66 HN ALA 66 -9.495 5.317 -11.804 556 HA ALA 66 HA ALA 66 -11.919 4.092 -10.679 557 HB1 ALA 66 HB1 ALA 66 -11.626 4.262 -13.660 558 HB2 ALA 66 HB2 ALA 66 -12.416 5.557 -12.756 559 HB3 ALA 66 HB3 ALA 66 -13.064 3.916 -12.700 560 H LYS 67 HN LYS 67 -11.901 1.969 -10.584 561 HA LYS 67 HA LYS 67 -9.552 0.606 -11.672 562 HB2 LYS 67 HB2 LYS 67 -9.758 0.271 -9.302 563 HB3 LYS 67 HB1 LYS 67 -11.470 -0.087 -9.443 564 HG2 LYS 67 HG2 LYS 67 -11.044 -2.214 -10.397 565 HG3 LYS 67 HG1 LYS 67 -9.339 -1.836 -10.642 566 HD2 LYS 67 HD2 LYS 67 -9.110 -3.047 -8.739 567 HD3 LYS 67 HD1 LYS 67 -9.488 -1.500 -7.983 568 HE2 LYS 67 HE2 LYS 67 -10.778 -3.383 -7.038 569 HE3 LYS 67 HE1 LYS 67 -11.808 -2.139 -7.736 570 HZ1 LYS 67 HZ1 LYS 67 -11.160 -4.092 -9.681 571 HZ2 LYS 67 HZ2 LYS 67 -12.681 -3.621 -9.114 572 HZ3 LYS 67 HZ3 LYS 67 -11.820 -4.835 -8.313 573 H VAL 68 HN VAL 68 -10.021 -0.096 -13.672 574 HA VAL 68 HA VAL 68 -12.706 -0.798 -14.415 575 HB VAL 68 HB VAL 68 -11.738 -1.265 -16.640 576 HG11 VAL 68 HG11 VAL 68 -11.235 1.023 -17.187 577 HG12 VAL 68 HG12 VAL 68 -10.846 1.377 -15.503 578 HG13 VAL 68 HG13 VAL 68 -12.504 0.990 -15.963 579 HG21 VAL 68 HG21 VAL 68 -9.402 -1.745 -15.367 580 HG22 VAL 68 HG22 VAL 68 -9.131 -0.098 -15.936 581 HG23 VAL 68 HG23 VAL 68 -9.530 -1.374 -17.086 582 H LEU 69 HN LEU 69 -9.830 -2.512 -13.462 583 HA LEU 69 HA LEU 69 -11.344 -5.021 -13.771 584 HB2 LEU 69 HB2 LEU 69 -8.448 -4.638 -14.539 585 HB3 LEU 69 HB1 LEU 69 -9.265 -6.185 -14.466 586 HG LEU 69 HG LEU 69 -10.061 -3.938 -16.323 587 HD11 LEU 69 HD11 LEU 69 -8.026 -6.051 -16.542 588 HD12 LEU 69 HD12 LEU 69 -8.161 -4.508 -17.385 589 HD13 LEU 69 HD13 LEU 69 -9.110 -5.893 -17.924 590 HD21 LEU 69 HD21 LEU 69 -11.242 -5.843 -17.482 591 HD22 LEU 69 HD22 LEU 69 -11.927 -5.344 -15.934 592 HD23 LEU 69 HD23 LEU 69 -10.938 -6.804 -16.033 593 HA PRO 70 HA PRO 70 -11.298 -7.006 -13.244 594 HB2 PRO 70 HB2 PRO 70 -12.383 -8.554 -11.349 595 HB3 PRO 70 HB1 PRO 70 -10.699 -8.763 -11.851 596 HG2 PRO 70 HG2 PRO 70 -11.798 -7.331 -9.455 597 HG3 PRO 70 HG1 PRO 70 -10.429 -8.456 -9.553 598 HD2 PRO 70 HD2 PRO 70 -10.147 -5.736 -9.524 599 HD3 PRO 70 HD1 PRO 70 -8.990 -6.831 -10.305 600 HA PRO 71 HA PRO 71 -15.202 -4.864 -13.004 601 HB2 PRO 71 HB2 PRO 71 -16.422 -7.430 -13.872 602 HB3 PRO 71 HB1 PRO 71 -16.518 -5.831 -14.621 603 HG2 PRO 71 HG2 PRO 71 -15.012 -7.723 -15.713 604 HG3 PRO 71 HG1 PRO 71 -14.439 -6.044 -15.648 605 HD2 PRO 71 HD2 PRO 71 -13.699 -8.363 -13.895 606 HD3 PRO 71 HD1 PRO 71 -12.658 -7.119 -14.616 607 HA PRO 72 HA PRO 72 -17.605 -4.452 -12.826 608 HB2 PRO 72 HB2 PRO 72 -18.429 -3.148 -10.326 609 HB3 PRO 72 HB1 PRO 72 -19.413 -3.674 -11.693 610 HG2 PRO 72 HG2 PRO 72 -19.506 -4.952 -9.341 611 HG3 PRO 72 HG1 PRO 72 -19.631 -5.830 -10.877 612 HD2 PRO 72 HD2 PRO 72 -17.241 -5.487 -9.088 613 HD3 PRO 72 HD1 PRO 72 -17.850 -6.962 -9.872 614 H VAL 73 HN VAL 73 -17.217 -2.201 -13.154 615 HA VAL 73 HA VAL 73 -14.577 -1.379 -12.418 616 HB VAL 73 HB VAL 73 -16.756 0.136 -13.877 617 HG11 VAL 73 HG11 VAL 73 -14.638 1.360 -14.781 618 HG12 VAL 73 HG12 VAL 73 -13.905 0.794 -13.280 619 HG13 VAL 73 HG13 VAL 73 -15.333 1.829 -13.228 620 HG21 VAL 73 HG21 VAL 73 -14.825 -0.498 -15.712 621 HG22 VAL 73 HG22 VAL 73 -16.341 -1.368 -15.482 622 HG23 VAL 73 HG23 VAL 73 -14.869 -1.939 -14.695 623 H ARG 74 HN ARG 74 -13.967 -0.166 -10.747 624 HA ARG 74 HA ARG 74 -16.048 1.130 -9.115 625 HB2 ARG 74 HB2 ARG 74 -14.873 -0.503 -7.838 626 HB3 ARG 74 HB1 ARG 74 -13.318 0.054 -8.434 627 HG2 ARG 74 HG2 ARG 74 -13.605 0.747 -6.151 628 HG3 ARG 74 HG1 ARG 74 -13.623 2.164 -7.202 629 HD2 ARG 74 HD2 ARG 74 -15.357 2.385 -5.542 630 HD3 ARG 74 HD1 ARG 74 -16.098 2.139 -7.123 631 HE ARG 74 HE ARG 74 -15.790 -0.336 -5.792 632 HH11 ARG 74 HH11 ARG 74 -17.702 2.574 -5.742 633 HH12 ARG 74 HH12 ARG 74 -19.098 1.805 -5.065 634 HH21 ARG 74 HH21 ARG 74 -17.617 -1.364 -4.897 635 HH22 ARG 74 HH22 ARG 74 -19.048 -0.442 -4.581 636 H ARG 75 HN ARG 75 -16.217 3.243 -9.264 637 HA ARG 75 HA ARG 75 -13.855 4.763 -10.109 638 HB2 ARG 75 HB2 ARG 75 -16.785 5.474 -10.202 639 HB3 ARG 75 HB1 ARG 75 -15.485 6.592 -10.586 640 HG2 ARG 75 HG2 ARG 75 -14.748 5.067 -12.379 641 HG3 ARG 75 HG1 ARG 75 -16.143 4.042 -12.038 642 HD2 ARG 75 HD2 ARG 75 -16.298 6.949 -12.806 643 HD3 ARG 75 HD1 ARG 75 -16.476 5.609 -13.938 644 HE ARG 75 HE ARG 75 -18.305 5.176 -11.906 645 HH11 ARG 75 HH11 ARG 75 -17.690 7.596 -14.335 646 HH12 ARG 75 HH12 ARG 75 -19.352 8.059 -14.484 647 HH21 ARG 75 HH21 ARG 75 -20.499 5.774 -12.090 648 HH22 ARG 75 HH22 ARG 75 -20.954 7.021 -13.203 649 H ILE 76 HN ILE 76 -12.844 5.959 -8.692 650 HA ILE 76 HA ILE 76 -14.161 6.516 -6.114 651 HB ILE 76 HB ILE 76 -11.209 6.371 -6.724 652 HG12 ILE 76 HG12 ILE 76 -13.009 4.444 -5.233 653 HG13 ILE 76 HG11 ILE 76 -12.367 4.191 -6.854 654 HG21 ILE 76 HG21 ILE 76 -12.749 7.279 -4.388 655 HG22 ILE 76 HG22 ILE 76 -11.091 7.644 -4.866 656 HG23 ILE 76 HG23 ILE 76 -11.454 6.136 -4.026 657 HD11 ILE 76 HD11 ILE 76 -10.551 4.650 -4.541 658 HD12 ILE 76 HD12 ILE 76 -10.218 3.874 -6.087 659 HD13 ILE 76 HD13 ILE 76 -11.214 3.053 -4.883 660 H ILE 77 HN ILE 77 -14.790 8.572 -5.857 661 HA ILE 77 HA ILE 77 -13.211 10.701 -7.137 662 HB ILE 77 HB ILE 77 -16.190 10.753 -6.669 663 HG12 ILE 77 HG12 ILE 77 -15.647 10.953 -9.412 664 HG13 ILE 77 HG11 ILE 77 -14.612 9.649 -8.834 665 HG21 ILE 77 HG21 ILE 77 -16.242 12.846 -7.704 666 HG22 ILE 77 HG22 ILE 77 -14.621 12.656 -8.375 667 HG23 ILE 77 HG23 ILE 77 -14.834 12.931 -6.645 668 HD11 ILE 77 HD11 ILE 77 -16.814 8.894 -9.657 669 HD12 ILE 77 HD12 ILE 77 -17.576 9.803 -8.352 670 HD13 ILE 77 HD13 ILE 77 -16.501 8.457 -7.978 671 H GLY 78 HN GLY 78 -12.410 12.201 -5.790 672 HA2 GLY 78 HA2 GLY 78 -13.634 13.401 -3.639 673 HA3 GLY 78 HA1 GLY 78 -12.838 11.982 -2.973 674 H ASP 79 HN ASP 79 -11.534 13.489 -1.736 675 HA ASP 79 HA ASP 79 -9.703 15.211 -3.163 676 HB2 ASP 79 HB2 ASP 79 -10.600 15.795 -0.904 677 HB3 ASP 79 HB1 ASP 79 -9.704 14.437 -0.233 678 H LEU 80 HN LEU 80 -8.622 13.741 -4.491 679 HA LEU 80 HA LEU 80 -7.246 11.467 -3.430 680 HB2 LEU 80 HB2 LEU 80 -7.615 12.720 -6.079 681 HB3 LEU 80 HB1 LEU 80 -6.128 11.816 -5.867 682 HG LEU 80 HG LEU 80 -7.715 9.947 -4.979 683 HD11 LEU 80 HD11 LEU 80 -9.694 11.546 -5.106 684 HD12 LEU 80 HD12 LEU 80 -9.913 9.934 -5.788 685 HD13 LEU 80 HD13 LEU 80 -9.620 11.310 -6.853 686 HD21 LEU 80 HD21 LEU 80 -8.067 10.160 -7.875 687 HD22 LEU 80 HD22 LEU 80 -7.259 8.920 -6.917 688 HD23 LEU 80 HD23 LEU 80 -6.410 10.410 -7.327 689 H SER 81 HN SER 81 -6.492 14.735 -3.460 690 HA SER 81 HA SER 81 -3.692 14.608 -3.908 691 HB2 SER 81 HB2 SER 81 -3.617 16.856 -2.941 692 HB3 SER 81 HB1 SER 81 -4.961 16.718 -4.072 693 HG SER 81 HG SER 81 -6.206 17.277 -2.479 694 H ASN 82 HN ASN 82 -5.653 13.717 -1.266 695 HA ASN 82 HA ASN 82 -3.490 13.820 0.670 696 HB2 ASN 82 HB2 ASN 82 -5.847 14.366 1.310 697 HB3 ASN 82 HB1 ASN 82 -6.269 12.694 0.982 698 HD21 ASN 82 HD21 ASN 82 -6.699 13.899 3.435 699 HD22 ASN 82 HD22 ASN 82 -5.677 13.159 4.615 700 H ARG 83 HN ARG 83 -2.074 12.236 0.837 701 HA ARG 83 HA ARG 83 -2.175 9.918 -0.689 702 HB2 ARG 83 HB2 ARG 83 -0.504 10.619 1.728 703 HB3 ARG 83 HB1 ARG 83 -0.292 9.108 0.857 704 HG2 ARG 83 HG2 ARG 83 1.137 10.169 -0.463 705 HG3 ARG 83 HG1 ARG 83 -0.232 11.073 -1.113 706 HD2 ARG 83 HD2 ARG 83 0.998 11.999 1.433 707 HD3 ARG 83 HD1 ARG 83 1.863 12.298 -0.074 708 HE ARG 83 HE ARG 83 -0.667 13.158 -0.585 709 HH11 ARG 83 HH11 ARG 83 1.698 13.869 1.873 710 HH12 ARG 83 HH12 ARG 83 1.159 15.499 2.103 711 HH21 ARG 83 HH21 ARG 83 -1.386 15.290 -0.300 712 HH22 ARG 83 HH22 ARG 83 -0.601 16.312 0.863 713 H GLU 84 HN GLU 84 -3.242 10.453 2.628 714 HA GLU 84 HA GLU 84 -3.565 7.756 3.382 715 HB2 GLU 84 HB2 GLU 84 -4.958 10.272 4.253 716 HB3 GLU 84 HB1 GLU 84 -5.346 8.698 4.934 717 HG2 GLU 84 HG2 GLU 84 -3.153 8.435 5.793 718 HG3 GLU 84 HG1 GLU 84 -2.574 9.857 4.921 719 H LYS 85 HN LYS 85 -5.893 9.949 1.740 720 HA LYS 85 HA LYS 85 -7.949 7.997 1.742 721 HB2 LYS 85 HB2 LYS 85 -7.507 10.431 0.004 722 HB3 LYS 85 HB1 LYS 85 -8.899 9.374 -0.200 723 HG2 LYS 85 HG2 LYS 85 -9.616 9.873 2.078 724 HG3 LYS 85 HG1 LYS 85 -8.220 10.930 2.290 725 HD2 LYS 85 HD2 LYS 85 -9.011 12.346 0.453 726 HD3 LYS 85 HD1 LYS 85 -10.384 11.270 0.213 727 HE2 LYS 85 HE2 LYS 85 -11.077 13.215 1.478 728 HE3 LYS 85 HE1 LYS 85 -11.169 11.773 2.488 729 HZ1 LYS 85 HZ1 LYS 85 -10.194 13.652 3.666 730 HZ2 LYS 85 HZ2 LYS 85 -8.955 13.752 2.521 731 HZ3 LYS 85 HZ3 LYS 85 -9.080 12.387 3.513 732 H VAL 86 HN VAL 86 -5.440 8.763 -0.617 733 HA VAL 86 HA VAL 86 -6.310 6.948 -2.588 734 HB VAL 86 HB VAL 86 -3.543 8.025 -1.992 735 HG11 VAL 86 HG11 VAL 86 -4.498 6.128 -4.092 736 HG12 VAL 86 HG12 VAL 86 -2.982 6.140 -3.191 737 HG13 VAL 86 HG13 VAL 86 -3.246 7.305 -4.488 738 HG21 VAL 86 HG21 VAL 86 -4.544 9.856 -2.824 739 HG22 VAL 86 HG22 VAL 86 -5.891 8.938 -3.496 740 HG23 VAL 86 HG23 VAL 86 -4.369 9.042 -4.379 741 H LEU 87 HN LEU 87 -4.005 6.555 0.099 742 HA LEU 87 HA LEU 87 -3.362 3.852 -0.460 743 HB2 LEU 87 HB2 LEU 87 -1.891 5.202 0.886 744 HB3 LEU 87 HB1 LEU 87 -3.167 5.533 2.039 745 HG LEU 87 HG LEU 87 -3.162 3.153 2.688 746 HD11 LEU 87 HD11 LEU 87 -0.810 2.090 1.940 747 HD12 LEU 87 HD12 LEU 87 -1.217 2.997 0.485 748 HD13 LEU 87 HD13 LEU 87 -2.334 1.781 1.107 749 HD21 LEU 87 HD21 LEU 87 -1.278 3.311 4.091 750 HD22 LEU 87 HD22 LEU 87 -1.791 4.976 3.797 751 HD23 LEU 87 HD23 LEU 87 -0.402 4.312 2.932 752 H ILE 88 HN ILE 88 -5.695 5.300 1.799 753 HA ILE 88 HA ILE 88 -6.561 2.869 2.918 754 HB ILE 88 HB ILE 88 -7.898 5.553 2.704 755 HG12 ILE 88 HG12 ILE 88 -6.826 4.077 5.112 756 HG13 ILE 88 HG11 ILE 88 -5.834 5.152 4.133 757 HG21 ILE 88 HG21 ILE 88 -9.568 4.755 4.312 758 HG22 ILE 88 HG22 ILE 88 -8.901 3.126 4.195 759 HG23 ILE 88 HG23 ILE 88 -9.663 3.870 2.788 760 HD11 ILE 88 HD11 ILE 88 -7.742 5.765 6.208 761 HD12 ILE 88 HD12 ILE 88 -8.062 6.665 4.727 762 HD13 ILE 88 HD13 ILE 88 -6.475 6.768 5.497 763 H ALA 89 HN ALA 89 -7.870 4.744 0.179 764 HA ALA 89 HA ALA 89 -10.033 3.008 -0.349 765 HB1 ALA 89 HB1 ALA 89 -8.838 4.386 -2.664 766 HB2 ALA 89 HB2 ALA 89 -9.300 5.419 -1.311 767 HB3 ALA 89 HB3 ALA 89 -10.502 4.381 -2.079 768 H LEU 90 HN LEU 90 -6.695 3.019 -1.552 769 HA LEU 90 HA LEU 90 -7.085 0.898 -3.394 770 HB2 LEU 90 HB2 LEU 90 -4.586 1.958 -2.083 771 HB3 LEU 90 HB1 LEU 90 -4.566 0.658 -3.260 772 HG LEU 90 HG LEU 90 -5.625 3.430 -3.801 773 HD11 LEU 90 HD11 LEU 90 -3.490 4.031 -3.938 774 HD12 LEU 90 HD12 LEU 90 -3.385 2.995 -5.361 775 HD13 LEU 90 HD13 LEU 90 -2.930 2.366 -3.777 776 HD21 LEU 90 HD21 LEU 90 -5.458 0.912 -5.368 777 HD22 LEU 90 HD22 LEU 90 -5.152 2.433 -6.209 778 HD23 LEU 90 HD23 LEU 90 -6.688 2.175 -5.382 779 H ARG 91 HN ARG 91 -6.197 0.964 0.044 780 HA ARG 91 HA ARG 91 -5.500 -1.785 0.254 781 HB2 ARG 91 HB2 ARG 91 -6.494 0.200 2.297 782 HB3 ARG 91 HB1 ARG 91 -6.042 -1.449 2.701 783 HG2 ARG 91 HG2 ARG 91 -3.776 -1.042 1.943 784 HG3 ARG 91 HG1 ARG 91 -4.218 0.598 1.459 785 HD2 ARG 91 HD2 ARG 91 -3.099 0.650 3.605 786 HD3 ARG 91 HD1 ARG 91 -4.790 1.110 3.799 787 HE ARG 91 HE ARG 91 -4.447 -1.669 4.243 788 HH11 ARG 91 HH11 ARG 91 -3.902 1.439 5.716 789 HH12 ARG 91 HH12 ARG 91 -4.001 0.836 7.336 790 HH21 ARG 91 HH21 ARG 91 -4.581 -2.478 6.369 791 HH22 ARG 91 HH22 ARG 91 -4.388 -1.399 7.708 792 H LEU 92 HN LEU 92 -8.561 -0.041 0.725 793 HA LEU 92 HA LEU 92 -10.056 -2.287 1.530 794 HB2 LEU 92 HB2 LEU 92 -10.889 0.291 0.197 795 HB3 LEU 92 HB1 LEU 92 -12.038 -0.913 0.749 796 HG LEU 92 HG LEU 92 -10.059 0.474 2.556 797 HD11 LEU 92 HD11 LEU 92 -12.935 1.108 1.932 798 HD12 LEU 92 HD12 LEU 92 -11.528 2.159 1.760 799 HD13 LEU 92 HD13 LEU 92 -12.094 1.701 3.365 800 HD21 LEU 92 HD21 LEU 92 -11.842 -0.343 4.249 801 HD22 LEU 92 HD22 LEU 92 -10.653 -1.491 3.631 802 HD23 LEU 92 HD23 LEU 92 -12.290 -1.475 2.975 803 H LEU 93 HN LEU 93 -9.373 -0.947 -1.663 804 HA LEU 93 HA LEU 93 -11.097 -2.690 -3.098 805 HB2 LEU 93 HB2 LEU 93 -8.637 -1.164 -3.937 806 HB3 LEU 93 HB1 LEU 93 -9.608 -2.104 -5.051 807 HG LEU 93 HG LEU 93 -10.661 0.220 -3.439 808 HD11 LEU 93 HD11 LEU 93 -9.415 1.432 -4.863 809 HD12 LEU 93 HD12 LEU 93 -10.685 1.035 -6.021 810 HD13 LEU 93 HD13 LEU 93 -9.199 0.087 -5.983 811 HD21 LEU 93 HD21 LEU 93 -12.025 -0.559 -5.892 812 HD22 LEU 93 HD22 LEU 93 -12.678 -0.229 -4.288 813 HD23 LEU 93 HD23 LEU 93 -12.033 -1.827 -4.667 814 H ALA 94 HN ALA 94 -7.701 -2.847 -2.150 815 HA ALA 94 HA ALA 94 -7.028 -5.174 -3.568 816 HB1 ALA 94 HB1 ALA 94 -5.741 -4.383 -0.970 817 HB2 ALA 94 HB2 ALA 94 -5.458 -3.493 -2.467 818 HB3 ALA 94 HB3 ALA 94 -5.013 -5.197 -2.356 819 H GLU 95 HN GLU 95 -8.388 -4.721 -0.345 820 HA GLU 95 HA GLU 95 -8.132 -7.368 0.553 821 HB2 GLU 95 HB2 GLU 95 -10.121 -5.196 1.211 822 HB3 GLU 95 HB1 GLU 95 -10.102 -6.750 2.033 823 HG2 GLU 95 HG2 GLU 95 -7.913 -6.334 2.906 824 HG3 GLU 95 HG1 GLU 95 -7.752 -4.872 1.931 825 H GLU 96 HN GLU 96 -10.562 -5.752 -1.400 826 HA GLU 96 HA GLU 96 -12.484 -7.807 -1.477 827 HB2 GLU 96 HB2 GLU 96 -11.788 -5.603 -3.430 828 HB3 GLU 96 HB1 GLU 96 -13.159 -6.685 -3.655 829 HG2 GLU 96 HG2 GLU 96 -14.205 -5.886 -1.655 830 HG3 GLU 96 HG1 GLU 96 -12.777 -4.948 -1.227 831 H ILE 97 HN ILE 97 -9.661 -7.119 -3.472 832 HA ILE 97 HA ILE 97 -10.094 -9.184 -5.377 833 HB ILE 97 HB ILE 97 -7.562 -7.702 -4.642 834 HG12 ILE 97 HG12 ILE 97 -9.473 -7.273 -6.940 835 HG13 ILE 97 HG11 ILE 97 -9.529 -6.364 -5.432 836 HG21 ILE 97 HG21 ILE 97 -7.128 -9.847 -5.819 837 HG22 ILE 97 HG22 ILE 97 -6.659 -8.432 -6.764 838 HG23 ILE 97 HG23 ILE 97 -8.153 -9.291 -7.142 839 HD11 ILE 97 HD11 ILE 97 -8.280 -5.454 -7.535 840 HD12 ILE 97 HD12 ILE 97 -6.973 -6.460 -6.911 841 HD13 ILE 97 HD13 ILE 97 -7.666 -5.187 -5.904 842 H GLY 98 HN GLY 98 -8.104 -8.921 -2.452 843 HA2 GLY 98 HA2 GLY 98 -6.906 -11.487 -2.646 844 HA3 GLY 98 HA1 GLY 98 -7.004 -10.503 -1.193 845 H ASP 99 HN ASP 99 -10.015 -10.464 -1.564 846 HA ASP 99 HA ASP 99 -10.660 -12.562 0.193 847 HB2 ASP 99 HB2 ASP 99 -11.986 -10.476 -0.045 848 HB3 ASP 99 HB1 ASP 99 -12.536 -11.030 -1.624 849 H TYR 100 HN TYR 100 -10.906 -12.286 -3.312 850 HA TYR 100 HA TYR 100 -12.329 -14.693 -3.731 851 HB2 TYR 100 HB2 TYR 100 -12.281 -12.925 -5.422 852 HB3 TYR 100 HB1 TYR 100 -10.541 -13.110 -5.595 853 HD1 TYR 100 HD1 TYR 100 -13.747 -14.961 -6.015 854 HD2 TYR 100 HD2 TYR 100 -9.674 -14.583 -7.187 855 HE1 TYR 100 HE1 TYR 100 -14.110 -16.620 -7.793 856 HE2 TYR 100 HE2 TYR 100 -10.027 -16.243 -8.966 857 HH TYR 100 HH TYR 100 -12.173 -18.344 -9.121 858 H LYS 101 HN LYS 101 -11.639 -16.693 -3.662 859 HA LYS 101 HA LYS 101 -8.781 -17.203 -3.346 860 HB2 LYS 101 HB2 LYS 101 -11.123 -19.057 -2.866 861 HB3 LYS 101 HB1 LYS 101 -9.444 -19.396 -2.478 862 HG2 LYS 101 HG2 LYS 101 -11.011 -17.124 -1.276 863 HG3 LYS 101 HG1 LYS 101 -10.857 -18.720 -0.536 864 HD2 LYS 101 HD2 LYS 101 -8.468 -17.054 -1.296 865 HD3 LYS 101 HD1 LYS 101 -9.255 -16.914 0.276 866 HE2 LYS 101 HE2 LYS 101 -8.089 -19.447 -0.881 867 HE3 LYS 101 HE1 LYS 101 -7.318 -18.428 0.334 868 HZ1 LYS 101 HZ1 LYS 101 -9.407 -20.382 0.637 869 HZ2 LYS 101 HZ2 LYS 101 -9.748 -18.917 1.410 870 HZ3 LYS 101 HZ3 LYS 101 -8.332 -19.761 1.787 871 H ASP 102 HN ASP 102 -7.681 -18.772 -4.549 872 HA ASP 102 HA ASP 102 -8.996 -20.077 -6.773 873 HB2 ASP 102 HB2 ASP 102 -8.313 -17.669 -7.465 874 HB3 ASP 102 HB1 ASP 102 -6.667 -18.288 -7.434 875 H ASP 103 HN ASP 103 -7.560 -21.608 -7.861 876 HA ASP 103 HA ASP 103 -5.632 -22.716 -5.979 877 HB2 ASP 103 HB2 ASP 103 -7.316 -24.190 -7.055 878 HB3 ASP 103 HB1 ASP 103 -6.612 -23.819 -8.625 879 H ASP 104 HN ASP 104 -3.691 -21.745 -6.070 880 HA ASP 104 HA ASP 104 -2.566 -21.022 -8.668 881 HB2 ASP 104 HB2 ASP 104 -0.855 -19.806 -7.404 882 HB3 ASP 104 HB1 ASP 104 -2.472 -19.318 -6.915 883 H ASP 105 HN ASP 105 -2.709 -23.765 -7.070 884 HA ASP 105 HA ASP 105 -1.500 -25.682 -6.931 885 HB2 ASP 105 HB2 ASP 105 -1.376 -25.103 -9.438 886 HB3 ASP 105 HB1 ASP 105 0.284 -24.616 -9.109 887 H LYS 106 HN LYS 106 -0.736 -23.813 -5.049 888 HA LYS 106 HA LYS 106 2.137 -24.400 -4.796 889 HB2 LYS 106 HB2 LYS 106 0.724 -21.820 -4.105 890 HB3 LYS 106 HB1 LYS 106 2.341 -22.218 -3.544 891 HG2 LYS 106 HG2 LYS 106 3.117 -22.344 -5.859 892 HG3 LYS 106 HG1 LYS 106 1.494 -21.945 -6.422 893 HD2 LYS 106 HD2 LYS 106 1.624 -19.797 -5.239 894 HD3 LYS 106 HD1 LYS 106 3.260 -20.196 -4.707 895 HE2 LYS 106 HE2 LYS 106 2.366 -19.926 -7.577 896 HE3 LYS 106 HE1 LYS 106 3.247 -18.702 -6.663 897 HZ1 LYS 106 HZ1 LYS 106 4.930 -20.626 -6.320 898 HZ2 LYS 106 HZ2 LYS 106 4.926 -19.769 -7.778 899 HZ3 LYS 106 HZ3 LYS 106 4.191 -21.289 -7.691 Start of MODEL 13 1 H1 MET 1 HT1 MET 1 -20.536 -14.191 -13.670 2 H2 MET 1 HT2 MET 1 -19.726 -12.717 -13.487 3 H3 MET 1 HT3 MET 1 -18.849 -14.135 -13.786 4 HA MET 1 HA MET 1 -19.915 -14.340 -15.958 5 HB2 MET 1 HB2 MET 1 -21.027 -11.617 -15.251 6 HB3 MET 1 HB1 MET 1 -21.128 -12.369 -16.836 7 HG2 MET 1 HG2 MET 1 -22.481 -14.166 -15.920 8 HG3 MET 1 HG1 MET 1 -22.348 -13.461 -14.310 9 HE1 MET 1 HE1 MET 1 -24.747 -14.236 -14.801 10 HE2 MET 1 HE2 MET 1 -25.955 -13.318 -15.700 11 HE3 MET 1 HE3 MET 1 -25.486 -12.809 -14.077 12 H ALA 2 HN ALA 2 -17.843 -12.582 -14.144 13 HA ALA 2 HA ALA 2 -16.389 -11.640 -16.523 14 HB1 ALA 2 HB1 ALA 2 -17.402 -10.051 -14.372 15 HB2 ALA 2 HB2 ALA 2 -16.516 -9.538 -15.808 16 HB3 ALA 2 HB3 ALA 2 -15.638 -10.002 -14.349 17 HA PRO 3 HA PRO 3 -13.041 -14.003 -14.864 18 HB2 PRO 3 HB2 PRO 3 -10.940 -12.832 -16.074 19 HB3 PRO 3 HB1 PRO 3 -12.101 -13.836 -16.953 20 HG2 PRO 3 HG2 PRO 3 -11.978 -10.857 -16.715 21 HG3 PRO 3 HG1 PRO 3 -12.223 -11.847 -18.165 22 HD2 PRO 3 HD2 PRO 3 -14.274 -10.659 -16.873 23 HD3 PRO 3 HD1 PRO 3 -14.450 -12.236 -17.673 24 H LEU 4 HN LEU 4 -11.444 -13.983 -13.300 25 HA LEU 4 HA LEU 4 -11.033 -11.394 -11.956 26 HB2 LEU 4 HB2 LEU 4 -11.111 -14.135 -10.688 27 HB3 LEU 4 HB1 LEU 4 -10.887 -12.614 -9.846 28 HG LEU 4 HG LEU 4 -13.387 -13.474 -11.307 29 HD11 LEU 4 HD11 LEU 4 -14.391 -13.750 -9.185 30 HD12 LEU 4 HD12 LEU 4 -13.004 -13.043 -8.357 31 HD13 LEU 4 HD13 LEU 4 -12.859 -14.621 -9.132 32 HD21 LEU 4 HD21 LEU 4 -14.277 -11.414 -10.010 33 HD22 LEU 4 HD22 LEU 4 -13.413 -11.176 -11.530 34 HD23 LEU 4 HD23 LEU 4 -12.587 -10.910 -9.992 35 H ARG 5 HN ARG 5 -8.973 -10.817 -11.437 36 HA ARG 5 HA ARG 5 -6.832 -12.767 -11.943 37 HB2 ARG 5 HB2 ARG 5 -6.878 -9.896 -12.849 38 HB3 ARG 5 HB1 ARG 5 -5.479 -10.958 -12.937 39 HG2 ARG 5 HG2 ARG 5 -6.867 -12.497 -14.358 40 HG3 ARG 5 HG1 ARG 5 -8.077 -11.212 -14.421 41 HD2 ARG 5 HD2 ARG 5 -6.361 -9.696 -15.319 42 HD3 ARG 5 HD1 ARG 5 -5.223 -11.039 -15.324 43 HE ARG 5 HE ARG 5 -7.518 -11.761 -16.779 44 HH11 ARG 5 HH11 ARG 5 -4.752 -9.657 -16.989 45 HH12 ARG 5 HH12 ARG 5 -4.706 -9.671 -18.722 46 HH21 ARG 5 HH21 ARG 5 -7.472 -11.792 -19.057 47 HH22 ARG 5 HH22 ARG 5 -6.258 -10.889 -19.900 48 H LYS 6 HN LYS 6 -4.938 -12.499 -10.696 49 HA LYS 6 HA LYS 6 -5.314 -11.507 -8.088 50 HB2 LYS 6 HB2 LYS 6 -2.806 -12.321 -9.556 51 HB3 LYS 6 HB1 LYS 6 -2.833 -11.892 -7.852 52 HG2 LYS 6 HG2 LYS 6 -4.472 -14.119 -9.039 53 HG3 LYS 6 HG1 LYS 6 -2.873 -14.342 -8.325 54 HD2 LYS 6 HD2 LYS 6 -3.753 -13.367 -6.209 55 HD3 LYS 6 HD1 LYS 6 -5.358 -13.333 -6.940 56 HE2 LYS 6 HE2 LYS 6 -3.677 -15.811 -6.569 57 HE3 LYS 6 HE1 LYS 6 -4.987 -15.311 -5.500 58 HZ1 LYS 6 HZ1 LYS 6 -5.650 -16.992 -7.165 59 HZ2 LYS 6 HZ2 LYS 6 -5.320 -15.875 -8.395 60 HZ3 LYS 6 HZ3 LYS 6 -6.547 -15.558 -7.276 61 H THR 7 HN THR 7 -3.675 -10.207 -10.889 62 HA THR 7 HA THR 7 -2.949 -7.796 -9.439 63 HB THR 7 HB THR 7 -2.207 -7.203 -11.940 64 HG1 THR 7 HG1 THR 7 -2.877 -9.045 -12.965 65 HG21 THR 7 HG21 THR 7 -0.907 -8.488 -9.663 66 HG22 THR 7 HG22 THR 7 -0.364 -7.140 -10.667 67 HG23 THR 7 HG23 THR 7 -0.099 -8.801 -11.200 68 H ALA 8 HN ALA 8 -4.185 -6.084 -9.372 69 HA ALA 8 HA ALA 8 -6.486 -5.902 -11.167 70 HB1 ALA 8 HB1 ALA 8 -5.935 -4.085 -8.847 71 HB2 ALA 8 HB2 ALA 8 -6.632 -5.691 -8.623 72 HB3 ALA 8 HB3 ALA 8 -7.479 -4.488 -9.597 73 H VAL 9 HN VAL 9 -7.019 -3.964 -12.250 74 HA VAL 9 HA VAL 9 -4.649 -2.351 -12.918 75 HB VAL 9 HB VAL 9 -7.059 -2.934 -14.642 76 HG11 VAL 9 HG11 VAL 9 -5.331 -1.903 -16.374 77 HG12 VAL 9 HG12 VAL 9 -4.762 -1.059 -14.934 78 HG13 VAL 9 HG13 VAL 9 -6.438 -0.882 -15.454 79 HG21 VAL 9 HG21 VAL 9 -5.078 -4.659 -14.144 80 HG22 VAL 9 HG22 VAL 9 -4.328 -3.736 -15.446 81 HG23 VAL 9 HG23 VAL 9 -5.873 -4.542 -15.714 82 H LEU 10 HN LEU 10 -4.726 -0.297 -12.387 83 HA LEU 10 HA LEU 10 -7.333 0.938 -11.750 84 HB2 LEU 10 HB2 LEU 10 -4.931 0.734 -10.232 85 HB3 LEU 10 HB1 LEU 10 -5.137 2.417 -10.664 86 HG LEU 10 HG LEU 10 -6.079 2.060 -8.488 87 HD11 LEU 10 HD11 LEU 10 -8.449 2.681 -8.851 88 HD12 LEU 10 HD12 LEU 10 -8.235 2.341 -10.569 89 HD13 LEU 10 HD13 LEU 10 -7.309 3.632 -9.804 90 HD21 LEU 10 HD21 LEU 10 -7.970 0.487 -8.152 91 HD22 LEU 10 HD22 LEU 10 -6.431 -0.299 -8.505 92 HD23 LEU 10 HD23 LEU 10 -7.658 -0.161 -9.763 93 H LYS 11 HN LYS 11 -7.860 2.787 -12.926 94 HA LYS 11 HA LYS 11 -5.705 3.784 -14.665 95 HB2 LYS 11 HB2 LYS 11 -8.648 3.528 -15.301 96 HB3 LYS 11 HB1 LYS 11 -7.523 4.472 -16.270 97 HG2 LYS 11 HG2 LYS 11 -6.221 2.442 -16.710 98 HG3 LYS 11 HG1 LYS 11 -7.391 1.505 -15.780 99 HD2 LYS 11 HD2 LYS 11 -9.156 2.145 -17.338 100 HD3 LYS 11 HD1 LYS 11 -8.004 3.117 -18.257 101 HE2 LYS 11 HE2 LYS 11 -6.712 1.113 -18.767 102 HE3 LYS 11 HE1 LYS 11 -7.849 0.134 -17.838 103 HZ1 LYS 11 HZ1 LYS 11 -8.000 0.803 -20.520 104 HZ2 LYS 11 HZ2 LYS 11 -9.236 1.674 -19.761 105 HZ3 LYS 11 HZ3 LYS 11 -9.165 -0.008 -19.598 106 H LEU 12 HN LEU 12 -5.255 5.853 -14.564 107 HA LEU 12 HA LEU 12 -7.026 7.538 -12.943 108 HB2 LEU 12 HB2 LEU 12 -4.246 7.096 -12.820 109 HB3 LEU 12 HB1 LEU 12 -4.443 8.721 -13.447 110 HG LEU 12 HG LEU 12 -5.666 7.714 -10.876 111 HD11 LEU 12 HD11 LEU 12 -3.221 7.820 -10.762 112 HD12 LEU 12 HD12 LEU 12 -3.977 9.056 -9.757 113 HD13 LEU 12 HD13 LEU 12 -3.272 9.494 -11.313 114 HD21 LEU 12 HD21 LEU 12 -5.910 10.223 -10.508 115 HD22 LEU 12 HD22 LEU 12 -7.018 9.470 -11.655 116 HD23 LEU 12 HD23 LEU 12 -5.632 10.389 -12.242 117 H TYR 13 HN TYR 13 -8.086 9.179 -14.017 118 HA TYR 13 HA TYR 13 -7.231 9.768 -16.768 119 HB2 TYR 13 HB2 TYR 13 -9.811 10.346 -15.287 120 HB3 TYR 13 HB1 TYR 13 -9.485 10.764 -16.966 121 HD1 TYR 13 HD1 TYR 13 -10.149 8.006 -14.630 122 HD2 TYR 13 HD2 TYR 13 -9.519 9.074 -18.700 123 HE1 TYR 13 HE1 TYR 13 -10.975 5.801 -15.329 124 HE2 TYR 13 HE2 TYR 13 -10.342 6.866 -19.409 125 HH TYR 13 HH TYR 13 -11.370 4.973 -18.744 126 H VAL 14 HN VAL 14 -6.075 11.599 -17.028 127 HA VAL 14 HA VAL 14 -6.468 13.772 -15.071 128 HB VAL 14 HB VAL 14 -4.064 14.316 -15.280 129 HG11 VAL 14 HG11 VAL 14 -4.876 11.641 -14.159 130 HG12 VAL 14 HG12 VAL 14 -4.719 13.180 -13.307 131 HG13 VAL 14 HG13 VAL 14 -3.278 12.343 -13.893 132 HG21 VAL 14 HG21 VAL 14 -2.628 13.204 -16.597 133 HG22 VAL 14 HG22 VAL 14 -4.070 12.627 -17.429 134 HG23 VAL 14 HG23 VAL 14 -3.317 11.634 -16.183 135 H ALA 15 HN ALA 15 -5.778 15.889 -15.854 136 HA ALA 15 HA ALA 15 -6.165 16.127 -18.761 137 HB1 ALA 15 HB1 ALA 15 -6.812 18.538 -17.276 138 HB2 ALA 15 HB2 ALA 15 -7.812 17.170 -16.786 139 HB3 ALA 15 HB3 ALA 15 -7.766 17.670 -18.476 140 H GLY 16 HN GLY 16 -4.208 16.448 -19.576 141 HA2 GLY 16 HA2 GLY 16 -2.185 17.437 -20.003 142 HA3 GLY 16 HA1 GLY 16 -2.800 18.844 -19.145 143 H ASN 17 HN ASN 17 -1.301 19.436 -17.714 144 HA ASN 17 HA ASN 17 -0.345 17.402 -15.826 145 HB2 ASN 17 HB2 ASN 17 1.323 18.104 -17.759 146 HB3 ASN 17 HB1 ASN 17 1.561 19.523 -16.745 147 HD21 ASN 17 HD21 ASN 17 3.570 19.170 -16.012 148 HD22 ASN 17 HD22 ASN 17 4.044 17.798 -15.076 149 H THR 18 HN THR 18 -2.387 18.911 -15.156 150 HA THR 18 HA THR 18 -1.646 21.417 -13.967 151 HB THR 18 HB THR 18 -3.892 21.395 -12.973 152 HG1 THR 18 HG1 THR 18 -5.259 19.544 -13.559 153 HG21 THR 18 HG21 THR 18 -4.316 20.376 -15.749 154 HG22 THR 18 HG22 THR 18 -3.390 21.855 -15.498 155 HG23 THR 18 HG23 THR 18 -5.054 21.754 -14.931 156 HA PRO 19 HA PRO 19 -0.067 20.204 -10.053 157 HB2 PRO 19 HB2 PRO 19 -2.202 21.898 -8.807 158 HB3 PRO 19 HB1 PRO 19 -0.457 21.900 -8.521 159 HG2 PRO 19 HG2 PRO 19 -1.523 23.812 -9.994 160 HG3 PRO 19 HG1 PRO 19 -0.006 23.049 -10.510 161 HD2 PRO 19 HD2 PRO 19 -2.789 22.604 -11.528 162 HD3 PRO 19 HD1 PRO 19 -1.265 22.731 -12.431 163 H ASN 20 HN ASN 20 -3.607 20.172 -10.275 164 HA ASN 20 HA ASN 20 -4.030 18.396 -8.099 165 HB2 ASN 20 HB2 ASN 20 -5.768 18.863 -10.553 166 HB3 ASN 20 HB1 ASN 20 -6.248 17.927 -9.146 167 HD21 ASN 20 HD21 ASN 20 -5.893 19.160 -7.015 168 HD22 ASN 20 HD22 ASN 20 -6.468 20.790 -7.005 169 H SER 21 HN SER 21 -3.699 17.877 -11.605 170 HA SER 21 HA SER 21 -3.898 15.036 -11.567 171 HB2 SER 21 HB2 SER 21 -2.591 16.912 -13.556 172 HB3 SER 21 HB1 SER 21 -2.893 15.197 -13.832 173 HG SER 21 HG SER 21 -4.639 17.338 -13.877 174 H VAL 22 HN VAL 22 -1.121 17.237 -11.465 175 HA VAL 22 HA VAL 22 0.809 15.178 -11.525 176 HB VAL 22 HB VAL 22 0.954 18.006 -10.441 177 HG11 VAL 22 HG11 VAL 22 3.137 15.952 -10.671 178 HG12 VAL 22 HG12 VAL 22 2.617 16.841 -9.236 179 HG13 VAL 22 HG13 VAL 22 3.448 17.685 -10.547 180 HG21 VAL 22 HG21 VAL 22 1.758 16.715 -13.025 181 HG22 VAL 22 HG22 VAL 22 2.459 18.244 -12.498 182 HG23 VAL 22 HG23 VAL 22 0.719 18.116 -12.760 183 H ARG 23 HN ARG 23 -0.754 16.875 -8.856 184 HA ARG 23 HA ARG 23 0.650 15.687 -6.734 185 HB2 ARG 23 HB2 ARG 23 -1.158 17.629 -6.903 186 HB3 ARG 23 HB1 ARG 23 -2.251 16.315 -6.475 187 HG2 ARG 23 HG2 ARG 23 -1.794 16.918 -4.380 188 HG3 ARG 23 HG1 ARG 23 -0.302 16.003 -4.616 189 HD2 ARG 23 HD2 ARG 23 0.858 18.030 -5.283 190 HD3 ARG 23 HD1 ARG 23 -0.637 18.954 -5.130 191 HE ARG 23 HE ARG 23 -0.141 17.719 -2.678 192 HH11 ARG 23 HH11 ARG 23 1.285 20.146 -4.726 193 HH12 ARG 23 HH12 ARG 23 1.998 21.024 -3.415 194 HH21 ARG 23 HH21 ARG 23 0.790 18.860 -0.940 195 HH22 ARG 23 HH22 ARG 23 1.716 20.289 -1.254 196 H ALA 24 HN ALA 24 -2.406 14.840 -8.307 197 HA ALA 24 HA ALA 24 -2.999 12.600 -6.715 198 HB1 ALA 24 HB1 ALA 24 -3.911 12.497 -9.511 199 HB2 ALA 24 HB2 ALA 24 -4.340 13.955 -8.617 200 HB3 ALA 24 HB3 ALA 24 -4.827 12.372 -8.009 201 H LEU 25 HN LEU 25 -1.294 12.922 -9.793 202 HA LEU 25 HA LEU 25 -0.894 10.195 -10.336 203 HB2 LEU 25 HB2 LEU 25 -0.581 11.923 -12.018 204 HB3 LEU 25 HB1 LEU 25 0.755 12.602 -11.111 205 HG LEU 25 HG LEU 25 2.064 10.556 -11.517 206 HD11 LEU 25 HD11 LEU 25 1.117 9.087 -13.422 207 HD12 LEU 25 HD12 LEU 25 -0.449 9.719 -12.915 208 HD13 LEU 25 HD13 LEU 25 0.548 8.815 -11.774 209 HD21 LEU 25 HD21 LEU 25 2.467 10.941 -13.896 210 HD22 LEU 25 HD22 LEU 25 2.278 12.461 -13.022 211 HD23 LEU 25 HD23 LEU 25 0.954 11.840 -14.009 212 H LYS 26 HN LYS 26 1.243 12.513 -8.652 213 HA LYS 26 HA LYS 26 3.309 10.652 -8.169 214 HB2 LYS 26 HB2 LYS 26 2.538 13.191 -6.736 215 HB3 LYS 26 HB1 LYS 26 3.954 12.244 -6.304 216 HG2 LYS 26 HG2 LYS 26 4.850 12.562 -8.561 217 HG3 LYS 26 HG1 LYS 26 3.433 13.527 -8.979 218 HD2 LYS 26 HD2 LYS 26 4.019 15.144 -7.238 219 HD3 LYS 26 HD1 LYS 26 5.433 14.176 -6.812 220 HE2 LYS 26 HE2 LYS 26 4.934 15.454 -9.499 221 HE3 LYS 26 HE1 LYS 26 6.000 16.094 -8.250 222 HZ1 LYS 26 HZ1 LYS 26 7.535 14.939 -9.391 223 HZ2 LYS 26 HZ2 LYS 26 6.410 13.880 -10.081 224 HZ3 LYS 26 HZ3 LYS 26 6.953 13.623 -8.500 225 H THR 27 HN THR 27 0.446 11.548 -6.300 226 HA THR 27 HA THR 27 1.046 10.073 -3.967 227 HB THR 27 HB THR 27 -1.630 10.924 -5.091 228 HG1 THR 27 HG1 THR 27 -0.491 12.760 -4.694 229 HG21 THR 27 HG21 THR 27 -0.824 9.611 -2.565 230 HG22 THR 27 HG22 THR 27 -2.350 9.540 -3.443 231 HG23 THR 27 HG23 THR 27 -1.977 10.941 -2.437 232 H LEU 28 HN LEU 28 -0.876 9.271 -6.862 233 HA LEU 28 HA LEU 28 -1.668 6.712 -5.907 234 HB2 LEU 28 HB2 LEU 28 -2.050 8.310 -8.281 235 HB3 LEU 28 HB1 LEU 28 -1.712 6.647 -8.717 236 HG LEU 28 HG LEU 28 -4.063 6.830 -8.615 237 HD11 LEU 28 HD11 LEU 28 -3.867 5.735 -5.915 238 HD12 LEU 28 HD12 LEU 28 -2.721 5.043 -7.062 239 HD13 LEU 28 HD13 LEU 28 -4.449 4.997 -7.405 240 HD21 LEU 28 HD21 LEU 28 -4.885 8.582 -7.512 241 HD22 LEU 28 HD22 LEU 28 -3.498 8.662 -6.428 242 HD23 LEU 28 HD23 LEU 28 -4.828 7.561 -6.078 243 H ALA 29 HN ALA 29 0.841 7.718 -8.272 244 HA ALA 29 HA ALA 29 1.686 5.132 -8.938 245 HB1 ALA 29 HB1 ALA 29 2.740 7.865 -9.284 246 HB2 ALA 29 HB2 ALA 29 2.464 6.587 -10.469 247 HB3 ALA 29 HB3 ALA 29 3.896 6.539 -9.440 248 H ASN 30 HN ASN 30 2.965 7.357 -6.441 249 HA ASN 30 HA ASN 30 5.160 5.654 -5.780 250 HB2 ASN 30 HB2 ASN 30 5.176 8.048 -5.199 251 HB3 ASN 30 HB1 ASN 30 3.816 7.799 -4.109 252 HD21 ASN 30 HD21 ASN 30 7.187 6.981 -4.682 253 HD22 ASN 30 HD22 ASN 30 7.578 6.661 -3.031 254 H ILE 31 HN ILE 31 1.926 5.997 -4.418 255 HA ILE 31 HA ILE 31 2.331 4.178 -2.337 256 HB ILE 31 HB ILE 31 -0.164 5.155 -3.672 257 HG12 ILE 31 HG12 ILE 31 0.920 5.520 -0.877 258 HG13 ILE 31 HG11 ILE 31 1.234 6.627 -2.209 259 HG21 ILE 31 HG21 ILE 31 -0.197 3.465 -1.192 260 HG22 ILE 31 HG22 ILE 31 -0.417 2.777 -2.800 261 HG23 ILE 31 HG23 ILE 31 -1.552 3.985 -2.197 262 HD11 ILE 31 HD11 ILE 31 -0.578 7.296 -0.627 263 HD12 ILE 31 HD12 ILE 31 -1.521 5.950 -1.261 264 HD13 ILE 31 HD13 ILE 31 -1.026 7.260 -2.330 265 H LEU 32 HN LEU 32 1.056 3.724 -5.622 266 HA LEU 32 HA LEU 32 0.603 0.939 -5.304 267 HB2 LEU 32 HB2 LEU 32 0.794 2.690 -7.736 268 HB3 LEU 32 HB1 LEU 32 0.469 0.968 -7.832 269 HG LEU 32 HG LEU 32 -1.254 2.911 -6.282 270 HD11 LEU 32 HD11 LEU 32 -1.672 1.769 -9.044 271 HD12 LEU 32 HD12 LEU 32 -1.312 3.452 -8.661 272 HD13 LEU 32 HD13 LEU 32 -2.835 2.735 -8.135 273 HD21 LEU 32 HD21 LEU 32 -2.229 1.097 -5.478 274 HD22 LEU 32 HD22 LEU 32 -1.098 0.074 -6.365 275 HD23 LEU 32 HD23 LEU 32 -2.611 0.577 -7.120 276 H GLU 33 HN GLU 33 3.462 2.760 -6.211 277 HA GLU 33 HA GLU 33 4.789 0.369 -7.217 278 HB2 GLU 33 HB2 GLU 33 5.868 3.165 -6.827 279 HB3 GLU 33 HB1 GLU 33 6.739 1.839 -7.583 280 HG2 GLU 33 HG2 GLU 33 4.971 1.744 -9.323 281 HG3 GLU 33 HG1 GLU 33 4.238 3.170 -8.582 282 H LYS 34 HN LYS 34 4.222 1.583 -4.175 283 HA LYS 34 HA LYS 34 6.610 0.193 -3.157 284 HB2 LYS 34 HB2 LYS 34 6.910 2.611 -2.888 285 HB3 LYS 34 HB1 LYS 34 5.384 2.717 -2.025 286 HG2 LYS 34 HG2 LYS 34 7.183 2.785 -0.445 287 HG3 LYS 34 HG1 LYS 34 6.327 1.252 -0.265 288 HD2 LYS 34 HD2 LYS 34 8.049 0.108 -1.535 289 HD3 LYS 34 HD1 LYS 34 8.882 1.638 -1.825 290 HE2 LYS 34 HE2 LYS 34 9.246 1.890 0.581 291 HE3 LYS 34 HE1 LYS 34 8.413 0.363 0.869 292 HZ1 LYS 34 HZ1 LYS 34 10.816 0.093 0.885 293 HZ2 LYS 34 HZ2 LYS 34 10.918 0.688 -0.695 294 HZ3 LYS 34 HZ3 LYS 34 10.125 -0.775 -0.392 295 H GLU 35 HN GLU 35 3.551 1.564 -1.961 296 HA GLU 35 HA GLU 35 3.246 -0.273 0.153 297 HB2 GLU 35 HB2 GLU 35 1.312 1.581 -1.245 298 HB3 GLU 35 HB1 GLU 35 0.854 0.598 0.147 299 HG2 GLU 35 HG2 GLU 35 3.016 2.698 0.094 300 HG3 GLU 35 HG1 GLU 35 1.414 2.874 0.803 301 H PHE 36 HN PHE 36 1.936 -0.241 -3.144 302 HA PHE 36 HA PHE 36 0.955 -2.983 -2.667 303 HB2 PHE 36 HB2 PHE 36 -0.247 -0.873 -4.468 304 HB3 PHE 36 HB1 PHE 36 -0.792 -2.542 -4.372 305 HD1 PHE 36 HD1 PHE 36 -0.829 0.718 -2.801 306 HD2 PHE 36 HD2 PHE 36 -1.870 -3.379 -2.322 307 HE1 PHE 36 HE1 PHE 36 -2.307 1.318 -0.929 308 HE2 PHE 36 HE2 PHE 36 -3.352 -2.787 -0.450 309 HZ PHE 36 HZ PHE 36 -3.569 -0.435 0.250 310 H LYS 37 HN LYS 37 3.582 -2.157 -3.639 311 HA LYS 37 HA LYS 37 3.852 -2.358 -6.410 312 HB2 LYS 37 HB2 LYS 37 5.607 -1.755 -4.611 313 HB3 LYS 37 HB1 LYS 37 5.885 -3.487 -4.505 314 HG2 LYS 37 HG2 LYS 37 5.930 -2.386 -7.229 315 HG3 LYS 37 HG1 LYS 37 7.215 -1.817 -6.161 316 HD2 LYS 37 HD2 LYS 37 7.964 -4.044 -5.752 317 HD3 LYS 37 HD1 LYS 37 6.543 -4.731 -6.543 318 HE2 LYS 37 HE2 LYS 37 8.406 -4.902 -8.045 319 HE3 LYS 37 HE1 LYS 37 7.292 -3.685 -8.669 320 HZ1 LYS 37 HZ1 LYS 37 9.954 -3.325 -7.471 321 HZ2 LYS 37 HZ2 LYS 37 8.824 -2.071 -7.370 322 HZ3 LYS 37 HZ3 LYS 37 9.314 -2.648 -8.883 323 H GLY 38 HN GLY 38 3.602 -3.962 -7.803 324 HA2 GLY 38 HA2 GLY 38 3.813 -6.136 -8.639 325 HA3 GLY 38 HA1 GLY 38 4.111 -6.710 -7.007 326 H VAL 39 HN VAL 39 1.476 -4.865 -6.594 327 HA VAL 39 HA VAL 39 -0.275 -7.175 -7.056 328 HB VAL 39 HB VAL 39 -0.723 -4.901 -5.106 329 HG11 VAL 39 HG11 VAL 39 -2.172 -7.536 -5.365 330 HG12 VAL 39 HG12 VAL 39 -2.788 -5.980 -5.921 331 HG13 VAL 39 HG13 VAL 39 -2.514 -6.255 -4.201 332 HG21 VAL 39 HG21 VAL 39 1.228 -6.476 -4.636 333 HG22 VAL 39 HG22 VAL 39 0.009 -7.726 -4.386 334 HG23 VAL 39 HG23 VAL 39 0.022 -6.289 -3.363 335 H TYR 40 HN TYR 40 -0.116 -3.636 -7.430 336 HA TYR 40 HA TYR 40 -2.454 -3.927 -9.168 337 HB2 TYR 40 HB2 TYR 40 -1.638 -1.671 -7.367 338 HB3 TYR 40 HB1 TYR 40 -2.621 -1.323 -8.778 339 HD1 TYR 40 HD1 TYR 40 -2.540 -3.214 -5.591 340 HD2 TYR 40 HD2 TYR 40 -4.918 -1.696 -8.769 341 HE1 TYR 40 HE1 TYR 40 -4.574 -3.692 -4.295 342 HE2 TYR 40 HE2 TYR 40 -6.953 -2.174 -7.488 343 HH TYR 40 HH TYR 40 -7.773 -3.250 -5.697 344 H ALA 41 HN ALA 41 -2.508 -2.990 -11.162 345 HA ALA 41 HA ALA 41 0.051 -1.952 -12.174 346 HB1 ALA 41 HB1 ALA 41 -2.243 -2.815 -13.910 347 HB2 ALA 41 HB2 ALA 41 -1.144 -4.006 -13.211 348 HB3 ALA 41 HB3 ALA 41 -0.522 -2.758 -14.292 349 H LEU 42 HN LEU 42 0.157 0.199 -12.623 350 HA LEU 42 HA LEU 42 -2.340 1.705 -12.507 351 HB2 LEU 42 HB2 LEU 42 -0.560 2.408 -11.002 352 HB3 LEU 42 HB1 LEU 42 0.523 2.641 -12.358 353 HG LEU 42 HG LEU 42 -0.933 4.463 -13.188 354 HD11 LEU 42 HD11 LEU 42 -2.578 3.606 -10.872 355 HD12 LEU 42 HD12 LEU 42 -3.073 4.196 -12.460 356 HD13 LEU 42 HD13 LEU 42 -2.501 5.329 -11.236 357 HD21 LEU 42 HD21 LEU 42 -0.212 4.999 -10.326 358 HD22 LEU 42 HD22 LEU 42 -0.141 6.094 -11.707 359 HD23 LEU 42 HD23 LEU 42 1.015 4.768 -11.572 360 H LYS 43 HN LYS 43 -3.230 2.704 -14.128 361 HA LYS 43 HA LYS 43 -1.740 3.120 -16.622 362 HB2 LYS 43 HB2 LYS 43 -4.180 1.580 -16.167 363 HB3 LYS 43 HB1 LYS 43 -4.424 2.872 -17.334 364 HG2 LYS 43 HG2 LYS 43 -3.848 0.945 -18.558 365 HG3 LYS 43 HG1 LYS 43 -2.434 1.998 -18.577 366 HD2 LYS 43 HD2 LYS 43 -1.360 0.677 -16.879 367 HD3 LYS 43 HD1 LYS 43 -2.813 -0.305 -16.670 368 HE2 LYS 43 HE2 LYS 43 -2.598 -1.113 -18.964 369 HE3 LYS 43 HE1 LYS 43 -1.156 -0.125 -19.183 370 HZ1 LYS 43 HZ1 LYS 43 -0.401 -2.278 -18.700 371 HZ2 LYS 43 HZ2 LYS 43 -1.498 -2.485 -17.430 372 HZ3 LYS 43 HZ3 LYS 43 -0.198 -1.417 -17.258 373 H VAL 44 HN VAL 44 -1.946 5.096 -17.471 374 HA VAL 44 HA VAL 44 -3.846 6.972 -16.190 375 HB VAL 44 HB VAL 44 -1.010 7.475 -17.090 376 HG11 VAL 44 HG11 VAL 44 -2.137 9.468 -17.615 377 HG12 VAL 44 HG12 VAL 44 -1.469 9.760 -16.008 378 HG13 VAL 44 HG13 VAL 44 -3.175 9.354 -16.193 379 HG21 VAL 44 HG21 VAL 44 -1.893 8.077 -14.341 380 HG22 VAL 44 HG22 VAL 44 -0.357 7.440 -14.928 381 HG23 VAL 44 HG23 VAL 44 -1.752 6.372 -14.771 382 H ILE 45 HN ILE 45 -5.141 8.053 -17.417 383 HA ILE 45 HA ILE 45 -4.819 7.842 -20.335 384 HB ILE 45 HB ILE 45 -7.328 8.234 -18.702 385 HG12 ILE 45 HG12 ILE 45 -6.399 6.037 -18.240 386 HG13 ILE 45 HG11 ILE 45 -7.859 5.877 -19.207 387 HG21 ILE 45 HG21 ILE 45 -7.385 9.082 -21.055 388 HG22 ILE 45 HG22 ILE 45 -8.582 7.831 -20.699 389 HG23 ILE 45 HG23 ILE 45 -7.115 7.425 -21.599 390 HD11 ILE 45 HD11 ILE 45 -6.064 4.344 -19.871 391 HD12 ILE 45 HD12 ILE 45 -5.055 5.732 -20.281 392 HD13 ILE 45 HD13 ILE 45 -6.548 5.431 -21.173 393 H ASP 46 HN ASP 46 -4.176 9.793 -21.185 394 HA ASP 46 HA ASP 46 -4.717 12.243 -19.736 395 HB2 ASP 46 HB2 ASP 46 -2.534 11.776 -20.909 396 HB3 ASP 46 HB1 ASP 46 -3.392 11.948 -22.435 397 H VAL 47 HN VAL 47 -6.762 12.920 -19.886 398 HA VAL 47 HA VAL 47 -8.471 12.382 -22.072 399 HB VAL 47 HB VAL 47 -10.119 13.747 -20.961 400 HG11 VAL 47 HG11 VAL 47 -10.379 11.942 -19.683 401 HG12 VAL 47 HG12 VAL 47 -9.331 12.701 -18.483 402 HG13 VAL 47 HG13 VAL 47 -8.644 11.618 -19.697 403 HG21 VAL 47 HG21 VAL 47 -9.677 15.133 -19.082 404 HG22 VAL 47 HG22 VAL 47 -8.520 15.585 -20.335 405 HG23 VAL 47 HG23 VAL 47 -8.006 14.576 -18.982 406 H LEU 48 HN LEU 48 -6.224 15.003 -21.622 407 HA LEU 48 HA LEU 48 -7.654 16.708 -23.486 408 HB2 LEU 48 HB2 LEU 48 -4.989 17.095 -22.136 409 HB3 LEU 48 HB1 LEU 48 -5.718 18.252 -23.233 410 HG LEU 48 HG LEU 48 -6.865 17.378 -20.579 411 HD11 LEU 48 HD11 LEU 48 -5.460 19.886 -21.468 412 HD12 LEU 48 HD12 LEU 48 -4.985 18.774 -20.185 413 HD13 LEU 48 HD13 LEU 48 -6.421 19.779 -19.993 414 HD21 LEU 48 HD21 LEU 48 -8.326 19.470 -21.109 415 HD22 LEU 48 HD22 LEU 48 -8.748 17.904 -21.803 416 HD23 LEU 48 HD23 LEU 48 -7.905 19.106 -22.783 417 H LYS 49 HN LYS 49 -4.743 14.692 -23.490 418 HA LYS 49 HA LYS 49 -3.941 15.477 -26.110 419 HB2 LYS 49 HB2 LYS 49 -3.194 13.100 -24.424 420 HB3 LYS 49 HB1 LYS 49 -2.544 13.371 -26.035 421 HG2 LYS 49 HG2 LYS 49 -1.645 15.530 -25.297 422 HG3 LYS 49 HG1 LYS 49 -2.259 15.214 -23.672 423 HD2 LYS 49 HD2 LYS 49 -0.852 13.219 -23.535 424 HD3 LYS 49 HD1 LYS 49 -0.241 13.540 -25.158 425 HE2 LYS 49 HE2 LYS 49 0.045 15.388 -22.796 426 HE3 LYS 49 HE1 LYS 49 1.303 14.301 -23.387 427 HZ1 LYS 49 HZ1 LYS 49 1.909 16.101 -24.556 428 HZ2 LYS 49 HZ2 LYS 49 0.390 16.834 -24.456 429 HZ3 LYS 49 HZ3 LYS 49 0.675 15.634 -25.613 430 H ASN 50 HN ASN 50 -5.938 12.906 -24.806 431 HA ASN 50 HA ASN 50 -6.891 12.378 -27.538 432 HB2 ASN 50 HB2 ASN 50 -5.315 10.562 -26.555 433 HB3 ASN 50 HB1 ASN 50 -6.675 10.181 -25.501 434 HD21 ASN 50 HD21 ASN 50 -5.302 8.751 -27.780 435 HD22 ASN 50 HD22 ASN 50 -6.600 8.267 -28.812 436 HA PRO 51 HA PRO 51 -10.307 13.499 -24.640 437 HB2 PRO 51 HB2 PRO 51 -11.689 14.895 -26.570 438 HB3 PRO 51 HB1 PRO 51 -10.504 15.613 -25.472 439 HG2 PRO 51 HG2 PRO 51 -10.158 14.712 -28.303 440 HG3 PRO 51 HG1 PRO 51 -9.518 16.156 -27.499 441 HD2 PRO 51 HD2 PRO 51 -8.003 13.993 -27.964 442 HD3 PRO 51 HD1 PRO 51 -7.792 14.997 -26.513 443 H GLN 52 HN GLN 52 -10.092 11.926 -27.707 444 HA GLN 52 HA GLN 52 -12.779 11.107 -28.028 445 HB2 GLN 52 HB2 GLN 52 -10.181 9.844 -28.927 446 HB3 GLN 52 HB1 GLN 52 -11.766 9.239 -29.392 447 HG2 GLN 52 HG2 GLN 52 -12.267 11.328 -30.513 448 HG3 GLN 52 HG1 GLN 52 -10.722 11.999 -29.993 449 HE21 GLN 52 HE21 GLN 52 -8.928 11.573 -31.156 450 HE22 GLN 52 HE22 GLN 52 -8.896 10.589 -32.574 451 H LEU 53 HN LEU 53 -10.034 9.757 -26.287 452 HA LEU 53 HA LEU 53 -11.426 7.383 -25.545 453 HB2 LEU 53 HB2 LEU 53 -8.913 8.636 -24.435 454 HB3 LEU 53 HB1 LEU 53 -9.550 7.097 -23.885 455 HG LEU 53 HG LEU 53 -8.671 7.690 -26.711 456 HD11 LEU 53 HD11 LEU 53 -7.279 5.888 -24.758 457 HD12 LEU 53 HD12 LEU 53 -6.887 7.604 -24.879 458 HD13 LEU 53 HD13 LEU 53 -6.679 6.551 -26.278 459 HD21 LEU 53 HD21 LEU 53 -9.983 5.381 -25.404 460 HD22 LEU 53 HD22 LEU 53 -8.704 5.033 -26.568 461 HD23 LEU 53 HD23 LEU 53 -10.111 5.978 -27.059 462 H ALA 54 HN ALA 54 -10.950 10.570 -24.163 463 HA ALA 54 HA ALA 54 -11.941 10.050 -21.569 464 HB1 ALA 54 HB1 ALA 54 -12.072 12.645 -23.094 465 HB2 ALA 54 HB2 ALA 54 -10.645 12.069 -22.231 466 HB3 ALA 54 HB3 ALA 54 -12.127 12.431 -21.344 467 H GLU 55 HN GLU 55 -13.431 11.112 -24.586 468 HA GLU 55 HA GLU 55 -16.069 11.430 -23.560 469 HB2 GLU 55 HB2 GLU 55 -15.309 12.453 -25.689 470 HB3 GLU 55 HB1 GLU 55 -15.195 10.848 -26.400 471 HG2 GLU 55 HG2 GLU 55 -17.593 10.533 -26.115 472 HG3 GLU 55 HG1 GLU 55 -17.722 12.118 -25.355 473 H GLU 56 HN GLU 56 -14.326 8.739 -25.008 474 HA GLU 56 HA GLU 56 -16.489 6.974 -25.291 475 HB2 GLU 56 HB2 GLU 56 -13.550 6.453 -24.805 476 HB3 GLU 56 HB1 GLU 56 -14.711 5.182 -25.157 477 HG2 GLU 56 HG2 GLU 56 -14.011 7.499 -26.963 478 HG3 GLU 56 HG1 GLU 56 -13.474 5.826 -27.149 479 H ASP 57 HN ASP 57 -14.312 7.585 -22.538 480 HA ASP 57 HA ASP 57 -15.968 5.793 -20.925 481 HB2 ASP 57 HB2 ASP 57 -13.274 7.094 -20.392 482 HB3 ASP 57 HB1 ASP 57 -14.177 6.251 -19.135 483 H LYS 58 HN LYS 58 -16.431 8.694 -21.886 484 HA LYS 58 HA LYS 58 -17.494 10.560 -21.180 485 HB2 LYS 58 HB2 LYS 58 -18.713 8.525 -19.324 486 HB3 LYS 58 HB1 LYS 58 -19.333 10.158 -19.534 487 HG2 LYS 58 HG2 LYS 58 -19.709 9.712 -21.913 488 HG3 LYS 58 HG1 LYS 58 -19.093 8.073 -21.696 489 HD2 LYS 58 HD2 LYS 58 -20.903 7.601 -20.115 490 HD3 LYS 58 HD1 LYS 58 -21.518 9.242 -20.328 491 HE2 LYS 58 HE2 LYS 58 -21.905 8.789 -22.700 492 HE3 LYS 58 HE1 LYS 58 -21.283 7.153 -22.493 493 HZ1 LYS 58 HZ1 LYS 58 -23.717 7.252 -22.471 494 HZ2 LYS 58 HZ2 LYS 58 -23.669 8.245 -21.102 495 HZ3 LYS 58 HZ3 LYS 58 -23.098 6.655 -21.014 496 H ILE 59 HN ILE 59 -15.053 10.783 -20.243 497 HA ILE 59 HA ILE 59 -15.114 11.281 -17.372 498 HB ILE 59 HB ILE 59 -12.901 11.738 -19.379 499 HG12 ILE 59 HG12 ILE 59 -13.499 9.375 -19.214 500 HG13 ILE 59 HG11 ILE 59 -11.927 9.665 -18.474 501 HG21 ILE 59 HG21 ILE 59 -13.095 12.840 -16.895 502 HG22 ILE 59 HG22 ILE 59 -11.581 12.505 -17.733 503 HG23 ILE 59 HG23 ILE 59 -12.211 11.352 -16.557 504 HD11 ILE 59 HD11 ILE 59 -14.478 8.819 -17.254 505 HD12 ILE 59 HD12 ILE 59 -13.456 9.900 -16.306 506 HD13 ILE 59 HD13 ILE 59 -12.819 8.356 -16.870 507 H LEU 60 HN LEU 60 -16.106 13.104 -16.743 508 HA LEU 60 HA LEU 60 -15.794 15.519 -18.388 509 HB2 LEU 60 HB2 LEU 60 -17.829 14.900 -16.247 510 HB3 LEU 60 HB1 LEU 60 -17.759 16.381 -17.181 511 HG LEU 60 HG LEU 60 -18.283 13.630 -18.316 512 HD11 LEU 60 HD11 LEU 60 -20.560 14.413 -18.648 513 HD12 LEU 60 HD12 LEU 60 -20.159 15.951 -17.881 514 HD13 LEU 60 HD13 LEU 60 -20.129 14.460 -16.938 515 HD21 LEU 60 HD21 LEU 60 -18.029 16.352 -19.551 516 HD22 LEU 60 HD22 LEU 60 -19.012 15.095 -20.303 517 HD23 LEU 60 HD23 LEU 60 -17.286 14.831 -20.047 518 H ALA 61 HN ALA 61 -14.547 14.147 -15.606 519 HA ALA 61 HA ALA 61 -13.556 16.751 -14.726 520 HB1 ALA 61 HB1 ALA 61 -15.638 15.952 -13.385 521 HB2 ALA 61 HB2 ALA 61 -14.238 16.592 -12.522 522 HB3 ALA 61 HB3 ALA 61 -14.495 14.850 -12.618 523 H THR 62 HN THR 62 -11.522 16.692 -13.824 524 HA THR 62 HA THR 62 -10.220 14.095 -13.489 525 HB THR 62 HB THR 62 -8.181 15.006 -14.582 526 HG1 THR 62 HG1 THR 62 -9.164 17.282 -14.299 527 HG21 THR 62 HG21 THR 62 -8.955 14.859 -16.909 528 HG22 THR 62 HG22 THR 62 -10.626 15.011 -16.356 529 HG23 THR 62 HG23 THR 62 -9.673 13.597 -15.902 530 HA PRO 63 HA PRO 63 -8.111 13.519 -13.079 531 HB2 PRO 63 HB2 PRO 63 -7.080 12.301 -10.912 532 HB3 PRO 63 HB1 PRO 63 -6.199 13.534 -11.822 533 HG2 PRO 63 HG2 PRO 63 -7.676 13.777 -9.241 534 HG3 PRO 63 HG1 PRO 63 -6.135 14.502 -9.735 535 HD2 PRO 63 HD2 PRO 63 -8.533 15.839 -9.735 536 HD3 PRO 63 HD1 PRO 63 -7.160 16.262 -10.776 537 H THR 64 HN THR 64 -8.929 11.462 -13.107 538 HA THR 64 HA THR 64 -11.176 10.901 -11.277 539 HB THR 64 HB THR 64 -11.285 9.435 -13.793 540 HG1 THR 64 HG1 THR 64 -11.833 12.208 -14.038 541 HG21 THR 64 HG21 THR 64 -13.610 10.732 -13.694 542 HG22 THR 64 HG22 THR 64 -13.117 10.952 -12.016 543 HG23 THR 64 HG23 THR 64 -13.274 9.325 -12.683 544 H LEU 65 HN LEU 65 -10.874 9.125 -10.074 545 HA LEU 65 HA LEU 65 -8.774 7.218 -10.884 546 HB2 LEU 65 HB2 LEU 65 -8.527 8.352 -8.688 547 HB3 LEU 65 HB1 LEU 65 -10.057 7.661 -8.185 548 HG LEU 65 HG LEU 65 -9.067 5.390 -8.434 549 HD11 LEU 65 HD11 LEU 65 -6.578 5.268 -8.547 550 HD12 LEU 65 HD12 LEU 65 -6.565 6.975 -8.987 551 HD13 LEU 65 HD13 LEU 65 -7.347 5.798 -10.044 552 HD21 LEU 65 HD21 LEU 65 -7.643 7.294 -6.578 553 HD22 LEU 65 HD22 LEU 65 -7.628 5.536 -6.432 554 HD23 LEU 65 HD23 LEU 65 -9.141 6.423 -6.251 555 H ALA 66 HN ALA 66 -9.519 5.395 -11.812 556 HA ALA 66 HA ALA 66 -11.929 4.158 -10.680 557 HB1 ALA 66 HB1 ALA 66 -13.096 4.005 -12.669 558 HB2 ALA 66 HB2 ALA 66 -11.657 4.251 -13.657 559 HB3 ALA 66 HB3 ALA 66 -12.381 5.612 -12.800 560 H LYS 67 HN LYS 67 -11.885 2.016 -10.581 561 HA LYS 67 HA LYS 67 -9.465 0.689 -11.558 562 HB2 LYS 67 HB2 LYS 67 -9.828 0.356 -9.204 563 HB3 LYS 67 HB1 LYS 67 -11.516 -0.040 -9.461 564 HG2 LYS 67 HG2 LYS 67 -11.005 -2.162 -10.331 565 HG3 LYS 67 HG1 LYS 67 -9.307 -1.751 -10.565 566 HD2 LYS 67 HD2 LYS 67 -9.079 -2.946 -8.650 567 HD3 LYS 67 HD1 LYS 67 -9.472 -1.394 -7.916 568 HE2 LYS 67 HE2 LYS 67 -10.736 -3.348 -6.994 569 HE3 LYS 67 HE1 LYS 67 -11.750 -2.040 -7.593 570 HZ1 LYS 67 HZ1 LYS 67 -12.668 -3.380 -9.093 571 HZ2 LYS 67 HZ2 LYS 67 -11.943 -4.671 -8.276 572 HZ3 LYS 67 HZ3 LYS 67 -11.175 -3.980 -9.614 573 H VAL 68 HN VAL 68 -9.861 0.100 -13.619 574 HA VAL 68 HA VAL 68 -12.407 -0.756 -14.539 575 HB VAL 68 HB VAL 68 -9.698 -0.880 -15.818 576 HG11 VAL 68 HG11 VAL 68 -10.486 -1.987 -17.598 577 HG12 VAL 68 HG12 VAL 68 -11.990 -1.065 -17.605 578 HG13 VAL 68 HG13 VAL 68 -11.818 -2.464 -16.544 579 HG21 VAL 68 HG21 VAL 68 -10.858 0.891 -17.287 580 HG22 VAL 68 HG22 VAL 68 -10.302 1.357 -15.679 581 HG23 VAL 68 HG23 VAL 68 -12.008 1.009 -15.958 582 H LEU 69 HN LEU 69 -9.480 -2.409 -13.479 583 HA LEU 69 HA LEU 69 -11.015 -4.934 -13.658 584 HB2 LEU 69 HB2 LEU 69 -8.095 -4.599 -14.349 585 HB3 LEU 69 HB1 LEU 69 -8.942 -6.130 -14.266 586 HG LEU 69 HG LEU 69 -9.626 -3.918 -16.205 587 HD11 LEU 69 HD11 LEU 69 -7.648 -6.096 -16.305 588 HD12 LEU 69 HD12 LEU 69 -7.699 -4.564 -17.176 589 HD13 LEU 69 HD13 LEU 69 -8.674 -5.925 -17.730 590 HD21 LEU 69 HD21 LEU 69 -10.545 -6.779 -15.967 591 HD22 LEU 69 HD22 LEU 69 -10.877 -5.731 -17.345 592 HD23 LEU 69 HD23 LEU 69 -11.522 -5.326 -15.756 593 HA PRO 70 HA PRO 70 -10.874 -6.991 -13.061 594 HB2 PRO 70 HB2 PRO 70 -12.152 -8.345 -11.116 595 HB3 PRO 70 HB1 PRO 70 -10.454 -8.647 -11.503 596 HG2 PRO 70 HG2 PRO 70 -11.626 -6.982 -9.301 597 HG3 PRO 70 HG1 PRO 70 -10.300 -8.158 -9.224 598 HD2 PRO 70 HD2 PRO 70 -9.881 -5.480 -9.378 599 HD3 PRO 70 HD1 PRO 70 -8.762 -6.668 -10.075 600 HA PRO 71 HA PRO 71 -14.740 -4.821 -13.382 601 HB2 PRO 71 HB2 PRO 71 -15.942 -7.456 -14.041 602 HB3 PRO 71 HB1 PRO 71 -15.952 -5.953 -14.972 603 HG2 PRO 71 HG2 PRO 71 -14.401 -7.970 -15.721 604 HG3 PRO 71 HG1 PRO 71 -13.800 -6.301 -15.797 605 HD2 PRO 71 HD2 PRO 71 -13.251 -8.417 -13.743 606 HD3 PRO 71 HD1 PRO 71 -12.130 -7.274 -14.510 607 HA PRO 72 HA PRO 72 -16.909 -4.244 -13.446 608 HB2 PRO 72 HB2 PRO 72 -18.406 -2.593 -11.967 609 HB3 PRO 72 HB1 PRO 72 -19.016 -4.171 -12.488 610 HG2 PRO 72 HG2 PRO 72 -17.850 -3.372 -9.840 611 HG3 PRO 72 HG1 PRO 72 -19.308 -4.328 -10.173 612 HD2 PRO 72 HD2 PRO 72 -16.903 -5.444 -9.528 613 HD3 PRO 72 HD1 PRO 72 -18.109 -6.255 -10.545 614 H VAL 73 HN VAL 73 -16.637 -1.871 -13.673 615 HA VAL 73 HA VAL 73 -14.085 -1.048 -12.680 616 HB VAL 73 HB VAL 73 -16.157 0.529 -14.233 617 HG11 VAL 73 HG11 VAL 73 -13.207 1.094 -13.968 618 HG12 VAL 73 HG12 VAL 73 -14.458 1.903 -13.020 619 HG13 VAL 73 HG13 VAL 73 -14.426 2.083 -14.773 620 HG21 VAL 73 HG21 VAL 73 -13.909 -0.167 -15.813 621 HG22 VAL 73 HG22 VAL 73 -15.585 -0.680 -16.005 622 HG23 VAL 73 HG23 VAL 73 -14.479 -1.634 -15.015 623 H ARG 74 HN ARG 74 -13.657 0.033 -10.860 624 HA ARG 74 HA ARG 74 -15.888 1.188 -9.323 625 HB2 ARG 74 HB2 ARG 74 -13.056 0.740 -8.382 626 HB3 ARG 74 HB1 ARG 74 -14.473 1.052 -7.395 627 HG2 ARG 74 HG2 ARG 74 -13.981 -1.437 -9.012 628 HG3 ARG 74 HG1 ARG 74 -13.749 -1.271 -7.269 629 HD2 ARG 74 HD2 ARG 74 -16.376 -0.856 -8.697 630 HD3 ARG 74 HD1 ARG 74 -15.901 -2.353 -7.897 631 HE ARG 74 HE ARG 74 -15.634 -0.363 -6.006 632 HH11 ARG 74 HH11 ARG 74 -18.198 -1.675 -7.961 633 HH12 ARG 74 HH12 ARG 74 -19.440 -1.324 -6.806 634 HH21 ARG 74 HH21 ARG 74 -17.255 0.106 -4.472 635 HH22 ARG 74 HH22 ARG 74 -18.902 -0.308 -4.816 636 H ARG 75 HN ARG 75 -16.196 3.327 -9.602 637 HA ARG 75 HA ARG 75 -13.855 4.964 -10.222 638 HB2 ARG 75 HB2 ARG 75 -16.799 5.522 -10.456 639 HB3 ARG 75 HB1 ARG 75 -15.572 6.769 -10.629 640 HG2 ARG 75 HG2 ARG 75 -14.577 5.526 -12.487 641 HG3 ARG 75 HG1 ARG 75 -15.854 4.312 -12.340 642 HD2 ARG 75 HD2 ARG 75 -16.343 7.238 -12.843 643 HD3 ARG 75 HD1 ARG 75 -16.227 6.029 -14.120 644 HE ARG 75 HE ARG 75 -18.139 5.131 -12.320 645 HH11 ARG 75 HH11 ARG 75 -17.678 7.817 -14.485 646 HH12 ARG 75 HH12 ARG 75 -19.370 8.052 -14.771 647 HH21 ARG 75 HH21 ARG 75 -20.371 5.424 -12.683 648 HH22 ARG 75 HH22 ARG 75 -20.907 6.685 -13.741 649 H ILE 76 HN ILE 76 -12.869 5.965 -8.681 650 HA ILE 76 HA ILE 76 -14.294 6.575 -6.181 651 HB ILE 76 HB ILE 76 -11.323 6.369 -6.683 652 HG12 ILE 76 HG12 ILE 76 -13.216 4.452 -5.296 653 HG13 ILE 76 HG11 ILE 76 -12.527 4.219 -6.901 654 HG21 ILE 76 HG21 ILE 76 -12.963 7.058 -4.286 655 HG22 ILE 76 HG22 ILE 76 -11.436 7.745 -4.840 656 HG23 ILE 76 HG23 ILE 76 -11.461 6.160 -4.064 657 HD11 ILE 76 HD11 ILE 76 -11.400 2.927 -5.149 658 HD12 ILE 76 HD12 ILE 76 -10.932 4.443 -4.376 659 HD13 ILE 76 HD13 ILE 76 -10.329 4.053 -5.985 660 H ILE 77 HN ILE 77 -14.898 8.664 -5.986 661 HA ILE 77 HA ILE 77 -13.257 10.713 -7.319 662 HB ILE 77 HB ILE 77 -16.215 10.870 -6.764 663 HG12 ILE 77 HG12 ILE 77 -15.740 10.976 -9.524 664 HG13 ILE 77 HG11 ILE 77 -14.733 9.658 -8.935 665 HG21 ILE 77 HG21 ILE 77 -16.230 12.922 -7.920 666 HG22 ILE 77 HG22 ILE 77 -14.589 12.683 -8.524 667 HG23 ILE 77 HG23 ILE 77 -14.859 13.018 -6.814 668 HD11 ILE 77 HD11 ILE 77 -17.012 8.996 -9.690 669 HD12 ILE 77 HD12 ILE 77 -17.665 9.909 -8.330 670 HD13 ILE 77 HD13 ILE 77 -16.614 8.523 -8.039 671 H GLY 78 HN GLY 78 -12.346 12.201 -6.065 672 HA2 GLY 78 HA2 GLY 78 -13.436 13.576 -3.950 673 HA3 GLY 78 HA1 GLY 78 -12.699 12.150 -3.230 674 H ASP 79 HN ASP 79 -11.373 13.858 -2.149 675 HA ASP 79 HA ASP 79 -9.412 15.221 -3.774 676 HB2 ASP 79 HB2 ASP 79 -10.268 16.210 -1.657 677 HB3 ASP 79 HB1 ASP 79 -9.537 14.882 -0.762 678 H LEU 80 HN LEU 80 -8.038 13.863 -4.783 679 HA LEU 80 HA LEU 80 -7.003 11.531 -3.400 680 HB2 LEU 80 HB2 LEU 80 -6.506 12.537 -6.205 681 HB3 LEU 80 HB1 LEU 80 -5.929 11.012 -5.564 682 HG LEU 80 HG LEU 80 -8.836 11.756 -5.910 683 HD11 LEU 80 HD11 LEU 80 -8.874 10.433 -7.835 684 HD12 LEU 80 HD12 LEU 80 -7.310 9.702 -7.474 685 HD13 LEU 80 HD13 LEU 80 -7.399 11.386 -7.994 686 HD21 LEU 80 HD21 LEU 80 -7.443 9.302 -4.888 687 HD22 LEU 80 HD22 LEU 80 -9.064 9.227 -5.578 688 HD23 LEU 80 HD23 LEU 80 -8.758 10.217 -4.150 689 H SER 81 HN SER 81 -6.097 14.726 -3.533 690 HA SER 81 HA SER 81 -3.285 14.478 -3.857 691 HB2 SER 81 HB2 SER 81 -4.917 16.599 -2.429 692 HB3 SER 81 HB1 SER 81 -3.193 16.730 -2.781 693 HG SER 81 HG SER 81 -3.792 17.472 -4.646 694 H ASN 82 HN ASN 82 -5.440 13.767 -1.311 695 HA ASN 82 HA ASN 82 -3.439 13.775 0.779 696 HB2 ASN 82 HB2 ASN 82 -5.758 14.364 1.319 697 HB3 ASN 82 HB1 ASN 82 -6.293 12.786 0.757 698 HD21 ASN 82 HD21 ASN 82 -4.470 14.472 3.222 699 HD22 ASN 82 HD22 ASN 82 -4.564 13.222 4.410 700 H ARG 83 HN ARG 83 -2.010 12.190 0.937 701 HA ARG 83 HA ARG 83 -2.096 9.864 -0.584 702 HB2 ARG 83 HB2 ARG 83 -0.447 10.550 1.853 703 HB3 ARG 83 HB1 ARG 83 -0.221 9.058 0.952 704 HG2 ARG 83 HG2 ARG 83 0.192 10.464 -1.086 705 HG3 ARG 83 HG1 ARG 83 0.199 11.871 -0.023 706 HD2 ARG 83 HD2 ARG 83 2.017 9.482 0.262 707 HD3 ARG 83 HD1 ARG 83 2.467 11.000 -0.512 708 HE ARG 83 HE ARG 83 2.152 10.506 2.333 709 HH11 ARG 83 HH11 ARG 83 2.528 12.856 -0.215 710 HH12 ARG 83 HH12 ARG 83 3.096 14.105 0.842 711 HH21 ARG 83 HH21 ARG 83 2.898 12.140 3.734 712 HH22 ARG 83 HH22 ARG 83 3.309 13.697 3.092 713 H GLU 84 HN GLU 84 -3.156 10.369 2.748 714 HA GLU 84 HA GLU 84 -3.515 7.664 3.451 715 HB2 GLU 84 HB2 GLU 84 -4.841 10.187 4.391 716 HB3 GLU 84 HB1 GLU 84 -5.266 8.605 5.034 717 HG2 GLU 84 HG2 GLU 84 -3.083 8.256 5.869 718 HG3 GLU 84 HG1 GLU 84 -2.459 9.672 5.022 719 H LYS 85 HN LYS 85 -5.828 9.920 1.865 720 HA LYS 85 HA LYS 85 -7.905 7.991 1.850 721 HB2 LYS 85 HB2 LYS 85 -7.417 10.398 0.077 722 HB3 LYS 85 HB1 LYS 85 -8.837 9.376 -0.094 723 HG2 LYS 85 HG2 LYS 85 -9.494 9.932 2.203 724 HG3 LYS 85 HG1 LYS 85 -8.088 10.992 2.334 725 HD2 LYS 85 HD2 LYS 85 -9.791 12.469 1.737 726 HD3 LYS 85 HD1 LYS 85 -9.029 12.098 0.182 727 HE2 LYS 85 HE2 LYS 85 -11.422 11.996 -0.067 728 HE3 LYS 85 HE1 LYS 85 -10.753 10.371 -0.208 729 HZ1 LYS 85 HZ1 LYS 85 -11.943 9.695 1.521 730 HZ2 LYS 85 HZ2 LYS 85 -12.782 11.161 1.453 731 HZ3 LYS 85 HZ3 LYS 85 -11.451 10.997 2.484 732 H VAL 86 HN VAL 86 -5.375 8.720 -0.483 733 HA VAL 86 HA VAL 86 -6.236 6.911 -2.461 734 HB VAL 86 HB VAL 86 -3.469 7.972 -1.836 735 HG11 VAL 86 HG11 VAL 86 -2.827 6.159 -3.055 736 HG12 VAL 86 HG12 VAL 86 -3.248 7.239 -4.384 737 HG13 VAL 86 HG13 VAL 86 -4.390 6.002 -3.856 738 HG21 VAL 86 HG21 VAL 86 -4.321 8.950 -4.260 739 HG22 VAL 86 HG22 VAL 86 -4.391 9.808 -2.720 740 HG23 VAL 86 HG23 VAL 86 -5.801 8.926 -3.305 741 H LEU 87 HN LEU 87 -4.047 6.505 0.304 742 HA LEU 87 HA LEU 87 -3.392 3.785 -0.243 743 HB2 LEU 87 HB2 LEU 87 -2.797 5.765 1.758 744 HB3 LEU 87 HB1 LEU 87 -3.238 4.262 2.543 745 HG LEU 87 HG LEU 87 -1.107 4.438 0.423 746 HD11 LEU 87 HD11 LEU 87 -1.025 5.512 3.027 747 HD12 LEU 87 HD12 LEU 87 0.317 5.284 1.903 748 HD13 LEU 87 HD13 LEU 87 -0.086 4.019 3.064 749 HD21 LEU 87 HD21 LEU 87 -2.426 2.258 1.374 750 HD22 LEU 87 HD22 LEU 87 -1.067 2.354 2.497 751 HD23 LEU 87 HD23 LEU 87 -0.770 2.235 0.763 752 H ILE 88 HN ILE 88 -5.769 5.274 1.930 753 HA ILE 88 HA ILE 88 -6.713 2.870 3.036 754 HB ILE 88 HB ILE 88 -7.982 5.581 2.743 755 HG12 ILE 88 HG12 ILE 88 -7.027 4.124 5.209 756 HG13 ILE 88 HG11 ILE 88 -5.965 5.133 4.236 757 HG21 ILE 88 HG21 ILE 88 -9.595 4.696 4.523 758 HG22 ILE 88 HG22 ILE 88 -9.113 3.088 3.980 759 HG23 ILE 88 HG23 ILE 88 -9.879 4.207 2.850 760 HD11 ILE 88 HD11 ILE 88 -7.902 5.873 6.240 761 HD12 ILE 88 HD12 ILE 88 -8.146 6.747 4.728 762 HD13 ILE 88 HD13 ILE 88 -6.578 6.808 5.540 763 H ALA 89 HN ALA 89 -7.893 4.742 0.233 764 HA ALA 89 HA ALA 89 -10.049 3.011 -0.369 765 HB1 ALA 89 HB1 ALA 89 -10.471 4.421 -2.066 766 HB2 ALA 89 HB2 ALA 89 -8.813 4.358 -2.664 767 HB3 ALA 89 HB3 ALA 89 -9.227 5.422 -1.318 768 H LEU 90 HN LEU 90 -6.675 3.024 -1.484 769 HA LEU 90 HA LEU 90 -7.006 0.885 -3.327 770 HB2 LEU 90 HB2 LEU 90 -4.557 1.962 -1.938 771 HB3 LEU 90 HB1 LEU 90 -4.492 0.659 -3.108 772 HG LEU 90 HG LEU 90 -5.549 3.420 -3.712 773 HD11 LEU 90 HD11 LEU 90 -3.233 3.107 -5.131 774 HD12 LEU 90 HD12 LEU 90 -2.829 2.355 -3.586 775 HD13 LEU 90 HD13 LEU 90 -3.398 4.025 -3.635 776 HD21 LEU 90 HD21 LEU 90 -4.902 2.429 -6.082 777 HD22 LEU 90 HD22 LEU 90 -6.484 2.140 -5.356 778 HD23 LEU 90 HD23 LEU 90 -5.231 0.903 -5.261 779 H ARG 91 HN ARG 91 -6.218 1.033 0.109 780 HA ARG 91 HA ARG 91 -5.417 -1.660 0.465 781 HB2 ARG 91 HB2 ARG 91 -4.999 0.139 2.107 782 HB3 ARG 91 HB1 ARG 91 -6.726 0.237 2.425 783 HG2 ARG 91 HG2 ARG 91 -6.722 -2.022 3.306 784 HG3 ARG 91 HG1 ARG 91 -5.007 -2.186 2.924 785 HD2 ARG 91 HD2 ARG 91 -5.254 -1.686 5.268 786 HD3 ARG 91 HD1 ARG 91 -4.528 -0.303 4.452 787 HE ARG 91 HE ARG 91 -7.340 -0.013 4.584 788 HH11 ARG 91 HH11 ARG 91 -4.471 0.161 6.547 789 HH12 ARG 91 HH12 ARG 91 -5.145 1.298 7.667 790 HH21 ARG 91 HH21 ARG 91 -8.245 1.481 6.048 791 HH22 ARG 91 HH22 ARG 91 -7.298 2.050 7.382 792 H LEU 92 HN LEU 92 -8.569 -0.044 0.836 793 HA LEU 92 HA LEU 92 -9.986 -2.357 1.608 794 HB2 LEU 92 HB2 LEU 92 -10.674 0.373 0.724 795 HB3 LEU 92 HB1 LEU 92 -11.912 -0.837 0.449 796 HG LEU 92 HG LEU 92 -12.043 -1.346 2.795 797 HD11 LEU 92 HD11 LEU 92 -9.844 -1.246 3.585 798 HD12 LEU 92 HD12 LEU 92 -10.666 0.087 4.400 799 HD13 LEU 92 HD13 LEU 92 -9.620 0.411 3.017 800 HD21 LEU 92 HD21 LEU 92 -11.920 1.651 2.550 801 HD22 LEU 92 HD22 LEU 92 -12.937 0.691 3.625 802 HD23 LEU 92 HD23 LEU 92 -13.227 0.669 1.887 803 H LEU 93 HN LEU 93 -9.340 -0.946 -1.567 804 HA LEU 93 HA LEU 93 -11.069 -2.652 -3.028 805 HB2 LEU 93 HB2 LEU 93 -8.574 -1.171 -3.847 806 HB3 LEU 93 HB1 LEU 93 -9.557 -2.088 -4.972 807 HG LEU 93 HG LEU 93 -10.565 0.255 -3.356 808 HD11 LEU 93 HD11 LEU 93 -8.974 0.151 -5.761 809 HD12 LEU 93 HD12 LEU 93 -9.475 1.542 -4.800 810 HD13 LEU 93 HD13 LEU 93 -10.538 0.911 -6.058 811 HD21 LEU 93 HD21 LEU 93 -12.581 -0.401 -4.015 812 HD22 LEU 93 HD22 LEU 93 -11.882 -1.777 -4.869 813 HD23 LEU 93 HD23 LEU 93 -12.072 -0.231 -5.696 814 H ALA 94 HN ALA 94 -7.678 -2.883 -2.074 815 HA ALA 94 HA ALA 94 -7.060 -5.233 -3.486 816 HB1 ALA 94 HB1 ALA 94 -5.487 -3.546 -2.325 817 HB2 ALA 94 HB2 ALA 94 -5.035 -5.250 -2.356 818 HB3 ALA 94 HB3 ALA 94 -5.732 -4.550 -0.895 819 H GLU 95 HN GLU 95 -8.415 -4.729 -0.258 820 HA GLU 95 HA GLU 95 -8.213 -7.382 0.635 821 HB2 GLU 95 HB2 GLU 95 -10.116 -5.140 1.326 822 HB3 GLU 95 HB1 GLU 95 -10.142 -6.694 2.147 823 HG2 GLU 95 HG2 GLU 95 -7.931 -6.359 2.993 824 HG3 GLU 95 HG1 GLU 95 -7.722 -4.912 2.009 825 H GLU 96 HN GLU 96 -10.624 -5.679 -1.269 826 HA GLU 96 HA GLU 96 -12.607 -7.676 -1.334 827 HB2 GLU 96 HB2 GLU 96 -11.879 -5.491 -3.298 828 HB3 GLU 96 HB1 GLU 96 -13.297 -6.519 -3.481 829 HG2 GLU 96 HG2 GLU 96 -12.747 -4.661 -1.174 830 HG3 GLU 96 HG1 GLU 96 -13.883 -4.380 -2.492 831 H ILE 97 HN ILE 97 -9.796 -7.050 -3.362 832 HA ILE 97 HA ILE 97 -10.306 -9.058 -5.301 833 HB ILE 97 HB ILE 97 -7.719 -7.704 -4.513 834 HG12 ILE 97 HG12 ILE 97 -9.563 -7.166 -6.841 835 HG13 ILE 97 HG11 ILE 97 -9.640 -6.289 -5.314 836 HG21 ILE 97 HG21 ILE 97 -7.339 -9.838 -5.712 837 HG22 ILE 97 HG22 ILE 97 -6.833 -8.435 -6.654 838 HG23 ILE 97 HG23 ILE 97 -8.351 -9.250 -7.030 839 HD11 ILE 97 HD11 ILE 97 -7.036 -6.420 -6.692 840 HD12 ILE 97 HD12 ILE 97 -7.753 -5.138 -5.714 841 HD13 ILE 97 HD13 ILE 97 -8.294 -5.388 -7.374 842 H GLY 98 HN GLY 98 -8.300 -8.959 -2.371 843 HA2 GLY 98 HA2 GLY 98 -7.209 -11.558 -2.612 844 HA3 GLY 98 HA1 GLY 98 -7.316 -10.626 -1.127 845 H ASP 99 HN ASP 99 -10.286 -10.444 -1.488 846 HA ASP 99 HA ASP 99 -11.045 -12.615 0.126 847 HB2 ASP 99 HB2 ASP 99 -12.259 -10.451 0.024 848 HB3 ASP 99 HB1 ASP 99 -12.830 -10.870 -1.588 849 H TYR 100 HN TYR 100 -11.233 -12.118 -3.359 850 HA TYR 100 HA TYR 100 -12.649 -14.615 -3.759 851 HB2 TYR 100 HB2 TYR 100 -11.576 -12.542 -5.683 852 HB3 TYR 100 HB1 TYR 100 -12.379 -14.021 -6.201 853 HD1 TYR 100 HD1 TYR 100 -12.833 -10.714 -4.715 854 HD2 TYR 100 HD2 TYR 100 -14.779 -14.332 -5.824 855 HE1 TYR 100 HE1 TYR 100 -15.014 -9.597 -4.514 856 HE2 TYR 100 HE2 TYR 100 -16.965 -13.224 -5.625 857 HH TYR 100 HH TYR 100 -17.605 -10.695 -4.021 858 H LYS 101 HN LYS 101 -11.497 -16.401 -3.498 859 HA LYS 101 HA LYS 101 -8.678 -16.503 -4.130 860 HB2 LYS 101 HB2 LYS 101 -10.545 -18.674 -3.152 861 HB3 LYS 101 HB1 LYS 101 -8.797 -18.813 -3.275 862 HG2 LYS 101 HG2 LYS 101 -10.240 -16.838 -1.514 863 HG3 LYS 101 HG1 LYS 101 -9.590 -18.388 -0.977 864 HD2 LYS 101 HD2 LYS 101 -7.339 -17.653 -1.676 865 HD3 LYS 101 HD1 LYS 101 -8.013 -16.088 -2.136 866 HE2 LYS 101 HE2 LYS 101 -6.992 -15.952 0.060 867 HE3 LYS 101 HE1 LYS 101 -8.737 -15.730 0.180 868 HZ1 LYS 101 HZ1 LYS 101 -7.356 -17.392 1.728 869 HZ2 LYS 101 HZ2 LYS 101 -7.787 -18.456 0.487 870 HZ3 LYS 101 HZ3 LYS 101 -8.987 -17.624 1.340 871 H ASP 102 HN ASP 102 -7.714 -17.697 -5.737 872 HA ASP 102 HA ASP 102 -9.228 -19.369 -7.519 873 HB2 ASP 102 HB2 ASP 102 -9.527 -16.833 -8.207 874 HB3 ASP 102 HB1 ASP 102 -7.917 -17.047 -8.887 875 H ASP 103 HN ASP 103 -7.804 -20.335 -9.198 876 HA ASP 103 HA ASP 103 -5.158 -20.778 -8.066 877 HB2 ASP 103 HB2 ASP 103 -6.579 -22.686 -8.835 878 HB3 ASP 103 HB1 ASP 103 -6.443 -22.079 -10.481 879 H ASP 104 HN ASP 104 -3.703 -19.274 -8.565 880 HA ASP 104 HA ASP 104 -3.724 -17.692 -10.913 881 HB2 ASP 104 HB2 ASP 104 -2.666 -17.048 -8.729 882 HB3 ASP 104 HB1 ASP 104 -1.370 -18.185 -9.083 883 H ASP 105 HN ASP 105 -2.263 -20.765 -10.152 884 HA ASP 105 HA ASP 105 -0.527 -20.696 -12.484 885 HB2 ASP 105 HB2 ASP 105 0.216 -21.778 -10.367 886 HB3 ASP 105 HB1 ASP 105 -1.066 -22.970 -10.559 887 H LYS 106 HN LYS 106 -1.631 -20.830 -14.357 888 HA LYS 106 HA LYS 106 -3.757 -22.842 -14.594 889 HB2 LYS 106 HB2 LYS 106 -3.043 -20.534 -16.418 890 HB3 LYS 106 HB1 LYS 106 -4.375 -21.653 -16.673 891 HG2 LYS 106 HG2 LYS 106 -5.360 -20.897 -14.526 892 HG3 LYS 106 HG1 LYS 106 -4.073 -19.695 -14.405 893 HD2 LYS 106 HD2 LYS 106 -5.979 -19.886 -16.733 894 HD3 LYS 106 HD1 LYS 106 -6.234 -18.835 -15.340 895 HE2 LYS 106 HE2 LYS 106 -4.080 -17.730 -15.818 896 HE3 LYS 106 HE1 LYS 106 -3.898 -18.745 -17.248 897 HZ1 LYS 106 HZ1 LYS 106 -5.990 -16.699 -16.756 898 HZ2 LYS 106 HZ2 LYS 106 -6.027 -17.782 -18.055 899 HZ3 LYS 106 HZ3 LYS 106 -4.769 -16.657 -17.928 Start of MODEL 14 1 H1 MET 1 HT1 MET 1 -19.134 -16.755 -16.980 2 H2 MET 1 HT2 MET 1 -18.663 -15.157 -17.266 3 H3 MET 1 HT3 MET 1 -17.765 -16.128 -16.209 4 HA MET 1 HA MET 1 -17.187 -17.603 -18.049 5 HB2 MET 1 HB2 MET 1 -18.689 -15.506 -19.621 6 HB3 MET 1 HB1 MET 1 -17.570 -16.642 -20.361 7 HG2 MET 1 HG2 MET 1 -18.967 -18.494 -19.429 8 HG3 MET 1 HG1 MET 1 -20.137 -17.275 -18.928 9 HE1 MET 1 HE1 MET 1 -21.774 -16.038 -22.070 10 HE2 MET 1 HE2 MET 1 -20.342 -15.195 -21.481 11 HE3 MET 1 HE3 MET 1 -21.499 -15.872 -20.336 12 H ALA 2 HN ALA 2 -16.841 -14.569 -16.836 13 HA ALA 2 HA ALA 2 -14.390 -14.014 -18.364 14 HB1 ALA 2 HB1 ALA 2 -14.656 -11.769 -17.955 15 HB2 ALA 2 HB2 ALA 2 -15.559 -12.035 -16.464 16 HB3 ALA 2 HB3 ALA 2 -16.340 -12.291 -18.026 17 HA PRO 3 HA PRO 3 -12.363 -15.511 -14.634 18 HB2 PRO 3 HB2 PRO 3 -9.866 -15.552 -15.633 19 HB3 PRO 3 HB1 PRO 3 -11.064 -16.792 -16.029 20 HG2 PRO 3 HG2 PRO 3 -10.264 -14.372 -17.593 21 HG3 PRO 3 HG1 PRO 3 -10.488 -16.036 -18.158 22 HD2 PRO 3 HD2 PRO 3 -12.376 -14.134 -18.485 23 HD3 PRO 3 HD1 PRO 3 -12.792 -15.838 -18.209 24 H LEU 4 HN LEU 4 -10.925 -14.647 -13.077 25 HA LEU 4 HA LEU 4 -10.482 -11.758 -13.398 26 HB2 LEU 4 HB2 LEU 4 -10.671 -13.365 -10.847 27 HB3 LEU 4 HB1 LEU 4 -10.513 -11.624 -10.962 28 HG LEU 4 HG LEU 4 -12.889 -13.249 -11.873 29 HD11 LEU 4 HD11 LEU 4 -12.642 -13.060 -9.431 30 HD12 LEU 4 HD12 LEU 4 -14.064 -12.212 -10.040 31 HD13 LEU 4 HD13 LEU 4 -12.623 -11.303 -9.587 32 HD21 LEU 4 HD21 LEU 4 -13.824 -10.782 -11.919 33 HD22 LEU 4 HD22 LEU 4 -13.007 -11.487 -13.317 34 HD23 LEU 4 HD23 LEU 4 -12.132 -10.396 -12.239 35 H ARG 5 HN ARG 5 -8.487 -10.886 -13.091 36 HA ARG 5 HA ARG 5 -6.264 -12.773 -12.926 37 HB2 ARG 5 HB2 ARG 5 -6.630 -10.037 -14.035 38 HB3 ARG 5 HB1 ARG 5 -5.032 -10.448 -13.431 39 HG2 ARG 5 HG2 ARG 5 -4.899 -10.998 -15.672 40 HG3 ARG 5 HG1 ARG 5 -5.259 -12.550 -14.913 41 HD2 ARG 5 HD2 ARG 5 -6.676 -12.404 -16.795 42 HD3 ARG 5 HD1 ARG 5 -7.695 -12.071 -15.394 43 HE ARG 5 HE ARG 5 -6.648 -9.676 -16.524 44 HH11 ARG 5 HH11 ARG 5 -9.109 -12.107 -16.920 45 HH12 ARG 5 HH12 ARG 5 -10.181 -11.069 -17.798 46 HH21 ARG 5 HH21 ARG 5 -8.047 -8.296 -17.679 47 HH22 ARG 5 HH22 ARG 5 -9.574 -8.895 -18.232 48 H LYS 6 HN LYS 6 -4.487 -12.429 -11.511 49 HA LYS 6 HA LYS 6 -5.206 -11.661 -8.891 50 HB2 LYS 6 HB2 LYS 6 -2.470 -12.158 -10.072 51 HB3 LYS 6 HB1 LYS 6 -2.809 -12.003 -8.353 52 HG2 LYS 6 HG2 LYS 6 -3.940 -14.134 -10.161 53 HG3 LYS 6 HG1 LYS 6 -2.573 -14.342 -9.066 54 HD2 LYS 6 HD2 LYS 6 -4.052 -13.783 -7.167 55 HD3 LYS 6 HD1 LYS 6 -5.413 -13.676 -8.288 56 HE2 LYS 6 HE2 LYS 6 -3.717 -16.127 -7.819 57 HE3 LYS 6 HE1 LYS 6 -5.321 -15.849 -7.139 58 HZ1 LYS 6 HZ1 LYS 6 -5.454 -17.245 -9.096 59 HZ2 LYS 6 HZ2 LYS 6 -4.664 -16.074 -10.027 60 HZ3 LYS 6 HZ3 LYS 6 -6.202 -15.755 -9.403 61 H THR 7 HN THR 7 -3.404 -10.078 -11.431 62 HA THR 7 HA THR 7 -2.884 -7.762 -9.756 63 HB THR 7 HB THR 7 -1.999 -6.917 -12.111 64 HG1 THR 7 HG1 THR 7 -2.641 -8.632 -13.371 65 HG21 THR 7 HG21 THR 7 -0.151 -7.044 -10.877 66 HG22 THR 7 HG22 THR 7 0.021 -8.720 -11.406 67 HG23 THR 7 HG23 THR 7 -0.827 -8.351 -9.902 68 H ALA 8 HN ALA 8 -4.215 -6.137 -9.609 69 HA ALA 8 HA ALA 8 -6.466 -5.898 -11.430 70 HB1 ALA 8 HB1 ALA 8 -7.458 -4.522 -9.829 71 HB2 ALA 8 HB2 ALA 8 -5.909 -4.093 -9.105 72 HB3 ALA 8 HB3 ALA 8 -6.571 -5.712 -8.873 73 H VAL 9 HN VAL 9 -7.024 -3.948 -12.496 74 HA VAL 9 HA VAL 9 -4.663 -2.318 -13.151 75 HB VAL 9 HB VAL 9 -7.111 -2.836 -14.845 76 HG11 VAL 9 HG11 VAL 9 -6.476 -0.742 -15.565 77 HG12 VAL 9 HG12 VAL 9 -5.460 -1.752 -16.592 78 HG13 VAL 9 HG13 VAL 9 -4.779 -0.994 -15.153 79 HG21 VAL 9 HG21 VAL 9 -4.386 -3.630 -15.700 80 HG22 VAL 9 HG22 VAL 9 -5.942 -4.396 -16.018 81 HG23 VAL 9 HG23 VAL 9 -5.162 -4.604 -14.450 82 H LEU 10 HN LEU 10 -4.707 -0.317 -12.489 83 HA LEU 10 HA LEU 10 -7.288 0.905 -11.745 84 HB2 LEU 10 HB2 LEU 10 -5.079 0.471 -10.167 85 HB3 LEU 10 HB1 LEU 10 -4.800 2.109 -10.713 86 HG LEU 10 HG LEU 10 -5.866 2.184 -8.568 87 HD11 LEU 10 HD11 LEU 10 -6.606 3.985 -9.798 88 HD12 LEU 10 HD12 LEU 10 -8.109 3.260 -9.216 89 HD13 LEU 10 HD13 LEU 10 -7.582 2.985 -10.878 90 HD21 LEU 10 HD21 LEU 10 -8.261 1.266 -8.404 91 HD22 LEU 10 HD22 LEU 10 -6.911 0.137 -8.264 92 HD23 LEU 10 HD23 LEU 10 -7.809 0.255 -9.778 93 H LYS 11 HN LYS 11 -7.856 2.772 -12.886 94 HA LYS 11 HA LYS 11 -5.732 3.822 -14.631 95 HB2 LYS 11 HB2 LYS 11 -8.685 3.570 -15.214 96 HB3 LYS 11 HB1 LYS 11 -7.594 4.569 -16.168 97 HG2 LYS 11 HG2 LYS 11 -6.270 2.576 -16.709 98 HG3 LYS 11 HG1 LYS 11 -7.411 1.587 -15.800 99 HD2 LYS 11 HD2 LYS 11 -9.210 2.255 -17.303 100 HD3 LYS 11 HD1 LYS 11 -8.092 3.289 -18.196 101 HE2 LYS 11 HE2 LYS 11 -6.770 1.329 -18.814 102 HE3 LYS 11 HE1 LYS 11 -7.877 0.294 -17.914 103 HZ1 LYS 11 HZ1 LYS 11 -9.253 0.231 -19.635 104 HZ2 LYS 11 HZ2 LYS 11 -8.080 1.024 -20.558 105 HZ3 LYS 11 HZ3 LYS 11 -9.283 1.917 -19.774 106 H LEU 12 HN LEU 12 -5.295 5.895 -14.540 107 HA LEU 12 HA LEU 12 -7.001 7.558 -12.812 108 HB2 LEU 12 HB2 LEU 12 -4.340 7.049 -12.543 109 HB3 LEU 12 HB1 LEU 12 -4.287 8.509 -13.506 110 HG LEU 12 HG LEU 12 -5.391 8.151 -10.730 111 HD11 LEU 12 HD11 LEU 12 -3.621 10.381 -11.540 112 HD12 LEU 12 HD12 LEU 12 -2.913 8.767 -11.478 113 HD13 LEU 12 HD13 LEU 12 -3.670 9.455 -10.041 114 HD21 LEU 12 HD21 LEU 12 -5.902 10.686 -11.017 115 HD22 LEU 12 HD22 LEU 12 -7.075 9.488 -11.563 116 HD23 LEU 12 HD23 LEU 12 -6.015 10.280 -12.730 117 H TYR 13 HN TYR 13 -8.106 9.217 -13.868 118 HA TYR 13 HA TYR 13 -7.286 9.815 -16.620 119 HB2 TYR 13 HB2 TYR 13 -9.828 10.435 -15.098 120 HB3 TYR 13 HB1 TYR 13 -9.522 10.861 -16.778 121 HD1 TYR 13 HD1 TYR 13 -10.381 8.170 -14.471 122 HD2 TYR 13 HD2 TYR 13 -9.423 9.114 -18.508 123 HE1 TYR 13 HE1 TYR 13 -11.238 5.978 -15.181 124 HE2 TYR 13 HE2 TYR 13 -10.280 6.925 -19.228 125 HH TYR 13 HH TYR 13 -11.343 5.060 -18.607 126 H VAL 14 HN VAL 14 -6.078 11.602 -16.898 127 HA VAL 14 HA VAL 14 -6.382 13.793 -14.945 128 HB VAL 14 HB VAL 14 -3.990 14.284 -15.195 129 HG11 VAL 14 HG11 VAL 14 -4.587 13.007 -13.286 130 HG12 VAL 14 HG12 VAL 14 -3.137 12.263 -13.963 131 HG13 VAL 14 HG13 VAL 14 -4.716 11.525 -14.235 132 HG21 VAL 14 HG21 VAL 14 -2.477 12.849 -16.328 133 HG22 VAL 14 HG22 VAL 14 -3.788 13.189 -17.458 134 HG23 VAL 14 HG23 VAL 14 -3.730 11.641 -16.614 135 H ALA 15 HN ALA 15 -5.715 15.897 -15.755 136 HA ALA 15 HA ALA 15 -6.128 16.134 -18.659 137 HB1 ALA 15 HB1 ALA 15 -7.748 17.187 -16.639 138 HB2 ALA 15 HB2 ALA 15 -7.771 17.624 -18.348 139 HB3 ALA 15 HB3 ALA 15 -6.789 18.552 -17.215 140 H GLY 16 HN GLY 16 -4.147 16.427 -19.450 141 HA2 GLY 16 HA2 GLY 16 -2.129 17.425 -19.877 142 HA3 GLY 16 HA1 GLY 16 -2.767 18.846 -19.063 143 H ASN 17 HN ASN 17 -1.307 19.493 -17.618 144 HA ASN 17 HA ASN 17 -0.343 17.514 -15.683 145 HB2 ASN 17 HB2 ASN 17 1.283 18.828 -17.647 146 HB3 ASN 17 HB1 ASN 17 1.746 19.399 -16.045 147 HD21 ASN 17 HD21 ASN 17 0.543 16.234 -17.085 148 HD22 ASN 17 HD22 ASN 17 1.937 15.349 -16.569 149 H THR 18 HN THR 18 -2.410 18.982 -15.041 150 HA THR 18 HA THR 18 -1.727 21.509 -13.867 151 HB THR 18 HB THR 18 -3.966 21.439 -12.864 152 HG1 THR 18 HG1 THR 18 -5.292 19.560 -13.364 153 HG21 THR 18 HG21 THR 18 -5.153 21.740 -14.818 154 HG22 THR 18 HG22 THR 18 -4.381 20.373 -15.624 155 HG23 THR 18 HG23 THR 18 -3.494 21.881 -15.398 156 HA PRO 19 HA PRO 19 -0.095 20.363 -9.955 157 HB2 PRO 19 HB2 PRO 19 -2.288 21.979 -8.705 158 HB3 PRO 19 HB1 PRO 19 -0.544 22.042 -8.419 159 HG2 PRO 19 HG2 PRO 19 -1.677 23.916 -9.890 160 HG3 PRO 19 HG1 PRO 19 -0.134 23.206 -10.409 161 HD2 PRO 19 HD2 PRO 19 -2.901 22.668 -11.425 162 HD3 PRO 19 HD1 PRO 19 -1.381 22.844 -12.328 163 H ASN 20 HN ASN 20 -3.626 20.204 -10.177 164 HA ASN 20 HA ASN 20 -3.990 18.406 -7.999 165 HB2 ASN 20 HB2 ASN 20 -5.758 18.821 -10.439 166 HB3 ASN 20 HB1 ASN 20 -6.206 17.913 -9.001 167 HD21 ASN 20 HD21 ASN 20 -5.758 19.239 -6.908 168 HD22 ASN 20 HD22 ASN 20 -6.390 20.845 -6.931 169 H SER 21 HN SER 21 -3.703 17.924 -11.517 170 HA SER 21 HA SER 21 -3.847 15.086 -11.505 171 HB2 SER 21 HB2 SER 21 -2.580 16.994 -13.484 172 HB3 SER 21 HB1 SER 21 -2.854 15.276 -13.773 173 HG SER 21 HG SER 21 -4.640 17.389 -13.776 174 H VAL 22 HN VAL 22 -1.076 17.302 -11.431 175 HA VAL 22 HA VAL 22 0.849 15.236 -11.499 176 HB VAL 22 HB VAL 22 1.021 18.082 -10.477 177 HG11 VAL 22 HG11 VAL 22 2.759 17.177 -9.289 178 HG12 VAL 22 HG12 VAL 22 3.568 17.593 -10.802 179 HG13 VAL 22 HG13 VAL 22 3.081 15.927 -10.492 180 HG21 VAL 22 HG21 VAL 22 0.724 18.070 -12.814 181 HG22 VAL 22 HG22 VAL 22 1.844 16.724 -13.030 182 HG23 VAL 22 HG23 VAL 22 2.453 18.311 -12.557 183 H ARG 23 HN ARG 23 -0.641 16.992 -8.810 184 HA ARG 23 HA ARG 23 0.803 15.789 -6.709 185 HB2 ARG 23 HB2 ARG 23 -0.703 17.838 -6.647 186 HB3 ARG 23 HB1 ARG 23 -2.059 16.711 -6.605 187 HG2 ARG 23 HG2 ARG 23 -1.602 16.005 -4.490 188 HG3 ARG 23 HG1 ARG 23 0.100 16.465 -4.572 189 HD2 ARG 23 HD2 ARG 23 -0.567 18.835 -4.542 190 HD3 ARG 23 HD1 ARG 23 -2.255 18.347 -4.424 191 HE ARG 23 HE ARG 23 -1.942 17.897 -2.195 192 HH11 ARG 23 HH11 ARG 23 1.156 18.328 -3.730 193 HH12 ARG 23 HH12 ARG 23 2.039 18.351 -2.239 194 HH21 ARG 23 HH21 ARG 23 -0.795 17.930 -0.228 195 HH22 ARG 23 HH22 ARG 23 0.925 18.123 -0.244 196 H ALA 24 HN ALA 24 -2.323 15.003 -8.190 197 HA ALA 24 HA ALA 24 -2.914 12.814 -6.536 198 HB1 ALA 24 HB1 ALA 24 -4.223 14.149 -8.546 199 HB2 ALA 24 HB2 ALA 24 -4.814 12.717 -7.704 200 HB3 ALA 24 HB3 ALA 24 -3.962 12.547 -9.238 201 H LEU 25 HN LEU 25 -1.303 13.032 -9.669 202 HA LEU 25 HA LEU 25 -0.968 10.288 -10.168 203 HB2 LEU 25 HB2 LEU 25 -0.676 11.972 -11.894 204 HB3 LEU 25 HB1 LEU 25 0.696 12.649 -11.039 205 HG LEU 25 HG LEU 25 1.963 10.577 -11.438 206 HD11 LEU 25 HD11 LEU 25 0.938 9.081 -13.281 207 HD12 LEU 25 HD12 LEU 25 -0.601 9.744 -12.736 208 HD13 LEU 25 HD13 LEU 25 0.421 8.853 -11.610 209 HD21 LEU 25 HD21 LEU 25 2.161 12.441 -12.993 210 HD22 LEU 25 HD22 LEU 25 0.797 11.821 -13.925 211 HD23 LEU 25 HD23 LEU 25 2.298 10.899 -13.838 212 H LYS 26 HN LYS 26 1.248 12.591 -8.574 213 HA LYS 26 HA LYS 26 3.319 10.718 -8.157 214 HB2 LYS 26 HB2 LYS 26 2.594 13.246 -6.678 215 HB3 LYS 26 HB1 LYS 26 4.024 12.297 -6.306 216 HG2 LYS 26 HG2 LYS 26 4.742 12.607 -8.684 217 HG3 LYS 26 HG1 LYS 26 3.396 13.733 -8.872 218 HD2 LYS 26 HD2 LYS 26 5.559 14.023 -6.790 219 HD3 LYS 26 HD1 LYS 26 5.597 14.815 -8.367 220 HE2 LYS 26 HE2 LYS 26 3.463 15.926 -7.827 221 HE3 LYS 26 HE1 LYS 26 3.497 15.177 -6.232 222 HZ1 LYS 26 HZ1 LYS 26 4.336 17.508 -6.326 223 HZ2 LYS 26 HZ2 LYS 26 5.648 16.954 -7.239 224 HZ3 LYS 26 HZ3 LYS 26 5.425 16.399 -5.656 225 H THR 27 HN THR 27 0.526 11.644 -6.201 226 HA THR 27 HA THR 27 1.173 10.174 -3.881 227 HB THR 27 HB THR 27 -1.513 11.057 -4.952 228 HG1 THR 27 HG1 THR 27 -0.357 12.881 -4.579 229 HG21 THR 27 HG21 THR 27 -1.919 11.072 -2.354 230 HG22 THR 27 HG22 THR 27 -0.662 9.833 -2.369 231 HG23 THR 27 HG23 THR 27 -2.144 9.597 -3.295 232 H LEU 28 HN LEU 28 -0.959 9.381 -6.639 233 HA LEU 28 HA LEU 28 -1.709 6.848 -5.612 234 HB2 LEU 28 HB2 LEU 28 -3.045 8.080 -7.247 235 HB3 LEU 28 HB1 LEU 28 -1.782 7.885 -8.445 236 HG LEU 28 HG LEU 28 -2.144 5.418 -8.366 237 HD11 LEU 28 HD11 LEU 28 -3.048 5.150 -6.169 238 HD12 LEU 28 HD12 LEU 28 -4.255 4.622 -7.340 239 HD13 LEU 28 HD13 LEU 28 -4.418 6.192 -6.555 240 HD21 LEU 28 HD21 LEU 28 -3.228 6.896 -10.033 241 HD22 LEU 28 HD22 LEU 28 -4.642 6.973 -8.983 242 HD23 LEU 28 HD23 LEU 28 -4.144 5.431 -9.676 243 H ALA 29 HN ALA 29 0.714 7.804 -8.074 244 HA ALA 29 HA ALA 29 1.446 5.206 -8.831 245 HB1 ALA 29 HB1 ALA 29 2.447 7.912 -9.265 246 HB2 ALA 29 HB2 ALA 29 2.297 6.557 -10.384 247 HB3 ALA 29 HB3 ALA 29 3.695 6.664 -9.313 248 H ASN 30 HN ASN 30 2.868 7.344 -6.350 249 HA ASN 30 HA ASN 30 5.057 5.598 -5.801 250 HB2 ASN 30 HB2 ASN 30 4.915 8.066 -5.179 251 HB3 ASN 30 HB1 ASN 30 3.853 7.582 -3.862 252 HD21 ASN 30 HD21 ASN 30 5.127 8.064 -2.162 253 HD22 ASN 30 HD22 ASN 30 6.659 7.326 -1.853 254 H ILE 31 HN ILE 31 1.854 5.932 -4.389 255 HA ILE 31 HA ILE 31 2.286 4.084 -2.331 256 HB ILE 31 HB ILE 31 -0.230 5.081 -3.619 257 HG12 ILE 31 HG12 ILE 31 0.896 5.407 -0.837 258 HG13 ILE 31 HG11 ILE 31 1.203 6.527 -2.160 259 HG21 ILE 31 HG21 ILE 31 -1.605 3.832 -2.263 260 HG22 ILE 31 HG22 ILE 31 -0.318 3.460 -1.115 261 HG23 ILE 31 HG23 ILE 31 -0.362 2.655 -2.682 262 HD11 ILE 31 HD11 ILE 31 -0.682 6.959 -0.404 263 HD12 ILE 31 HD12 ILE 31 -1.603 5.894 -1.463 264 HD13 ILE 31 HD13 ILE 31 -0.898 7.379 -2.102 265 H LEU 32 HN LEU 32 0.986 3.701 -5.608 266 HA LEU 32 HA LEU 32 0.525 0.914 -5.393 267 HB2 LEU 32 HB2 LEU 32 0.804 2.738 -7.761 268 HB3 LEU 32 HB1 LEU 32 0.489 1.020 -7.928 269 HG LEU 32 HG LEU 32 -1.302 2.895 -6.371 270 HD11 LEU 32 HD11 LEU 32 -1.790 1.810 -9.138 271 HD12 LEU 32 HD12 LEU 32 -1.123 3.414 -8.838 272 HD13 LEU 32 HD13 LEU 32 -2.736 3.008 -8.253 273 HD21 LEU 32 HD21 LEU 32 -2.324 1.047 -5.714 274 HD22 LEU 32 HD22 LEU 32 -1.123 0.073 -6.560 275 HD23 LEU 32 HD23 LEU 32 -2.591 0.586 -7.395 276 H GLU 33 HN GLU 33 3.371 2.762 -6.373 277 HA GLU 33 HA GLU 33 4.731 0.415 -7.366 278 HB2 GLU 33 HB2 GLU 33 5.776 3.198 -6.833 279 HB3 GLU 33 HB1 GLU 33 6.687 1.914 -7.613 280 HG2 GLU 33 HG2 GLU 33 4.996 1.857 -9.412 281 HG3 GLU 33 HG1 GLU 33 4.179 3.217 -8.636 282 H LYS 34 HN LYS 34 4.255 1.695 -4.256 283 HA LYS 34 HA LYS 34 6.590 0.167 -3.304 284 HB2 LYS 34 HB2 LYS 34 6.901 2.571 -2.939 285 HB3 LYS 34 HB1 LYS 34 5.380 2.646 -2.064 286 HG2 LYS 34 HG2 LYS 34 7.186 2.647 -0.494 287 HG3 LYS 34 HG1 LYS 34 6.329 1.110 -0.368 288 HD2 LYS 34 HD2 LYS 34 8.041 0.013 -1.690 289 HD3 LYS 34 HD1 LYS 34 8.875 1.550 -1.928 290 HE2 LYS 34 HE2 LYS 34 9.256 1.711 0.483 291 HE3 LYS 34 HE1 LYS 34 8.420 0.178 0.719 292 HZ1 LYS 34 HZ1 LYS 34 10.820 -0.105 0.711 293 HZ2 LYS 34 HZ2 LYS 34 10.919 0.558 -0.842 294 HZ3 LYS 34 HZ3 LYS 34 10.121 -0.913 -0.602 295 H GLU 35 HN GLU 35 3.531 1.483 -2.048 296 HA GLU 35 HA GLU 35 3.254 -0.420 0.013 297 HB2 GLU 35 HB2 GLU 35 1.296 1.461 -1.309 298 HB3 GLU 35 HB1 GLU 35 0.856 0.432 0.052 299 HG2 GLU 35 HG2 GLU 35 3.005 2.543 0.055 300 HG3 GLU 35 HG1 GLU 35 1.404 2.688 0.779 301 H PHE 36 HN PHE 36 1.915 -0.314 -3.277 302 HA PHE 36 HA PHE 36 0.941 -3.066 -2.838 303 HB2 PHE 36 HB2 PHE 36 -0.258 -0.936 -4.618 304 HB3 PHE 36 HB1 PHE 36 -0.812 -2.604 -4.527 305 HD1 PHE 36 HD1 PHE 36 -0.831 0.650 -2.948 306 HD2 PHE 36 HD2 PHE 36 -1.873 -3.445 -2.466 307 HE1 PHE 36 HE1 PHE 36 -2.291 1.250 -1.061 308 HE2 PHE 36 HE2 PHE 36 -3.338 -2.853 -0.580 309 HZ PHE 36 HZ PHE 36 -3.546 -0.503 0.125 310 H LYS 37 HN LYS 37 3.569 -2.220 -3.810 311 HA LYS 37 HA LYS 37 3.859 -2.403 -6.569 312 HB2 LYS 37 HB2 LYS 37 5.681 -1.746 -5.073 313 HB3 LYS 37 HB1 LYS 37 5.746 -3.376 -4.418 314 HG2 LYS 37 HG2 LYS 37 7.543 -3.108 -5.968 315 HG3 LYS 37 HG1 LYS 37 6.356 -4.203 -6.677 316 HD2 LYS 37 HD2 LYS 37 5.467 -2.393 -8.040 317 HD3 LYS 37 HD1 LYS 37 6.594 -1.257 -7.291 318 HE2 LYS 37 HE2 LYS 37 7.356 -3.671 -8.935 319 HE3 LYS 37 HE1 LYS 37 7.366 -1.999 -9.500 320 HZ1 LYS 37 HZ1 LYS 37 9.253 -3.389 -7.795 321 HZ2 LYS 37 HZ2 LYS 37 8.881 -1.809 -7.316 322 HZ3 LYS 37 HZ3 LYS 37 9.502 -2.099 -8.863 323 H GLY 38 HN GLY 38 3.652 -3.970 -8.005 324 HA2 GLY 38 HA2 GLY 38 3.769 -6.109 -8.908 325 HA3 GLY 38 HA1 GLY 38 4.105 -6.740 -7.305 326 H VAL 39 HN VAL 39 1.451 -4.847 -6.883 327 HA VAL 39 HA VAL 39 -0.303 -7.161 -7.335 328 HB VAL 39 HB VAL 39 -0.770 -4.910 -5.367 329 HG11 VAL 39 HG11 VAL 39 -2.847 -5.898 -6.015 330 HG12 VAL 39 HG12 VAL 39 -2.435 -6.523 -4.416 331 HG13 VAL 39 HG13 VAL 39 -2.189 -7.528 -5.846 332 HG21 VAL 39 HG21 VAL 39 0.081 -7.720 -4.707 333 HG22 VAL 39 HG22 VAL 39 -0.017 -6.329 -3.628 334 HG23 VAL 39 HG23 VAL 39 1.223 -6.387 -4.880 335 H TYR 40 HN TYR 40 -0.155 -3.613 -7.654 336 HA TYR 40 HA TYR 40 -2.489 -3.883 -9.402 337 HB2 TYR 40 HB2 TYR 40 -1.661 -1.635 -7.593 338 HB3 TYR 40 HB1 TYR 40 -2.652 -1.284 -8.996 339 HD1 TYR 40 HD1 TYR 40 -2.557 -3.196 -5.820 340 HD2 TYR 40 HD2 TYR 40 -4.955 -1.615 -8.955 341 HE1 TYR 40 HE1 TYR 40 -4.578 -3.648 -4.498 342 HE2 TYR 40 HE2 TYR 40 -6.981 -2.070 -7.646 343 HH TYR 40 HH TYR 40 -6.872 -2.901 -4.343 344 H ALA 41 HN ALA 41 -2.535 -2.925 -11.386 345 HA ALA 41 HA ALA 41 0.031 -1.876 -12.380 346 HB1 ALA 41 HB1 ALA 41 -1.110 -3.918 -13.448 347 HB2 ALA 41 HB2 ALA 41 -0.571 -2.630 -14.526 348 HB3 ALA 41 HB3 ALA 41 -2.276 -2.765 -14.096 349 H LEU 42 HN LEU 42 0.132 0.283 -12.818 350 HA LEU 42 HA LEU 42 -2.361 1.784 -12.664 351 HB2 LEU 42 HB2 LEU 42 -0.567 2.505 -11.199 352 HB3 LEU 42 HB1 LEU 42 0.506 2.715 -12.570 353 HG LEU 42 HG LEU 42 -0.935 4.539 -13.406 354 HD11 LEU 42 HD11 LEU 42 -2.496 3.937 -10.907 355 HD12 LEU 42 HD12 LEU 42 -3.076 3.999 -12.572 356 HD13 LEU 42 HD13 LEU 42 -2.599 5.484 -11.749 357 HD21 LEU 42 HD21 LEU 42 -0.354 5.266 -10.583 358 HD22 LEU 42 HD22 LEU 42 0.019 6.131 -12.074 359 HD23 LEU 42 HD23 LEU 42 0.981 4.729 -11.604 360 H LYS 43 HN LYS 43 -3.291 2.787 -14.262 361 HA LYS 43 HA LYS 43 -1.851 3.202 -16.786 362 HB2 LYS 43 HB2 LYS 43 -4.221 1.585 -16.288 363 HB3 LYS 43 HB1 LYS 43 -4.541 2.864 -17.449 364 HG2 LYS 43 HG2 LYS 43 -3.855 1.258 -18.875 365 HG3 LYS 43 HG1 LYS 43 -2.286 1.972 -18.502 366 HD2 LYS 43 HD2 LYS 43 -1.722 0.225 -17.035 367 HD3 LYS 43 HD1 LYS 43 -3.395 -0.330 -16.923 368 HE2 LYS 43 HE2 LYS 43 -2.250 -1.876 -18.315 369 HE3 LYS 43 HE1 LYS 43 -3.270 -0.893 -19.363 370 HZ1 LYS 43 HZ1 LYS 43 -0.556 0.066 -18.958 371 HZ2 LYS 43 HZ2 LYS 43 -1.498 0.039 -20.364 372 HZ3 LYS 43 HZ3 LYS 43 -0.705 -1.365 -19.850 373 H VAL 44 HN VAL 44 -1.716 5.287 -17.098 374 HA VAL 44 HA VAL 44 -3.814 7.081 -16.053 375 HB VAL 44 HB VAL 44 -0.975 7.634 -16.915 376 HG11 VAL 44 HG11 VAL 44 -3.143 9.463 -15.910 377 HG12 VAL 44 HG12 VAL 44 -2.194 9.609 -17.389 378 HG13 VAL 44 HG13 VAL 44 -1.431 9.884 -15.822 379 HG21 VAL 44 HG21 VAL 44 -1.836 8.164 -14.155 380 HG22 VAL 44 HG22 VAL 44 -0.326 7.486 -14.767 381 HG23 VAL 44 HG23 VAL 44 -1.756 6.465 -14.617 382 H ILE 45 HN ILE 45 -5.115 8.119 -17.289 383 HA ILE 45 HA ILE 45 -4.752 7.952 -20.204 384 HB ILE 45 HB ILE 45 -7.277 8.362 -18.602 385 HG12 ILE 45 HG12 ILE 45 -6.369 6.164 -18.115 386 HG13 ILE 45 HG11 ILE 45 -7.821 6.012 -19.093 387 HG21 ILE 45 HG21 ILE 45 -8.498 7.933 -20.626 388 HG22 ILE 45 HG22 ILE 45 -7.008 7.554 -21.497 389 HG23 ILE 45 HG23 ILE 45 -7.313 9.203 -20.949 390 HD11 ILE 45 HD11 ILE 45 -6.045 4.451 -19.735 391 HD12 ILE 45 HD12 ILE 45 -5.007 5.822 -20.134 392 HD13 ILE 45 HD13 ILE 45 -6.492 5.545 -21.047 393 H ASP 46 HN ASP 46 -4.087 9.901 -21.031 394 HA ASP 46 HA ASP 46 -4.650 12.351 -19.589 395 HB2 ASP 46 HB2 ASP 46 -2.444 11.883 -20.718 396 HB3 ASP 46 HB1 ASP 46 -3.274 12.057 -22.262 397 H VAL 47 HN VAL 47 -6.753 12.941 -19.793 398 HA VAL 47 HA VAL 47 -8.355 12.393 -22.047 399 HB VAL 47 HB VAL 47 -10.053 13.798 -21.023 400 HG11 VAL 47 HG11 VAL 47 -10.364 11.912 -19.869 401 HG12 VAL 47 HG12 VAL 47 -9.517 12.704 -18.541 402 HG13 VAL 47 HG13 VAL 47 -8.630 11.663 -19.655 403 HG21 VAL 47 HG21 VAL 47 -9.657 15.071 -19.011 404 HG22 VAL 47 HG22 VAL 47 -8.558 15.625 -20.275 405 HG23 VAL 47 HG23 VAL 47 -7.964 14.574 -18.988 406 H LEU 48 HN LEU 48 -6.398 15.249 -21.294 407 HA LEU 48 HA LEU 48 -7.648 16.896 -23.257 408 HB2 LEU 48 HB2 LEU 48 -5.000 17.144 -21.856 409 HB3 LEU 48 HB1 LEU 48 -5.559 18.309 -23.040 410 HG LEU 48 HG LEU 48 -6.994 17.640 -20.468 411 HD11 LEU 48 HD11 LEU 48 -5.253 19.979 -21.223 412 HD12 LEU 48 HD12 LEU 48 -4.949 18.785 -19.961 413 HD13 LEU 48 HD13 LEU 48 -6.288 19.922 -19.796 414 HD21 LEU 48 HD21 LEU 48 -8.708 18.430 -21.734 415 HD22 LEU 48 HD22 LEU 48 -7.643 19.330 -22.815 416 HD23 LEU 48 HD23 LEU 48 -8.027 19.974 -21.219 417 H LYS 49 HN LYS 49 -4.811 14.780 -23.359 418 HA LYS 49 HA LYS 49 -4.011 15.621 -25.961 419 HB2 LYS 49 HB2 LYS 49 -3.300 13.186 -24.346 420 HB3 LYS 49 HB1 LYS 49 -2.659 13.483 -25.957 421 HG2 LYS 49 HG2 LYS 49 -1.694 15.597 -25.170 422 HG3 LYS 49 HG1 LYS 49 -2.306 15.260 -23.549 423 HD2 LYS 49 HD2 LYS 49 -0.953 13.229 -23.461 424 HD3 LYS 49 HD1 LYS 49 -0.356 13.552 -25.089 425 HE2 LYS 49 HE2 LYS 49 0.654 15.637 -24.305 426 HE3 LYS 49 HE1 LYS 49 0.050 15.322 -22.680 427 HZ1 LYS 49 HZ1 LYS 49 2.463 14.698 -23.264 428 HZ2 LYS 49 HZ2 LYS 49 1.778 13.351 -24.025 429 HZ3 LYS 49 HZ3 LYS 49 1.534 13.601 -22.370 430 H ASN 50 HN ASN 50 -6.079 13.020 -24.774 431 HA ASN 50 HA ASN 50 -6.882 12.575 -27.573 432 HB2 ASN 50 HB2 ASN 50 -5.456 10.694 -26.516 433 HB3 ASN 50 HB1 ASN 50 -6.885 10.366 -25.537 434 HD21 ASN 50 HD21 ASN 50 -5.339 9.172 -28.014 435 HD22 ASN 50 HD22 ASN 50 -6.642 8.628 -29.009 436 HA PRO 51 HA PRO 51 -10.536 13.887 -25.183 437 HB2 PRO 51 HB2 PRO 51 -11.334 14.641 -27.945 438 HB3 PRO 51 HB1 PRO 51 -11.386 15.602 -26.461 439 HG2 PRO 51 HG2 PRO 51 -9.530 16.100 -28.294 440 HG3 PRO 51 HG1 PRO 51 -9.109 16.124 -26.570 441 HD2 PRO 51 HD2 PRO 51 -8.654 13.960 -28.594 442 HD3 PRO 51 HD1 PRO 51 -7.532 14.620 -27.382 443 H GLN 52 HN GLN 52 -10.188 11.968 -28.082 444 HA GLN 52 HA GLN 52 -12.822 10.984 -28.298 445 HB2 GLN 52 HB2 GLN 52 -11.072 10.779 -30.074 446 HB3 GLN 52 HB1 GLN 52 -10.255 9.579 -29.074 447 HG2 GLN 52 HG2 GLN 52 -12.202 8.122 -29.216 448 HG3 GLN 52 HG1 GLN 52 -13.037 9.321 -30.201 449 HE21 GLN 52 HE21 GLN 52 -12.030 6.490 -30.639 450 HE22 GLN 52 HE22 GLN 52 -11.173 6.587 -32.136 451 H LEU 53 HN LEU 53 -9.979 9.807 -26.553 452 HA LEU 53 HA LEU 53 -11.296 7.435 -25.702 453 HB2 LEU 53 HB2 LEU 53 -8.782 8.772 -24.703 454 HB3 LEU 53 HB1 LEU 53 -9.369 7.238 -24.084 455 HG LEU 53 HG LEU 53 -8.649 7.753 -26.965 456 HD11 LEU 53 HD11 LEU 53 -7.049 5.948 -25.233 457 HD12 LEU 53 HD12 LEU 53 -6.826 7.687 -25.032 458 HD13 LEU 53 HD13 LEU 53 -6.553 6.939 -26.606 459 HD21 LEU 53 HD21 LEU 53 -8.562 5.078 -26.626 460 HD22 LEU 53 HD22 LEU 53 -9.965 5.962 -27.231 461 HD23 LEU 53 HD23 LEU 53 -9.877 5.504 -25.528 462 H ALA 54 HN ALA 54 -10.856 10.661 -24.388 463 HA ALA 54 HA ALA 54 -11.822 10.147 -21.786 464 HB1 ALA 54 HB1 ALA 54 -10.589 12.217 -22.590 465 HB2 ALA 54 HB2 ALA 54 -11.966 12.485 -21.519 466 HB3 ALA 54 HB3 ALA 54 -12.133 12.750 -23.255 467 H GLU 55 HN GLU 55 -13.331 11.113 -24.815 468 HA GLU 55 HA GLU 55 -15.978 11.373 -23.812 469 HB2 GLU 55 HB2 GLU 55 -15.229 12.378 -25.951 470 HB3 GLU 55 HB1 GLU 55 -15.067 10.767 -26.634 471 HG2 GLU 55 HG2 GLU 55 -17.459 10.395 -26.365 472 HG3 GLU 55 HG1 GLU 55 -17.635 11.989 -25.639 473 H GLU 56 HN GLU 56 -14.153 8.682 -25.194 474 HA GLU 56 HA GLU 56 -16.287 6.881 -25.479 475 HB2 GLU 56 HB2 GLU 56 -13.355 6.368 -24.912 476 HB3 GLU 56 HB1 GLU 56 -14.508 5.102 -25.310 477 HG2 GLU 56 HG2 GLU 56 -14.930 6.252 -27.478 478 HG3 GLU 56 HG1 GLU 56 -13.638 7.392 -27.071 479 H ASP 57 HN ASP 57 -14.161 7.551 -22.703 480 HA ASP 57 HA ASP 57 -15.829 5.766 -21.098 481 HB2 ASP 57 HB2 ASP 57 -13.163 7.107 -20.524 482 HB3 ASP 57 HB1 ASP 57 -14.087 6.282 -19.271 483 H LYS 58 HN LYS 58 -16.299 8.654 -22.111 484 HA LYS 58 HA LYS 58 -17.398 10.517 -21.447 485 HB2 LYS 58 HB2 LYS 58 -18.626 8.519 -19.554 486 HB3 LYS 58 HB1 LYS 58 -19.270 10.128 -19.855 487 HG2 LYS 58 HG2 LYS 58 -19.513 9.538 -22.250 488 HG3 LYS 58 HG1 LYS 58 -18.977 7.902 -21.866 489 HD2 LYS 58 HD2 LYS 58 -21.375 9.229 -20.605 490 HD3 LYS 58 HD1 LYS 58 -21.461 8.175 -22.018 491 HE2 LYS 58 HE2 LYS 58 -20.382 7.393 -19.309 492 HE3 LYS 58 HE1 LYS 58 -21.980 6.983 -19.929 493 HZ1 LYS 58 HZ1 LYS 58 -20.889 5.119 -20.537 494 HZ2 LYS 58 HZ2 LYS 58 -19.377 5.873 -20.622 495 HZ3 LYS 58 HZ3 LYS 58 -20.480 6.046 -21.891 496 H ILE 59 HN ILE 59 -14.960 10.731 -20.470 497 HA ILE 59 HA ILE 59 -15.074 11.259 -17.607 498 HB ILE 59 HB ILE 59 -12.799 11.700 -19.550 499 HG12 ILE 59 HG12 ILE 59 -13.438 9.344 -19.474 500 HG13 ILE 59 HG11 ILE 59 -11.891 9.585 -18.668 501 HG21 ILE 59 HG21 ILE 59 -12.959 11.755 -16.546 502 HG22 ILE 59 HG22 ILE 59 -12.398 13.023 -17.635 503 HG23 ILE 59 HG23 ILE 59 -11.438 11.561 -17.416 504 HD11 ILE 59 HD11 ILE 59 -12.848 8.265 -17.120 505 HD12 ILE 59 HD12 ILE 59 -14.488 8.727 -17.578 506 HD13 ILE 59 HD13 ILE 59 -13.522 9.797 -16.561 507 H LEU 60 HN LEU 60 -16.153 13.070 -17.099 508 HA LEU 60 HA LEU 60 -15.654 15.498 -18.680 509 HB2 LEU 60 HB2 LEU 60 -17.895 14.882 -16.754 510 HB3 LEU 60 HB1 LEU 60 -17.716 16.372 -17.658 511 HG LEU 60 HG LEU 60 -18.169 13.644 -18.874 512 HD11 LEU 60 HD11 LEU 60 -20.038 15.988 -18.539 513 HD12 LEU 60 HD12 LEU 60 -20.135 14.446 -17.689 514 HD13 LEU 60 HD13 LEU 60 -20.390 14.508 -19.433 515 HD21 LEU 60 HD21 LEU 60 -17.761 16.375 -20.042 516 HD22 LEU 60 HD22 LEU 60 -18.682 15.140 -20.902 517 HD23 LEU 60 HD23 LEU 60 -16.993 14.849 -20.485 518 H ALA 61 HN ALA 61 -14.466 14.082 -16.000 519 HA ALA 61 HA ALA 61 -13.720 16.656 -14.846 520 HB1 ALA 61 HB1 ALA 61 -14.492 14.559 -12.885 521 HB2 ALA 61 HB2 ALA 61 -15.780 15.469 -13.678 522 HB3 ALA 61 HB3 ALA 61 -14.546 16.317 -12.746 523 H THR 62 HN THR 62 -11.809 16.613 -13.632 524 HA THR 62 HA THR 62 -10.300 14.139 -13.431 525 HB THR 62 HB THR 62 -8.267 15.234 -14.396 526 HG1 THR 62 HG1 THR 62 -9.483 17.409 -14.213 527 HG21 THR 62 HG21 THR 62 -10.593 14.968 -16.305 528 HG22 THR 62 HG22 THR 62 -9.511 13.674 -15.786 529 HG23 THR 62 HG23 THR 62 -8.889 15.003 -16.769 530 HA PRO 63 HA PRO 63 -8.308 13.614 -12.829 531 HB2 PRO 63 HB2 PRO 63 -7.515 12.811 -10.151 532 HB3 PRO 63 HB1 PRO 63 -6.489 13.173 -11.540 533 HG2 PRO 63 HG2 PRO 63 -6.580 14.750 -9.328 534 HG3 PRO 63 HG1 PRO 63 -6.242 15.380 -10.949 535 HD2 PRO 63 HD2 PRO 63 -8.827 15.393 -9.419 536 HD3 PRO 63 HD1 PRO 63 -8.071 16.702 -10.360 537 H THR 64 HN THR 64 -9.135 11.532 -12.828 538 HA THR 64 HA THR 64 -11.248 10.961 -10.859 539 HB THR 64 HB THR 64 -11.378 10.251 -13.801 540 HG1 THR 64 HG1 THR 64 -12.173 12.253 -13.789 541 HG21 THR 64 HG21 THR 64 -13.495 9.793 -11.708 542 HG22 THR 64 HG22 THR 64 -12.337 8.554 -12.186 543 HG23 THR 64 HG23 THR 64 -13.468 9.205 -13.370 544 H LEU 65 HN LEU 65 -11.029 9.098 -9.844 545 HA LEU 65 HA LEU 65 -8.896 7.254 -10.702 546 HB2 LEU 65 HB2 LEU 65 -8.863 8.351 -8.424 547 HB3 LEU 65 HB1 LEU 65 -10.309 7.440 -8.045 548 HG LEU 65 HG LEU 65 -9.010 5.336 -8.439 549 HD11 LEU 65 HD11 LEU 65 -6.491 5.673 -8.289 550 HD12 LEU 65 HD12 LEU 65 -6.802 7.340 -8.776 551 HD13 LEU 65 HD13 LEU 65 -7.258 6.011 -9.841 552 HD21 LEU 65 HD21 LEU 65 -8.237 5.272 -6.281 553 HD22 LEU 65 HD22 LEU 65 -9.298 6.677 -6.194 554 HD23 LEU 65 HD23 LEU 65 -7.556 6.896 -6.359 555 H ALA 66 HN ALA 66 -9.541 5.403 -11.682 556 HA ALA 66 HA ALA 66 -11.992 4.116 -10.702 557 HB1 ALA 66 HB1 ALA 66 -13.128 4.094 -12.674 558 HB2 ALA 66 HB2 ALA 66 -11.661 4.131 -13.652 559 HB3 ALA 66 HB3 ALA 66 -12.258 5.613 -12.897 560 H LYS 67 HN LYS 67 -11.929 2.006 -10.613 561 HA LYS 67 HA LYS 67 -9.505 0.668 -11.569 562 HB2 LYS 67 HB2 LYS 67 -9.946 0.315 -9.209 563 HB3 LYS 67 HB1 LYS 67 -11.609 -0.128 -9.543 564 HG2 LYS 67 HG2 LYS 67 -11.033 -2.224 -10.352 565 HG3 LYS 67 HG1 LYS 67 -9.362 -1.757 -10.666 566 HD2 LYS 67 HD2 LYS 67 -9.016 -2.952 -8.768 567 HD3 LYS 67 HD1 LYS 67 -9.396 -1.404 -8.018 568 HE2 LYS 67 HE2 LYS 67 -10.572 -3.362 -7.013 569 HE3 LYS 67 HE1 LYS 67 -11.647 -2.091 -7.581 570 HZ1 LYS 67 HZ1 LYS 67 -11.774 -4.750 -8.225 571 HZ2 LYS 67 HZ2 LYS 67 -11.142 -4.023 -9.615 572 HZ3 LYS 67 HZ3 LYS 67 -12.619 -3.495 -8.982 573 H VAL 68 HN VAL 68 -9.835 -0.005 -13.628 574 HA VAL 68 HA VAL 68 -12.464 -0.763 -14.513 575 HB VAL 68 HB VAL 68 -11.398 -1.182 -16.693 576 HG11 VAL 68 HG11 VAL 68 -11.042 1.079 -17.231 577 HG12 VAL 68 HG12 VAL 68 -10.456 1.454 -15.611 578 HG13 VAL 68 HG13 VAL 68 -12.163 1.093 -15.870 579 HG21 VAL 68 HG21 VAL 68 -8.830 -0.002 -15.913 580 HG22 VAL 68 HG22 VAL 68 -9.179 -1.316 -17.035 581 HG23 VAL 68 HG23 VAL 68 -9.104 -1.632 -15.301 582 H LEU 69 HN LEU 69 -9.591 -2.399 -13.415 583 HA LEU 69 HA LEU 69 -11.045 -4.940 -13.738 584 HB2 LEU 69 HB2 LEU 69 -8.161 -4.504 -14.515 585 HB3 LEU 69 HB1 LEU 69 -8.922 -6.074 -14.386 586 HG LEU 69 HG LEU 69 -9.812 -3.921 -16.308 587 HD11 LEU 69 HD11 LEU 69 -7.851 -4.454 -17.306 588 HD12 LEU 69 HD12 LEU 69 -8.801 -5.819 -17.890 589 HD13 LEU 69 HD13 LEU 69 -7.735 -6.019 -16.500 590 HD21 LEU 69 HD21 LEU 69 -10.876 -5.975 -17.395 591 HD22 LEU 69 HD22 LEU 69 -11.633 -5.342 -15.933 592 HD23 LEU 69 HD23 LEU 69 -10.611 -6.779 -15.848 593 HA PRO 70 HA PRO 70 -10.970 -6.959 -13.150 594 HB2 PRO 70 HB2 PRO 70 -12.159 -8.356 -11.185 595 HB3 PRO 70 HB1 PRO 70 -10.476 -8.650 -11.641 596 HG2 PRO 70 HG2 PRO 70 -11.564 -7.031 -9.363 597 HG3 PRO 70 HG1 PRO 70 -10.240 -8.212 -9.358 598 HD2 PRO 70 HD2 PRO 70 -9.826 -5.525 -9.479 599 HD3 PRO 70 HD1 PRO 70 -8.728 -6.705 -10.223 600 HA PRO 71 HA PRO 71 -14.840 -4.778 -13.061 601 HB2 PRO 71 HB2 PRO 71 -16.534 -6.652 -14.067 602 HB3 PRO 71 HB1 PRO 71 -15.354 -5.792 -15.064 603 HG2 PRO 71 HG2 PRO 71 -15.156 -8.518 -13.829 604 HG3 PRO 71 HG1 PRO 71 -14.742 -8.009 -15.477 605 HD2 PRO 71 HD2 PRO 71 -12.859 -8.326 -13.585 606 HD3 PRO 71 HD1 PRO 71 -12.743 -7.045 -14.811 607 HA PRO 72 HA PRO 72 -17.198 -4.370 -13.097 608 HB2 PRO 72 HB2 PRO 72 -18.575 -2.799 -11.399 609 HB3 PRO 72 HB1 PRO 72 -19.221 -4.337 -11.990 610 HG2 PRO 72 HG2 PRO 72 -17.866 -3.733 -9.383 611 HG3 PRO 72 HG1 PRO 72 -19.349 -4.662 -9.678 612 HD2 PRO 72 HD2 PRO 72 -16.944 -5.844 -9.276 613 HD3 PRO 72 HD1 PRO 72 -18.186 -6.545 -10.333 614 H VAL 73 HN VAL 73 -16.921 -2.048 -13.345 615 HA VAL 73 HA VAL 73 -14.336 -1.185 -12.512 616 HB VAL 73 HB VAL 73 -16.531 0.342 -13.932 617 HG11 VAL 73 HG11 VAL 73 -13.673 1.023 -13.343 618 HG12 VAL 73 HG12 VAL 73 -15.120 2.009 -13.130 619 HG13 VAL 73 HG13 VAL 73 -14.497 1.696 -14.750 620 HG21 VAL 73 HG21 VAL 73 -16.054 -0.983 -15.655 621 HG22 VAL 73 HG22 VAL 73 -14.691 -1.710 -14.804 622 HG23 VAL 73 HG23 VAL 73 -14.468 -0.215 -15.711 623 H ARG 74 HN ARG 74 -13.765 -0.027 -10.788 624 HA ARG 74 HA ARG 74 -15.880 1.101 -9.074 625 HB2 ARG 74 HB2 ARG 74 -12.975 0.717 -8.362 626 HB3 ARG 74 HB1 ARG 74 -14.315 1.010 -7.269 627 HG2 ARG 74 HG2 ARG 74 -13.904 -1.488 -8.892 628 HG3 ARG 74 HG1 ARG 74 -13.526 -1.296 -7.181 629 HD2 ARG 74 HD2 ARG 74 -16.276 -0.934 -8.366 630 HD3 ARG 74 HD1 ARG 74 -15.706 -2.428 -7.626 631 HE ARG 74 HE ARG 74 -15.296 -0.454 -5.748 632 HH11 ARG 74 HH11 ARG 74 -18.013 -1.774 -7.479 633 HH12 ARG 74 HH12 ARG 74 -19.147 -1.458 -6.210 634 HH21 ARG 74 HH21 ARG 74 -16.775 -0.032 -4.064 635 HH22 ARG 74 HH22 ARG 74 -18.441 -0.463 -4.261 636 H ARG 75 HN ARG 75 -16.247 3.217 -9.368 637 HA ARG 75 HA ARG 75 -13.972 4.884 -10.161 638 HB2 ARG 75 HB2 ARG 75 -16.928 5.481 -10.235 639 HB3 ARG 75 HB1 ARG 75 -15.658 6.611 -10.684 640 HG2 ARG 75 HG2 ARG 75 -14.928 5.022 -12.437 641 HG3 ARG 75 HG1 ARG 75 -16.327 4.016 -12.048 642 HD2 ARG 75 HD2 ARG 75 -17.808 5.895 -12.579 643 HD3 ARG 75 HD1 ARG 75 -16.402 6.882 -12.977 644 HE ARG 75 HE ARG 75 -16.196 5.755 -14.979 645 HH11 ARG 75 HH11 ARG 75 -18.565 4.176 -12.968 646 HH12 ARG 75 HH12 ARG 75 -19.156 3.157 -14.238 647 HH21 ARG 75 HH21 ARG 75 -16.966 4.424 -16.658 648 HH22 ARG 75 HH22 ARG 75 -18.245 3.299 -16.342 649 H ILE 76 HN ILE 76 -13.004 6.066 -8.730 650 HA ILE 76 HA ILE 76 -14.376 6.629 -6.179 651 HB ILE 76 HB ILE 76 -11.408 6.460 -6.694 652 HG12 ILE 76 HG12 ILE 76 -13.284 4.487 -5.365 653 HG13 ILE 76 HG11 ILE 76 -12.521 4.282 -6.940 654 HG21 ILE 76 HG21 ILE 76 -13.004 6.777 -4.154 655 HG22 ILE 76 HG22 ILE 76 -11.881 7.940 -4.857 656 HG23 ILE 76 HG23 ILE 76 -11.278 6.416 -4.207 657 HD11 ILE 76 HD11 ILE 76 -11.453 3.025 -5.099 658 HD12 ILE 76 HD12 ILE 76 -11.005 4.571 -4.377 659 HD13 ILE 76 HD13 ILE 76 -10.373 4.124 -5.961 660 H ILE 77 HN ILE 77 -14.961 8.714 -5.953 661 HA ILE 77 HA ILE 77 -13.343 10.768 -7.305 662 HB ILE 77 HB ILE 77 -16.276 11.001 -6.656 663 HG12 ILE 77 HG12 ILE 77 -15.974 10.977 -9.428 664 HG13 ILE 77 HG11 ILE 77 -14.927 9.677 -8.868 665 HG21 ILE 77 HG21 ILE 77 -14.728 13.061 -6.917 666 HG22 ILE 77 HG22 ILE 77 -16.271 13.032 -7.770 667 HG23 ILE 77 HG23 ILE 77 -14.777 12.668 -8.636 668 HD11 ILE 77 HD11 ILE 77 -17.227 8.960 -9.432 669 HD12 ILE 77 HD12 ILE 77 -17.823 9.961 -8.109 670 HD13 ILE 77 HD13 ILE 77 -16.755 8.599 -7.772 671 H GLY 78 HN GLY 78 -12.366 12.192 -6.019 672 HA2 GLY 78 HA2 GLY 78 -13.424 13.530 -3.854 673 HA3 GLY 78 HA1 GLY 78 -12.679 12.084 -3.187 674 H ASP 79 HN ASP 79 -11.326 13.744 -2.075 675 HA ASP 79 HA ASP 79 -9.388 15.135 -3.721 676 HB2 ASP 79 HB2 ASP 79 -10.250 16.145 -1.616 677 HB3 ASP 79 HB1 ASP 79 -9.500 14.838 -0.706 678 H LEU 80 HN LEU 80 -8.006 13.779 -4.715 679 HA LEU 80 HA LEU 80 -6.909 11.495 -3.293 680 HB2 LEU 80 HB2 LEU 80 -6.447 12.457 -6.120 681 HB3 LEU 80 HB1 LEU 80 -5.837 10.959 -5.451 682 HG LEU 80 HG LEU 80 -8.757 11.634 -5.822 683 HD11 LEU 80 HD11 LEU 80 -7.019 11.067 -7.797 684 HD12 LEU 80 HD12 LEU 80 -8.717 10.590 -7.820 685 HD13 LEU 80 HD13 LEU 80 -7.482 9.437 -7.313 686 HD21 LEU 80 HD21 LEU 80 -8.570 10.137 -3.992 687 HD22 LEU 80 HD22 LEU 80 -7.337 9.178 -4.811 688 HD23 LEU 80 HD23 LEU 80 -9.001 9.157 -5.392 689 H SER 81 HN SER 81 -6.119 14.683 -3.395 690 HA SER 81 HA SER 81 -3.304 14.545 -3.814 691 HB2 SER 81 HB2 SER 81 -4.900 16.641 -2.314 692 HB3 SER 81 HB1 SER 81 -3.251 16.820 -2.920 693 HG SER 81 HG SER 81 -5.596 17.133 -4.230 694 H ASN 82 HN ASN 82 -5.334 13.638 -1.278 695 HA ASN 82 HA ASN 82 -3.269 13.778 0.772 696 HB2 ASN 82 HB2 ASN 82 -5.607 14.364 1.351 697 HB3 ASN 82 HB1 ASN 82 -6.098 12.733 0.923 698 HD21 ASN 82 HD21 ASN 82 -6.872 13.256 3.272 699 HD22 ASN 82 HD22 ASN 82 -5.843 12.642 4.517 700 H ARG 83 HN ARG 83 -1.862 12.184 0.968 701 HA ARG 83 HA ARG 83 -1.957 9.850 -0.540 702 HB2 ARG 83 HB2 ARG 83 -0.336 10.538 1.919 703 HB3 ARG 83 HB1 ARG 83 -0.109 9.036 1.035 704 HG2 ARG 83 HG2 ARG 83 1.355 10.106 -0.238 705 HG3 ARG 83 HG1 ARG 83 0.009 11.034 -0.904 706 HD2 ARG 83 HD2 ARG 83 1.250 11.877 1.678 707 HD3 ARG 83 HD1 ARG 83 2.055 12.263 0.157 708 HE ARG 83 HE ARG 83 -0.347 13.189 -0.375 709 HH11 ARG 83 HH11 ARG 83 1.485 13.472 2.577 710 HH12 ARG 83 HH12 ARG 83 0.763 14.979 3.032 711 HH21 ARG 83 HH21 ARG 83 -1.302 15.163 0.203 712 HH22 ARG 83 HH22 ARG 83 -0.829 15.944 1.678 713 H GLU 84 HN GLU 84 -3.055 10.423 2.765 714 HA GLU 84 HA GLU 84 -3.422 7.748 3.523 715 HB2 GLU 84 HB2 GLU 84 -4.491 10.362 4.417 716 HB3 GLU 84 HB1 GLU 84 -5.397 8.928 4.888 717 HG2 GLU 84 HG2 GLU 84 -3.442 7.986 5.937 718 HG3 GLU 84 HG1 GLU 84 -2.459 9.345 5.392 719 H LYS 85 HN LYS 85 -5.728 9.952 1.865 720 HA LYS 85 HA LYS 85 -7.800 8.019 1.841 721 HB2 LYS 85 HB2 LYS 85 -7.323 10.447 0.097 722 HB3 LYS 85 HB1 LYS 85 -8.737 9.419 -0.085 723 HG2 LYS 85 HG2 LYS 85 -9.417 9.952 2.199 724 HG3 LYS 85 HG1 LYS 85 -8.000 10.988 2.379 725 HD2 LYS 85 HD2 LYS 85 -8.805 12.344 0.457 726 HD3 LYS 85 HD1 LYS 85 -10.251 11.338 0.398 727 HE2 LYS 85 HE2 LYS 85 -9.386 13.005 2.760 728 HE3 LYS 85 HE1 LYS 85 -10.636 13.451 1.599 729 HZ1 LYS 85 HZ1 LYS 85 -11.959 12.495 3.131 730 HZ2 LYS 85 HZ2 LYS 85 -10.730 11.530 3.778 731 HZ3 LYS 85 HZ3 LYS 85 -11.511 11.061 2.352 732 H VAL 86 HN VAL 86 -5.257 8.755 -0.493 733 HA VAL 86 HA VAL 86 -6.140 6.965 -2.473 734 HB VAL 86 HB VAL 86 -3.339 7.943 -1.851 735 HG11 VAL 86 HG11 VAL 86 -2.507 6.519 -3.340 736 HG12 VAL 86 HG12 VAL 86 -3.658 7.080 -4.553 737 HG13 VAL 86 HG13 VAL 86 -4.090 5.754 -3.475 738 HG21 VAL 86 HG21 VAL 86 -5.637 8.950 -3.374 739 HG22 VAL 86 HG22 VAL 86 -4.104 8.997 -4.242 740 HG23 VAL 86 HG23 VAL 86 -4.262 9.814 -2.686 741 H LEU 87 HN LEU 87 -4.007 6.508 0.321 742 HA LEU 87 HA LEU 87 -3.417 3.770 -0.206 743 HB2 LEU 87 HB2 LEU 87 -2.877 5.720 1.868 744 HB3 LEU 87 HB1 LEU 87 -3.277 4.161 2.562 745 HG LEU 87 HG LEU 87 -1.141 4.519 0.471 746 HD11 LEU 87 HD11 LEU 87 -0.132 3.988 3.101 747 HD12 LEU 87 HD12 LEU 87 -1.096 5.467 3.116 748 HD13 LEU 87 HD13 LEU 87 0.262 5.308 2.001 749 HD21 LEU 87 HD21 LEU 87 -1.000 2.331 2.412 750 HD22 LEU 87 HD22 LEU 87 -0.783 2.308 0.662 751 HD23 LEU 87 HD23 LEU 87 -2.408 2.255 1.350 752 H ILE 88 HN ILE 88 -5.842 5.326 1.877 753 HA ILE 88 HA ILE 88 -6.863 2.949 2.974 754 HB ILE 88 HB ILE 88 -8.114 5.656 2.578 755 HG12 ILE 88 HG12 ILE 88 -7.239 4.242 5.099 756 HG13 ILE 88 HG11 ILE 88 -6.173 5.286 4.165 757 HG21 ILE 88 HG21 ILE 88 -9.805 4.813 4.296 758 HG22 ILE 88 HG22 ILE 88 -9.287 3.191 3.835 759 HG23 ILE 88 HG23 ILE 88 -10.005 4.263 2.631 760 HD11 ILE 88 HD11 ILE 88 -8.386 6.854 4.538 761 HD12 ILE 88 HD12 ILE 88 -6.894 6.913 5.481 762 HD13 ILE 88 HD13 ILE 88 -8.266 5.961 6.054 763 H ALA 89 HN ALA 89 -7.940 4.810 0.123 764 HA ALA 89 HA ALA 89 -10.072 3.075 -0.546 765 HB1 ALA 89 HB1 ALA 89 -10.485 4.640 -2.071 766 HB2 ALA 89 HB2 ALA 89 -8.952 4.320 -2.883 767 HB3 ALA 89 HB3 ALA 89 -9.019 5.471 -1.547 768 H LEU 90 HN LEU 90 -6.675 3.114 -1.536 769 HA LEU 90 HA LEU 90 -6.904 1.001 -3.426 770 HB2 LEU 90 HB2 LEU 90 -4.702 2.477 -2.120 771 HB3 LEU 90 HB1 LEU 90 -4.309 0.858 -2.663 772 HG LEU 90 HG LEU 90 -4.740 1.398 -4.930 773 HD11 LEU 90 HD11 LEU 90 -6.139 3.783 -3.800 774 HD12 LEU 90 HD12 LEU 90 -6.676 2.645 -5.038 775 HD13 LEU 90 HD13 LEU 90 -5.452 3.855 -5.423 776 HD21 LEU 90 HD21 LEU 90 -3.118 3.075 -5.346 777 HD22 LEU 90 HD22 LEU 90 -2.629 2.255 -3.860 778 HD23 LEU 90 HD23 LEU 90 -3.406 3.837 -3.783 779 H ARG 91 HN ARG 91 -6.169 1.098 0.035 780 HA ARG 91 HA ARG 91 -5.401 -1.612 0.341 781 HB2 ARG 91 HB2 ARG 91 -4.948 0.132 2.021 782 HB3 ARG 91 HB1 ARG 91 -6.672 0.271 2.338 783 HG2 ARG 91 HG2 ARG 91 -6.750 -1.953 3.230 784 HG3 ARG 91 HG1 ARG 91 -5.075 -2.246 2.757 785 HD2 ARG 91 HD2 ARG 91 -5.941 -0.118 4.707 786 HD3 ARG 91 HD1 ARG 91 -5.382 -1.724 5.177 787 HE ARG 91 HE ARG 91 -3.436 -0.606 3.530 788 HH11 ARG 91 HH11 ARG 91 -4.872 -0.019 6.646 789 HH12 ARG 91 HH12 ARG 91 -3.450 0.714 7.311 790 HH21 ARG 91 HH21 ARG 91 -1.556 0.352 4.389 791 HH22 ARG 91 HH22 ARG 91 -1.558 0.925 6.023 792 H LEU 92 HN LEU 92 -8.541 0.025 0.721 793 HA LEU 92 HA LEU 92 -9.973 -2.282 1.481 794 HB2 LEU 92 HB2 LEU 92 -10.646 0.451 0.598 795 HB3 LEU 92 HB1 LEU 92 -11.886 -0.754 0.310 796 HG LEU 92 HG LEU 92 -12.039 -1.268 2.653 797 HD11 LEU 92 HD11 LEU 92 -9.853 -1.184 3.468 798 HD12 LEU 92 HD12 LEU 92 -10.666 0.161 4.270 799 HD13 LEU 92 HD13 LEU 92 -9.604 0.465 2.894 800 HD21 LEU 92 HD21 LEU 92 -11.893 1.730 2.435 801 HD22 LEU 92 HD22 LEU 92 -12.940 0.764 3.477 802 HD23 LEU 92 HD23 LEU 92 -13.195 0.767 1.732 803 H LEU 93 HN LEU 93 -9.330 -0.863 -1.696 804 HA LEU 93 HA LEU 93 -11.043 -2.591 -3.153 805 HB2 LEU 93 HB2 LEU 93 -8.571 -1.074 -3.980 806 HB3 LEU 93 HB1 LEU 93 -9.550 -1.999 -5.101 807 HG LEU 93 HG LEU 93 -10.571 0.330 -3.474 808 HD11 LEU 93 HD11 LEU 93 -9.415 1.577 -4.918 809 HD12 LEU 93 HD12 LEU 93 -10.609 1.072 -6.113 810 HD13 LEU 93 HD13 LEU 93 -9.078 0.207 -5.975 811 HD21 LEU 93 HD21 LEU 93 -11.893 -1.721 -4.937 812 HD22 LEU 93 HD22 LEU 93 -12.086 -0.200 -5.811 813 HD23 LEU 93 HD23 LEU 93 -12.590 -0.318 -4.125 814 H ALA 94 HN ALA 94 -7.648 -2.772 -2.200 815 HA ALA 94 HA ALA 94 -6.998 -5.112 -3.623 816 HB1 ALA 94 HB1 ALA 94 -5.459 -3.386 -2.428 817 HB2 ALA 94 HB2 ALA 94 -4.963 -5.075 -2.537 818 HB3 ALA 94 HB3 ALA 94 -5.656 -4.454 -1.038 819 H GLU 95 HN GLU 95 -8.349 -4.622 -0.394 820 HA GLU 95 HA GLU 95 -8.108 -7.268 0.513 821 HB2 GLU 95 HB2 GLU 95 -10.060 -5.062 1.182 822 HB3 GLU 95 HB1 GLU 95 -10.057 -6.615 2.009 823 HG2 GLU 95 HG2 GLU 95 -7.861 -6.230 2.868 824 HG3 GLU 95 HG1 GLU 95 -7.675 -4.782 1.878 825 H GLU 96 HN GLU 96 -10.548 -5.624 -1.410 826 HA GLU 96 HA GLU 96 -12.480 -7.673 -1.475 827 HB2 GLU 96 HB2 GLU 96 -11.809 -5.451 -3.419 828 HB3 GLU 96 HB1 GLU 96 -13.187 -6.525 -3.629 829 HG2 GLU 96 HG2 GLU 96 -14.199 -5.740 -1.609 830 HG3 GLU 96 HG1 GLU 96 -12.757 -4.816 -1.190 831 H ILE 97 HN ILE 97 -9.687 -6.962 -3.499 832 HA ILE 97 HA ILE 97 -10.135 -8.995 -5.431 833 HB ILE 97 HB ILE 97 -7.602 -7.524 -4.680 834 HG12 ILE 97 HG12 ILE 97 -9.518 -7.073 -6.971 835 HG13 ILE 97 HG11 ILE 97 -9.577 -6.186 -5.450 836 HG21 ILE 97 HG21 ILE 97 -6.669 -8.238 -6.779 837 HG22 ILE 97 HG22 ILE 97 -8.174 -9.043 -7.226 838 HG23 ILE 97 HG23 ILE 97 -7.200 -9.674 -5.899 839 HD11 ILE 97 HD11 ILE 97 -6.966 -6.194 -6.744 840 HD12 ILE 97 HD12 ILE 97 -7.880 -4.878 -6.003 841 HD13 ILE 97 HD13 ILE 97 -8.248 -5.390 -7.650 842 H GLY 98 HN GLY 98 -8.124 -8.794 -2.514 843 HA2 GLY 98 HA2 GLY 98 -6.930 -11.354 -2.758 844 HA3 GLY 98 HA1 GLY 98 -7.038 -10.407 -1.283 845 H ASP 99 HN ASP 99 -10.040 -10.355 -1.643 846 HA ASP 99 HA ASP 99 -10.689 -12.512 0.039 847 HB2 ASP 99 HB2 ASP 99 -12.008 -10.413 -0.121 848 HB3 ASP 99 HB1 ASP 99 -12.563 -10.909 -1.718 849 H TYR 100 HN TYR 100 -10.928 -12.114 -3.452 850 HA TYR 100 HA TYR 100 -12.355 -14.512 -3.943 851 HB2 TYR 100 HB2 TYR 100 -12.347 -12.672 -5.561 852 HB3 TYR 100 HB1 TYR 100 -10.608 -12.839 -5.768 853 HD1 TYR 100 HD1 TYR 100 -13.814 -14.677 -6.227 854 HD2 TYR 100 HD2 TYR 100 -9.753 -14.252 -7.424 855 HE1 TYR 100 HE1 TYR 100 -14.195 -16.261 -8.069 856 HE2 TYR 100 HE2 TYR 100 -10.124 -15.836 -9.268 857 HH TYR 100 HH TYR 100 -12.064 -17.897 -9.558 858 H LYS 101 HN LYS 101 -11.635 -16.501 -3.878 859 HA LYS 101 HA LYS 101 -8.797 -17.009 -3.551 860 HB2 LYS 101 HB2 LYS 101 -11.145 -18.908 -3.394 861 HB3 LYS 101 HB1 LYS 101 -9.484 -19.304 -2.982 862 HG2 LYS 101 HG2 LYS 101 -11.157 -17.224 -1.586 863 HG3 LYS 101 HG1 LYS 101 -10.891 -18.870 -1.009 864 HD2 LYS 101 HD2 LYS 101 -8.468 -18.417 -0.915 865 HD3 LYS 101 HD1 LYS 101 -8.774 -16.759 -1.437 866 HE2 LYS 101 HE2 LYS 101 -8.491 -16.843 0.970 867 HE3 LYS 101 HE1 LYS 101 -10.146 -16.393 0.562 868 HZ1 LYS 101 HZ1 LYS 101 -9.716 -19.231 0.903 869 HZ2 LYS 101 HZ2 LYS 101 -10.960 -18.246 1.488 870 HZ3 LYS 101 HZ3 LYS 101 -9.483 -18.316 2.307 871 H ASP 102 HN ASP 102 -7.577 -18.380 -4.842 872 HA ASP 102 HA ASP 102 -8.048 -18.269 -7.612 873 HB2 ASP 102 HB2 ASP 102 -5.796 -18.461 -6.601 874 HB3 ASP 102 HB1 ASP 102 -6.168 -20.113 -6.118 875 H ASP 103 HN ASP 103 -8.483 -20.888 -5.273 876 HA ASP 103 HA ASP 103 -10.439 -22.145 -6.980 877 HB2 ASP 103 HB2 ASP 103 -8.034 -22.986 -7.616 878 HB3 ASP 103 HB1 ASP 103 -8.171 -23.921 -6.131 879 H ASP 104 HN ASP 104 -11.575 -23.890 -5.869 880 HA ASP 104 HA ASP 104 -12.051 -23.283 -3.139 881 HB2 ASP 104 HB2 ASP 104 -13.744 -24.216 -4.743 882 HB3 ASP 104 HB1 ASP 104 -12.923 -25.768 -4.623 883 H ASP 105 HN ASP 105 -10.073 -25.652 -4.749 884 HA ASP 105 HA ASP 105 -8.450 -27.062 -4.042 885 HB2 ASP 105 HB2 ASP 105 -7.895 -25.077 -2.527 886 HB3 ASP 105 HB1 ASP 105 -8.716 -25.964 -1.250 887 H LYS 106 HN LYS 106 -10.352 -26.911 -1.024 888 HA LYS 106 HA LYS 106 -10.891 -29.791 -1.375 889 HB2 LYS 106 HB2 LYS 106 -10.562 -28.296 1.235 890 HB3 LYS 106 HB1 LYS 106 -10.873 -30.016 1.061 891 HG2 LYS 106 HG2 LYS 106 -8.396 -28.589 0.107 892 HG3 LYS 106 HG1 LYS 106 -8.528 -29.538 1.589 893 HD2 LYS 106 HD2 LYS 106 -9.153 -31.506 0.181 894 HD3 LYS 106 HD1 LYS 106 -8.800 -30.531 -1.248 895 HE2 LYS 106 HE2 LYS 106 -6.841 -31.162 0.958 896 HE3 LYS 106 HE1 LYS 106 -6.920 -31.992 -0.597 897 HZ1 LYS 106 HZ1 LYS 106 -6.490 -29.824 -1.669 898 HZ2 LYS 106 HZ2 LYS 106 -5.217 -30.338 -0.681 899 HZ3 LYS 106 HZ3 LYS 106 -6.271 -29.130 -0.141 Start of MODEL 15 1 H1 MET 1 HT1 MET 1 -16.963 -14.376 -19.618 2 H2 MET 1 HT2 MET 1 -16.030 -15.352 -18.597 3 H3 MET 1 HT3 MET 1 -17.416 -15.981 -19.334 4 HA MET 1 HA MET 1 -15.656 -16.848 -20.565 5 HB2 MET 1 HB2 MET 1 -16.642 -14.366 -21.989 6 HB3 MET 1 HB1 MET 1 -15.892 -15.755 -22.763 7 HG2 MET 1 HG2 MET 1 -17.741 -17.167 -22.072 8 HG3 MET 1 HG1 MET 1 -18.482 -15.807 -21.228 9 HE1 MET 1 HE1 MET 1 -20.968 -15.736 -22.812 10 HE2 MET 1 HE2 MET 1 -20.183 -17.316 -22.785 11 HE3 MET 1 HE3 MET 1 -20.746 -16.637 -24.312 12 H ALA 2 HN ALA 2 -15.039 -13.846 -19.192 13 HA ALA 2 HA ALA 2 -12.388 -13.665 -20.456 14 HB1 ALA 2 HB1 ALA 2 -12.402 -11.394 -20.154 15 HB2 ALA 2 HB2 ALA 2 -13.453 -11.478 -18.741 16 HB3 ALA 2 HB3 ALA 2 -14.129 -11.692 -20.356 17 HA PRO 3 HA PRO 3 -10.959 -15.460 -16.556 18 HB2 PRO 3 HB2 PRO 3 -8.354 -14.912 -17.884 19 HB3 PRO 3 HB1 PRO 3 -8.951 -16.408 -17.157 20 HG2 PRO 3 HG2 PRO 3 -8.834 -16.175 -19.795 21 HG3 PRO 3 HG1 PRO 3 -10.231 -16.958 -19.029 22 HD2 PRO 3 HD2 PRO 3 -9.989 -14.176 -20.130 23 HD3 PRO 3 HD1 PRO 3 -11.321 -15.341 -20.300 24 H LEU 4 HN LEU 4 -10.107 -14.609 -14.699 25 HA LEU 4 HA LEU 4 -9.401 -11.760 -14.816 26 HB2 LEU 4 HB2 LEU 4 -10.359 -13.370 -12.447 27 HB3 LEU 4 HB1 LEU 4 -10.087 -11.638 -12.482 28 HG LEU 4 HG LEU 4 -12.209 -13.134 -14.023 29 HD11 LEU 4 HD11 LEU 4 -12.523 -12.865 -11.542 30 HD12 LEU 4 HD12 LEU 4 -13.785 -12.164 -12.554 31 HD13 LEU 4 HD13 LEU 4 -12.566 -11.124 -11.816 32 HD21 LEU 4 HD21 LEU 4 -13.000 -10.706 -14.408 33 HD22 LEU 4 HD22 LEU 4 -11.703 -11.355 -15.413 34 HD23 LEU 4 HD23 LEU 4 -11.322 -10.277 -14.067 35 H ARG 5 HN ARG 5 -7.564 -10.997 -13.829 36 HA ARG 5 HA ARG 5 -5.594 -13.046 -13.094 37 HB2 ARG 5 HB2 ARG 5 -5.368 -10.313 -14.306 38 HB3 ARG 5 HB1 ARG 5 -4.006 -10.982 -13.420 39 HG2 ARG 5 HG2 ARG 5 -3.510 -11.616 -15.567 40 HG3 ARG 5 HG1 ARG 5 -4.363 -13.043 -14.977 41 HD2 ARG 5 HD2 ARG 5 -5.254 -12.582 -17.119 42 HD3 ARG 5 HD1 ARG 5 -6.463 -12.042 -15.955 43 HE ARG 5 HE ARG 5 -4.697 -9.936 -16.716 44 HH11 ARG 5 HH11 ARG 5 -7.511 -11.737 -17.707 45 HH12 ARG 5 HH12 ARG 5 -8.118 -10.477 -18.729 46 HH21 ARG 5 HH21 ARG 5 -5.486 -8.269 -18.055 47 HH22 ARG 5 HH22 ARG 5 -6.963 -8.501 -18.927 48 H LYS 6 HN LYS 6 -4.122 -12.587 -11.337 49 HA LYS 6 HA LYS 6 -5.413 -11.720 -8.995 50 HB2 LYS 6 HB2 LYS 6 -2.496 -12.236 -9.570 51 HB3 LYS 6 HB1 LYS 6 -3.116 -11.874 -7.966 52 HG2 LYS 6 HG2 LYS 6 -4.058 -14.202 -9.626 53 HG3 LYS 6 HG1 LYS 6 -2.751 -14.301 -8.445 54 HD2 LYS 6 HD2 LYS 6 -4.312 -13.551 -6.691 55 HD3 LYS 6 HD1 LYS 6 -5.612 -13.516 -7.883 56 HE2 LYS 6 HE2 LYS 6 -5.706 -15.569 -6.592 57 HE3 LYS 6 HE1 LYS 6 -5.306 -15.919 -8.274 58 HZ1 LYS 6 HZ1 LYS 6 -3.038 -15.519 -6.512 59 HZ2 LYS 6 HZ2 LYS 6 -3.280 -16.674 -7.722 60 HZ3 LYS 6 HZ3 LYS 6 -3.963 -16.900 -6.192 61 H THR 7 HN THR 7 -3.150 -10.141 -11.140 62 HA THR 7 HA THR 7 -2.874 -7.813 -9.485 63 HB THR 7 HB THR 7 -1.932 -6.883 -11.765 64 HG1 THR 7 HG1 THR 7 -2.661 -8.596 -13.064 65 HG21 THR 7 HG21 THR 7 0.008 -8.837 -11.075 66 HG22 THR 7 HG22 THR 7 -0.809 -8.339 -9.594 67 HG23 THR 7 HG23 THR 7 -0.040 -7.132 -10.627 68 H ALA 8 HN ALA 8 -4.224 -6.199 -9.344 69 HA ALA 8 HA ALA 8 -6.471 -5.978 -11.164 70 HB1 ALA 8 HB1 ALA 8 -7.419 -4.497 -9.598 71 HB2 ALA 8 HB2 ALA 8 -5.856 -4.169 -8.845 72 HB3 ALA 8 HB3 ALA 8 -6.618 -5.747 -8.644 73 H VAL 9 HN VAL 9 -7.034 -4.047 -12.265 74 HA VAL 9 HA VAL 9 -4.673 -2.440 -12.981 75 HB VAL 9 HB VAL 9 -7.097 -3.038 -14.676 76 HG11 VAL 9 HG11 VAL 9 -5.629 -1.988 -16.480 77 HG12 VAL 9 HG12 VAL 9 -4.655 -1.340 -15.161 78 HG13 VAL 9 HG13 VAL 9 -6.353 -0.887 -15.310 79 HG21 VAL 9 HG21 VAL 9 -5.946 -4.693 -15.698 80 HG22 VAL 9 HG22 VAL 9 -5.076 -4.745 -14.165 81 HG23 VAL 9 HG23 VAL 9 -4.400 -3.862 -15.534 82 H LEU 10 HN LEU 10 -4.755 -0.370 -12.488 83 HA LEU 10 HA LEU 10 -7.364 0.856 -11.827 84 HB2 LEU 10 HB2 LEU 10 -4.821 0.813 -10.423 85 HB3 LEU 10 HB1 LEU 10 -5.351 2.452 -10.730 86 HG LEU 10 HG LEU 10 -6.005 1.542 -8.495 87 HD11 LEU 10 HD11 LEU 10 -8.438 2.228 -8.694 88 HD12 LEU 10 HD12 LEU 10 -8.127 2.448 -10.417 89 HD13 LEU 10 HD13 LEU 10 -7.234 3.402 -9.233 90 HD21 LEU 10 HD21 LEU 10 -8.072 -0.090 -9.912 91 HD22 LEU 10 HD22 LEU 10 -7.554 -0.164 -8.230 92 HD23 LEU 10 HD23 LEU 10 -6.498 -0.768 -9.506 93 H LYS 11 HN LYS 11 -7.910 2.721 -12.950 94 HA LYS 11 HA LYS 11 -5.829 3.706 -14.785 95 HB2 LYS 11 HB2 LYS 11 -8.800 3.444 -15.265 96 HB3 LYS 11 HB1 LYS 11 -7.753 4.438 -16.268 97 HG2 LYS 11 HG2 LYS 11 -6.446 2.449 -16.855 98 HG3 LYS 11 HG1 LYS 11 -7.530 1.461 -15.875 99 HD2 LYS 11 HD2 LYS 11 -9.409 2.085 -17.292 100 HD3 LYS 11 HD1 LYS 11 -8.359 3.133 -18.248 101 HE2 LYS 11 HE2 LYS 11 -7.039 1.195 -18.926 102 HE3 LYS 11 HE1 LYS 11 -8.075 0.144 -17.965 103 HZ1 LYS 11 HZ1 LYS 11 -8.523 1.278 -20.572 104 HZ2 LYS 11 HZ2 LYS 11 -9.844 1.448 -19.529 105 HZ3 LYS 11 HZ3 LYS 11 -9.216 -0.088 -19.853 106 H LEU 12 HN LEU 12 -5.318 5.757 -14.621 107 HA LEU 12 HA LEU 12 -7.031 7.449 -12.947 108 HB2 LEU 12 HB2 LEU 12 -4.279 6.956 -12.850 109 HB3 LEU 12 HB1 LEU 12 -4.417 8.561 -13.540 110 HG LEU 12 HG LEU 12 -5.596 7.684 -10.901 111 HD11 LEU 12 HD11 LEU 12 -3.273 9.518 -11.468 112 HD12 LEU 12 HD12 LEU 12 -3.131 7.847 -10.921 113 HD13 LEU 12 HD13 LEU 12 -3.894 9.053 -9.884 114 HD21 LEU 12 HD21 LEU 12 -5.724 10.239 -12.450 115 HD22 LEU 12 HD22 LEU 12 -5.795 10.253 -10.688 116 HD23 LEU 12 HD23 LEU 12 -7.012 9.373 -11.612 117 H TYR 13 HN TYR 13 -8.115 9.096 -13.988 118 HA TYR 13 HA TYR 13 -7.314 9.710 -16.749 119 HB2 TYR 13 HB2 TYR 13 -9.865 10.275 -15.216 120 HB3 TYR 13 HB1 TYR 13 -9.571 10.697 -16.899 121 HD1 TYR 13 HD1 TYR 13 -10.205 7.938 -14.558 122 HD2 TYR 13 HD2 TYR 13 -9.622 9.006 -18.636 123 HE1 TYR 13 HE1 TYR 13 -11.046 5.736 -15.247 124 HE2 TYR 13 HE2 TYR 13 -10.460 6.801 -19.335 125 HH TYR 13 HH TYR 13 -11.504 4.919 -18.654 126 H VAL 14 HN VAL 14 -6.163 11.532 -17.010 127 HA VAL 14 HA VAL 14 -6.511 13.694 -15.031 128 HB VAL 14 HB VAL 14 -4.112 14.238 -15.305 129 HG11 VAL 14 HG11 VAL 14 -4.876 11.553 -14.174 130 HG12 VAL 14 HG12 VAL 14 -4.747 13.093 -13.320 131 HG13 VAL 14 HG13 VAL 14 -3.294 12.291 -13.922 132 HG21 VAL 14 HG21 VAL 14 -3.890 11.519 -16.591 133 HG22 VAL 14 HG22 VAL 14 -2.583 12.657 -16.269 134 HG23 VAL 14 HG23 VAL 14 -3.812 13.045 -17.473 135 H ALA 15 HN ALA 15 -5.824 15.823 -15.824 136 HA ALA 15 HA ALA 15 -6.285 16.063 -18.722 137 HB1 ALA 15 HB1 ALA 15 -6.917 18.482 -17.268 138 HB2 ALA 15 HB2 ALA 15 -7.870 17.117 -16.683 139 HB3 ALA 15 HB3 ALA 15 -7.913 17.557 -18.390 140 H GLY 16 HN GLY 16 -4.305 16.351 -19.537 141 HA2 GLY 16 HA2 GLY 16 -2.298 17.343 -20.008 142 HA3 GLY 16 HA1 GLY 16 -2.933 18.777 -19.217 143 H ASN 17 HN ASN 17 -1.410 19.465 -17.866 144 HA ASN 17 HA ASN 17 -0.338 17.532 -15.923 145 HB2 ASN 17 HB2 ASN 17 1.246 18.410 -17.882 146 HB3 ASN 17 HB1 ASN 17 1.390 19.804 -16.816 147 HD21 ASN 17 HD21 ASN 17 3.410 19.585 -16.077 148 HD22 ASN 17 HD22 ASN 17 3.997 18.211 -15.211 149 H THR 18 HN THR 18 -2.503 18.888 -15.318 150 HA THR 18 HA THR 18 -2.020 21.429 -14.092 151 HB THR 18 HB THR 18 -4.280 20.815 -12.938 152 HG1 THR 18 HG1 THR 18 -4.655 19.052 -15.079 153 HG21 THR 18 HG21 THR 18 -5.510 21.303 -15.083 154 HG22 THR 18 HG22 THR 18 -3.956 21.203 -15.912 155 HG23 THR 18 HG23 THR 18 -4.223 22.441 -14.684 156 HA PRO 19 HA PRO 19 -0.245 20.305 -10.242 157 HB2 PRO 19 HB2 PRO 19 -1.817 21.771 -8.484 158 HB3 PRO 19 HB1 PRO 19 -0.429 22.403 -9.374 159 HG2 PRO 19 HG2 PRO 19 -3.345 22.601 -10.020 160 HG3 PRO 19 HG1 PRO 19 -2.076 23.828 -10.186 161 HD2 PRO 19 HD2 PRO 19 -2.982 22.494 -12.305 162 HD3 PRO 19 HD1 PRO 19 -1.255 22.887 -12.145 163 H ASN 20 HN ASN 20 -3.756 20.181 -10.419 164 HA ASN 20 HA ASN 20 -4.079 18.467 -8.161 165 HB2 ASN 20 HB2 ASN 20 -6.352 17.979 -9.286 166 HB3 ASN 20 HB1 ASN 20 -6.030 19.627 -8.762 167 HD21 ASN 20 HD21 ASN 20 -7.346 17.890 -11.162 168 HD22 ASN 20 HD22 ASN 20 -7.123 18.976 -12.485 169 H SER 21 HN SER 21 -3.819 17.930 -11.674 170 HA SER 21 HA SER 21 -4.065 15.079 -11.586 171 HB2 SER 21 HB2 SER 21 -2.807 16.917 -13.639 172 HB3 SER 21 HB1 SER 21 -3.103 15.194 -13.873 173 HG SER 21 HG SER 21 -4.878 17.329 -13.877 174 H VAL 22 HN VAL 22 -1.281 17.276 -11.562 175 HA VAL 22 HA VAL 22 0.647 15.207 -11.641 176 HB VAL 22 HB VAL 22 0.823 18.052 -10.611 177 HG11 VAL 22 HG11 VAL 22 3.327 17.696 -10.821 178 HG12 VAL 22 HG12 VAL 22 2.975 15.967 -10.828 179 HG13 VAL 22 HG13 VAL 22 2.529 16.952 -9.432 180 HG21 VAL 22 HG21 VAL 22 1.632 16.724 -13.183 181 HG22 VAL 22 HG22 VAL 22 2.221 18.314 -12.701 182 HG23 VAL 22 HG23 VAL 22 0.495 18.051 -12.946 183 H ARG 23 HN ARG 23 -0.832 16.975 -8.958 184 HA ARG 23 HA ARG 23 0.635 15.799 -6.861 185 HB2 ARG 23 HB2 ARG 23 -0.873 17.846 -6.806 186 HB3 ARG 23 HB1 ARG 23 -2.229 16.720 -6.753 187 HG2 ARG 23 HG2 ARG 23 -1.676 15.949 -4.646 188 HG3 ARG 23 HG1 ARG 23 -0.046 16.628 -4.712 189 HD2 ARG 23 HD2 ARG 23 -0.987 18.882 -4.674 190 HD3 ARG 23 HD1 ARG 23 -2.616 18.210 -4.628 191 HE ARG 23 HE ARG 23 -1.273 17.133 -2.467 192 HH11 ARG 23 HH11 ARG 23 -2.163 20.305 -3.594 193 HH12 ARG 23 HH12 ARG 23 -2.284 20.983 -2.005 194 HH21 ARG 23 HH21 ARG 23 -1.428 18.010 -0.366 195 HH22 ARG 23 HH22 ARG 23 -1.864 19.673 -0.165 196 H ALA 24 HN ALA 24 -2.493 14.989 -8.322 197 HA ALA 24 HA ALA 24 -3.053 12.799 -6.655 198 HB1 ALA 24 HB1 ALA 24 -4.484 14.139 -8.472 199 HB2 ALA 24 HB2 ALA 24 -4.938 12.546 -7.868 200 HB3 ALA 24 HB3 ALA 24 -4.097 12.696 -9.411 201 H LEU 25 HN LEU 25 -1.509 13.014 -9.828 202 HA LEU 25 HA LEU 25 -1.188 10.267 -10.327 203 HB2 LEU 25 HB2 LEU 25 -0.941 11.962 -12.059 204 HB3 LEU 25 HB1 LEU 25 0.470 12.614 -11.252 205 HG LEU 25 HG LEU 25 1.685 10.518 -11.698 206 HD11 LEU 25 HD11 LEU 25 0.105 8.823 -11.830 207 HD12 LEU 25 HD12 LEU 25 0.573 9.050 -13.515 208 HD13 LEU 25 HD13 LEU 25 -0.937 9.740 -12.919 209 HD21 LEU 25 HD21 LEU 25 0.464 11.821 -14.128 210 HD22 LEU 25 HD22 LEU 25 1.929 10.840 -14.118 211 HD23 LEU 25 HD23 LEU 25 1.890 12.373 -13.249 212 H LYS 26 HN LYS 26 1.037 12.584 -8.788 213 HA LYS 26 HA LYS 26 3.136 10.743 -8.389 214 HB2 LYS 26 HB2 LYS 26 2.451 13.436 -7.435 215 HB3 LYS 26 HB1 LYS 26 3.405 12.498 -6.296 216 HG2 LYS 26 HG2 LYS 26 4.848 13.832 -7.700 217 HG3 LYS 26 HG1 LYS 26 5.095 12.117 -8.033 218 HD2 LYS 26 HD2 LYS 26 4.137 12.247 -10.119 219 HD3 LYS 26 HD1 LYS 26 3.126 13.628 -9.686 220 HE2 LYS 26 HE2 LYS 26 4.879 14.280 -11.253 221 HE3 LYS 26 HE1 LYS 26 5.091 15.077 -9.694 222 HZ1 LYS 26 HZ1 LYS 26 7.207 14.361 -10.197 223 HZ2 LYS 26 HZ2 LYS 26 6.685 12.912 -10.898 224 HZ3 LYS 26 HZ3 LYS 26 6.650 13.099 -9.217 225 H THR 27 HN THR 27 0.364 11.643 -6.393 226 HA THR 27 HA THR 27 1.037 10.163 -4.090 227 HB THR 27 HB THR 27 -1.682 10.973 -5.143 228 HG1 THR 27 HG1 THR 27 -0.546 12.823 -4.772 229 HG21 THR 27 HG21 THR 27 -2.051 10.964 -2.531 230 HG22 THR 27 HG22 THR 27 -0.774 9.746 -2.586 231 HG23 THR 27 HG23 THR 27 -2.269 9.499 -3.488 232 H LEU 28 HN LEU 28 -0.959 9.345 -6.927 233 HA LEU 28 HA LEU 28 -1.704 6.775 -5.990 234 HB2 LEU 28 HB2 LEU 28 -2.124 8.380 -8.340 235 HB3 LEU 28 HB1 LEU 28 -1.725 6.742 -8.812 236 HG LEU 28 HG LEU 28 -4.079 6.829 -8.720 237 HD11 LEU 28 HD11 LEU 28 -3.966 5.697 -6.060 238 HD12 LEU 28 HD12 LEU 28 -2.657 5.116 -7.088 239 HD13 LEU 28 HD13 LEU 28 -4.333 4.931 -7.604 240 HD21 LEU 28 HD21 LEU 28 -3.600 8.681 -6.545 241 HD22 LEU 28 HD22 LEU 28 -4.850 7.501 -6.148 242 HD23 LEU 28 HD23 LEU 28 -5.010 8.502 -7.590 243 H ALA 29 HN ALA 29 0.783 7.807 -8.359 244 HA ALA 29 HA ALA 29 1.666 5.234 -9.022 245 HB1 ALA 29 HB1 ALA 29 3.848 6.950 -9.336 246 HB2 ALA 29 HB2 ALA 29 2.412 7.938 -9.606 247 HB3 ALA 29 HB3 ALA 29 2.665 6.472 -10.554 248 H ASN 30 HN ASN 30 2.896 7.477 -6.520 249 HA ASN 30 HA ASN 30 5.126 5.810 -5.863 250 HB2 ASN 30 HB2 ASN 30 4.554 8.366 -5.267 251 HB3 ASN 30 HB1 ASN 30 3.981 7.612 -3.784 252 HD21 ASN 30 HD21 ASN 30 5.849 5.529 -3.595 253 HD22 ASN 30 HD22 ASN 30 7.400 6.222 -3.269 254 H ILE 31 HN ILE 31 1.876 6.097 -4.519 255 HA ILE 31 HA ILE 31 2.319 4.308 -2.410 256 HB ILE 31 HB ILE 31 -0.192 5.230 -3.756 257 HG12 ILE 31 HG12 ILE 31 0.888 5.615 -0.964 258 HG13 ILE 31 HG11 ILE 31 1.183 6.725 -2.298 259 HG21 ILE 31 HG21 ILE 31 -1.521 3.786 -2.693 260 HG22 ILE 31 HG22 ILE 31 -0.568 3.856 -1.209 261 HG23 ILE 31 HG23 ILE 31 -0.077 2.787 -2.523 262 HD11 ILE 31 HD11 ILE 31 -1.086 7.325 -2.413 263 HD12 ILE 31 HD12 ILE 31 -0.637 7.364 -0.708 264 HD13 ILE 31 HD13 ILE 31 -1.561 6.006 -1.345 265 H LEU 32 HN LEU 32 1.096 3.816 -5.700 266 HA LEU 32 HA LEU 32 0.700 1.028 -5.387 267 HB2 LEU 32 HB2 LEU 32 0.884 2.792 -7.806 268 HB3 LEU 32 HB1 LEU 32 0.629 1.061 -7.927 269 HG LEU 32 HG LEU 32 -1.199 2.895 -6.365 270 HD11 LEU 32 HD11 LEU 32 -2.714 2.816 -8.241 271 HD12 LEU 32 HD12 LEU 32 -1.592 1.804 -9.152 272 HD13 LEU 32 HD13 LEU 32 -1.167 3.474 -8.776 273 HD21 LEU 32 HD21 LEU 32 -2.104 1.008 -5.651 274 HD22 LEU 32 HD22 LEU 32 -0.929 0.070 -6.572 275 HD23 LEU 32 HD23 LEU 32 -2.452 0.552 -7.318 276 H GLU 33 HN GLU 33 3.535 2.912 -6.209 277 HA GLU 33 HA GLU 33 4.955 0.563 -7.198 278 HB2 GLU 33 HB2 GLU 33 5.897 3.404 -6.777 279 HB3 GLU 33 HB1 GLU 33 6.884 2.116 -7.449 280 HG2 GLU 33 HG2 GLU 33 5.290 1.898 -9.312 281 HG3 GLU 33 HG1 GLU 33 4.359 3.236 -8.633 282 H LYS 34 HN LYS 34 4.253 1.701 -4.164 283 HA LYS 34 HA LYS 34 6.649 0.366 -3.097 284 HB2 LYS 34 HB2 LYS 34 6.906 2.781 -2.794 285 HB3 LYS 34 HB1 LYS 34 5.347 2.863 -1.988 286 HG2 LYS 34 HG2 LYS 34 7.085 2.946 -0.342 287 HG3 LYS 34 HG1 LYS 34 6.242 1.402 -0.199 288 HD2 LYS 34 HD2 LYS 34 8.025 0.286 -1.409 289 HD3 LYS 34 HD1 LYS 34 8.850 1.826 -1.660 290 HE2 LYS 34 HE2 LYS 34 9.119 2.072 0.759 291 HE3 LYS 34 HE1 LYS 34 8.292 0.535 1.008 292 HZ1 LYS 34 HZ1 LYS 34 10.064 -0.578 -0.193 293 HZ2 LYS 34 HZ2 LYS 34 10.693 0.287 1.116 294 HZ3 LYS 34 HZ3 LYS 34 10.854 0.896 -0.453 295 H GLU 35 HN GLU 35 3.533 1.670 -1.989 296 HA GLU 35 HA GLU 35 3.199 -0.184 0.107 297 HB2 GLU 35 HB2 GLU 35 1.287 1.657 -1.335 298 HB3 GLU 35 HB1 GLU 35 0.794 0.655 0.031 299 HG2 GLU 35 HG2 GLU 35 2.936 2.774 0.073 300 HG3 GLU 35 HG1 GLU 35 1.306 2.932 0.725 301 H PHE 36 HN PHE 36 1.963 -0.160 -3.229 302 HA PHE 36 HA PHE 36 1.042 -2.926 -2.773 303 HB2 PHE 36 HB2 PHE 36 -0.247 -0.835 -4.532 304 HB3 PHE 36 HB1 PHE 36 -0.748 -2.519 -4.433 305 HD1 PHE 36 HD1 PHE 36 -0.892 0.741 -2.895 306 HD2 PHE 36 HD2 PHE 36 -1.700 -3.396 -2.317 307 HE1 PHE 36 HE1 PHE 36 -2.340 1.295 -0.987 308 HE2 PHE 36 HE2 PHE 36 -3.152 -2.849 -0.409 309 HZ PHE 36 HZ PHE 36 -3.472 -0.500 0.258 310 H LYS 37 HN LYS 37 3.644 -2.034 -3.810 311 HA LYS 37 HA LYS 37 3.754 -2.249 -6.612 312 HB2 LYS 37 HB2 LYS 37 5.613 -1.371 -5.254 313 HB3 LYS 37 HB1 LYS 37 5.890 -2.980 -4.601 314 HG2 LYS 37 HG2 LYS 37 6.582 -3.812 -6.723 315 HG3 LYS 37 HG1 LYS 37 6.066 -2.333 -7.535 316 HD2 LYS 37 HD2 LYS 37 8.464 -2.312 -7.301 317 HD3 LYS 37 HD1 LYS 37 7.770 -1.083 -6.240 318 HE2 LYS 37 HE2 LYS 37 8.001 -2.560 -4.336 319 HE3 LYS 37 HE1 LYS 37 8.616 -3.844 -5.375 320 HZ1 LYS 37 HZ1 LYS 37 9.944 -1.211 -5.045 321 HZ2 LYS 37 HZ2 LYS 37 10.562 -2.576 -5.831 322 HZ3 LYS 37 HZ3 LYS 37 10.354 -2.589 -4.153 323 H GLY 38 HN GLY 38 3.590 -3.906 -7.956 324 HA2 GLY 38 HA2 GLY 38 3.906 -6.105 -8.714 325 HA3 GLY 38 HA1 GLY 38 4.219 -6.606 -7.060 326 H VAL 39 HN VAL 39 1.553 -4.847 -6.660 327 HA VAL 39 HA VAL 39 -0.161 -7.193 -7.092 328 HB VAL 39 HB VAL 39 -0.615 -4.926 -5.136 329 HG11 VAL 39 HG11 VAL 39 -2.688 -5.989 -5.903 330 HG12 VAL 39 HG12 VAL 39 -2.368 -6.340 -4.203 331 HG13 VAL 39 HG13 VAL 39 -2.051 -7.566 -5.431 332 HG21 VAL 39 HG21 VAL 39 1.354 -6.485 -4.693 333 HG22 VAL 39 HG22 VAL 39 0.148 -7.745 -4.430 334 HG23 VAL 39 HG23 VAL 39 0.162 -6.311 -3.404 335 H TYR 40 HN TYR 40 -0.050 -3.657 -7.482 336 HA TYR 40 HA TYR 40 -2.421 -3.972 -9.173 337 HB2 TYR 40 HB2 TYR 40 -1.563 -1.690 -7.423 338 HB3 TYR 40 HB1 TYR 40 -2.594 -1.372 -8.805 339 HD1 TYR 40 HD1 TYR 40 -2.391 -3.201 -5.591 340 HD2 TYR 40 HD2 TYR 40 -4.888 -1.753 -8.708 341 HE1 TYR 40 HE1 TYR 40 -4.374 -3.649 -4.207 342 HE2 TYR 40 HE2 TYR 40 -6.874 -2.203 -7.340 343 HH TYR 40 HH TYR 40 -6.738 -2.783 -4.067 344 H ALA 41 HN ALA 41 -2.517 -3.036 -11.175 345 HA ALA 41 HA ALA 41 0.026 -2.004 -12.240 346 HB1 ALA 41 HB1 ALA 41 -2.314 -2.933 -13.888 347 HB2 ALA 41 HB2 ALA 41 -1.122 -4.067 -13.248 348 HB3 ALA 41 HB3 ALA 41 -0.621 -2.794 -14.362 349 H LEU 42 HN LEU 42 0.123 0.138 -12.726 350 HA LEU 42 HA LEU 42 -2.368 1.653 -12.574 351 HB2 LEU 42 HB2 LEU 42 -0.597 2.397 -11.108 352 HB3 LEU 42 HB1 LEU 42 0.508 2.551 -12.460 353 HG LEU 42 HG LEU 42 -0.909 4.370 -13.378 354 HD11 LEU 42 HD11 LEU 42 -2.612 3.590 -11.109 355 HD12 LEU 42 HD12 LEU 42 -3.038 4.316 -12.658 356 HD13 LEU 42 HD13 LEU 42 -2.411 5.324 -11.353 357 HD21 LEU 42 HD21 LEU 42 0.259 5.893 -12.233 358 HD22 LEU 42 HD22 LEU 42 0.961 4.501 -11.409 359 HD23 LEU 42 HD23 LEU 42 -0.387 5.370 -10.678 360 H LYS 43 HN LYS 43 -3.319 2.556 -14.213 361 HA LYS 43 HA LYS 43 -1.833 3.005 -16.720 362 HB2 LYS 43 HB2 LYS 43 -4.268 1.482 -16.233 363 HB3 LYS 43 HB1 LYS 43 -4.549 2.794 -17.366 364 HG2 LYS 43 HG2 LYS 43 -4.014 0.882 -18.638 365 HG3 LYS 43 HG1 LYS 43 -2.606 1.942 -18.695 366 HD2 LYS 43 HD2 LYS 43 -1.460 0.601 -17.063 367 HD3 LYS 43 HD1 LYS 43 -2.903 -0.382 -16.796 368 HE2 LYS 43 HE2 LYS 43 -2.796 -1.175 -19.102 369 HE3 LYS 43 HE1 LYS 43 -1.365 -0.184 -19.383 370 HZ1 LYS 43 HZ1 LYS 43 -0.571 -2.328 -18.948 371 HZ2 LYS 43 HZ2 LYS 43 -1.626 -2.566 -17.648 372 HZ3 LYS 43 HZ3 LYS 43 -0.330 -1.491 -17.497 373 H VAL 44 HN VAL 44 -2.069 4.980 -17.636 374 HA VAL 44 HA VAL 44 -3.918 6.883 -16.316 375 HB VAL 44 HB VAL 44 -1.713 7.492 -15.629 376 HG11 VAL 44 HG11 VAL 44 -0.081 8.165 -17.594 377 HG12 VAL 44 HG12 VAL 44 -0.983 6.905 -18.437 378 HG13 VAL 44 HG13 VAL 44 -0.129 6.529 -16.939 379 HG21 VAL 44 HG21 VAL 44 -1.559 9.727 -16.377 380 HG22 VAL 44 HG22 VAL 44 -3.270 9.297 -16.424 381 HG23 VAL 44 HG23 VAL 44 -2.328 9.335 -17.915 382 H ILE 45 HN ILE 45 -5.219 7.998 -17.474 383 HA ILE 45 HA ILE 45 -4.996 7.801 -20.397 384 HB ILE 45 HB ILE 45 -7.461 8.277 -18.725 385 HG12 ILE 45 HG12 ILE 45 -6.584 6.060 -18.229 386 HG13 ILE 45 HG11 ILE 45 -8.066 5.927 -19.164 387 HG21 ILE 45 HG21 ILE 45 -7.520 9.080 -21.084 388 HG22 ILE 45 HG22 ILE 45 -8.731 7.847 -20.717 389 HG23 ILE 45 HG23 ILE 45 -7.269 7.415 -21.609 390 HD11 ILE 45 HD11 ILE 45 -6.305 4.325 -19.817 391 HD12 ILE 45 HD12 ILE 45 -5.297 5.685 -20.312 392 HD13 ILE 45 HD13 ILE 45 -6.825 5.374 -21.138 393 H ASP 46 HN ASP 46 -4.040 9.713 -20.985 394 HA ASP 46 HA ASP 46 -4.552 12.176 -19.626 395 HB2 ASP 46 HB2 ASP 46 -2.404 11.611 -20.808 396 HB3 ASP 46 HB1 ASP 46 -3.260 11.800 -22.333 397 H VAL 47 HN VAL 47 -6.560 12.910 -19.740 398 HA VAL 47 HA VAL 47 -8.404 12.516 -21.801 399 HB VAL 47 HB VAL 47 -8.296 14.499 -19.569 400 HG11 VAL 47 HG11 VAL 47 -9.947 15.655 -20.480 401 HG12 VAL 47 HG12 VAL 47 -10.958 14.218 -20.320 402 HG13 VAL 47 HG13 VAL 47 -10.073 14.512 -21.818 403 HG21 VAL 47 HG21 VAL 47 -10.351 12.445 -19.542 404 HG22 VAL 47 HG22 VAL 47 -9.210 12.922 -18.286 405 HG23 VAL 47 HG23 VAL 47 -8.710 11.793 -19.548 406 H LEU 48 HN LEU 48 -6.314 15.336 -21.165 407 HA LEU 48 HA LEU 48 -7.470 16.894 -23.252 408 HB2 LEU 48 HB2 LEU 48 -4.886 17.207 -21.750 409 HB3 LEU 48 HB1 LEU 48 -5.388 18.313 -23.014 410 HG LEU 48 HG LEU 48 -6.944 17.767 -20.482 411 HD11 LEU 48 HD11 LEU 48 -6.275 20.248 -20.120 412 HD12 LEU 48 HD12 LEU 48 -4.957 19.868 -21.230 413 HD13 LEU 48 HD13 LEU 48 -5.128 18.969 -19.721 414 HD21 LEU 48 HD21 LEU 48 -7.951 20.051 -21.375 415 HD22 LEU 48 HD22 LEU 48 -8.586 18.488 -21.886 416 HD23 LEU 48 HD23 LEU 48 -7.466 19.367 -22.927 417 H LYS 49 HN LYS 49 -4.695 14.724 -23.146 418 HA LYS 49 HA LYS 49 -3.689 15.425 -25.710 419 HB2 LYS 49 HB2 LYS 49 -2.324 14.321 -23.992 420 HB3 LYS 49 HB1 LYS 49 -3.326 12.883 -24.127 421 HG2 LYS 49 HG2 LYS 49 -2.606 12.558 -26.415 422 HG3 LYS 49 HG1 LYS 49 -1.646 14.039 -26.338 423 HD2 LYS 49 HD2 LYS 49 -0.305 13.070 -24.540 424 HD3 LYS 49 HD1 LYS 49 -1.253 11.584 -24.635 425 HE2 LYS 49 HE2 LYS 49 0.381 12.752 -26.880 426 HE3 LYS 49 HE1 LYS 49 0.899 11.431 -25.834 427 HZ1 LYS 49 HZ1 LYS 49 -0.870 11.385 -28.091 428 HZ2 LYS 49 HZ2 LYS 49 -1.523 10.607 -26.738 429 HZ3 LYS 49 HZ3 LYS 49 -0.026 10.116 -27.356 430 H ASN 50 HN ASN 50 -5.889 12.905 -24.546 431 HA ASN 50 HA ASN 50 -6.655 12.431 -27.349 432 HB2 ASN 50 HB2 ASN 50 -6.444 10.357 -25.158 433 HB3 ASN 50 HB1 ASN 50 -7.103 10.063 -26.761 434 HD21 ASN 50 HD21 ASN 50 -5.525 10.850 -28.554 435 HD22 ASN 50 HD22 ASN 50 -3.892 10.324 -28.362 436 HA PRO 51 HA PRO 51 -10.309 13.985 -25.055 437 HB2 PRO 51 HB2 PRO 51 -10.957 14.732 -27.862 438 HB3 PRO 51 HB1 PRO 51 -11.044 15.709 -26.390 439 HG2 PRO 51 HG2 PRO 51 -9.081 16.125 -28.121 440 HG3 PRO 51 HG1 PRO 51 -8.739 16.124 -26.380 441 HD2 PRO 51 HD2 PRO 51 -8.291 13.948 -28.393 442 HD3 PRO 51 HD1 PRO 51 -7.196 14.553 -27.127 443 H GLN 52 HN GLN 52 -10.043 12.115 -28.018 444 HA GLN 52 HA GLN 52 -12.710 11.210 -28.191 445 HB2 GLN 52 HB2 GLN 52 -10.120 9.977 -29.150 446 HB3 GLN 52 HB1 GLN 52 -11.709 9.341 -29.549 447 HG2 GLN 52 HG2 GLN 52 -11.410 10.603 -31.391 448 HG3 GLN 52 HG1 GLN 52 -12.059 11.865 -30.346 449 HE21 GLN 52 HE21 GLN 52 -10.403 12.282 -32.604 450 HE22 GLN 52 HE22 GLN 52 -8.931 12.999 -32.053 451 H LEU 53 HN LEU 53 -9.866 9.919 -26.548 452 HA LEU 53 HA LEU 53 -11.192 7.535 -25.753 453 HB2 LEU 53 HB2 LEU 53 -8.637 8.824 -24.798 454 HB3 LEU 53 HB1 LEU 53 -9.223 7.289 -24.179 455 HG LEU 53 HG LEU 53 -8.630 7.805 -27.090 456 HD11 LEU 53 HD11 LEU 53 -6.546 6.722 -26.818 457 HD12 LEU 53 HD12 LEU 53 -6.924 6.246 -25.162 458 HD13 LEU 53 HD13 LEU 53 -6.629 7.942 -25.546 459 HD21 LEU 53 HD21 LEU 53 -8.461 5.138 -26.723 460 HD22 LEU 53 HD22 LEU 53 -9.917 5.978 -27.257 461 HD23 LEU 53 HD23 LEU 53 -9.720 5.547 -25.557 462 H ALA 54 HN ALA 54 -10.655 10.702 -24.332 463 HA ALA 54 HA ALA 54 -11.594 10.129 -21.732 464 HB1 ALA 54 HB1 ALA 54 -12.204 12.743 -22.045 465 HB2 ALA 54 HB2 ALA 54 -10.991 12.532 -23.307 466 HB3 ALA 54 HB3 ALA 54 -10.595 12.147 -21.629 467 H GLU 55 HN GLU 55 -13.132 11.245 -24.696 468 HA GLU 55 HA GLU 55 -15.754 11.566 -23.635 469 HB2 GLU 55 HB2 GLU 55 -15.017 12.629 -25.749 470 HB3 GLU 55 HB1 GLU 55 -14.931 11.039 -26.497 471 HG2 GLU 55 HG2 GLU 55 -17.330 10.735 -26.149 472 HG3 GLU 55 HG1 GLU 55 -17.421 12.320 -25.385 473 H GLU 56 HN GLU 56 -14.041 8.863 -25.088 474 HA GLU 56 HA GLU 56 -16.238 7.153 -25.451 475 HB2 GLU 56 HB2 GLU 56 -13.346 6.507 -24.823 476 HB3 GLU 56 HB1 GLU 56 -14.542 5.291 -25.246 477 HG2 GLU 56 HG2 GLU 56 -14.869 6.434 -27.422 478 HG3 GLU 56 HG1 GLU 56 -13.571 7.558 -26.990 479 H ASP 57 HN ASP 57 -14.200 7.756 -22.610 480 HA ASP 57 HA ASP 57 -15.977 6.018 -21.060 481 HB2 ASP 57 HB2 ASP 57 -13.291 7.268 -20.400 482 HB3 ASP 57 HB1 ASP 57 -14.283 6.463 -19.188 483 H LYS 58 HN LYS 58 -16.224 8.958 -22.103 484 HA LYS 58 HA LYS 58 -17.204 10.897 -21.478 485 HB2 LYS 58 HB2 LYS 58 -18.730 8.931 -19.785 486 HB3 LYS 58 HB1 LYS 58 -19.207 10.612 -19.990 487 HG2 LYS 58 HG2 LYS 58 -18.818 8.733 -22.309 488 HG3 LYS 58 HG1 LYS 58 -20.368 8.944 -21.487 489 HD2 LYS 58 HD2 LYS 58 -20.261 11.362 -22.007 490 HD3 LYS 58 HD1 LYS 58 -18.762 11.079 -22.895 491 HE2 LYS 58 HE2 LYS 58 -21.424 9.807 -23.525 492 HE3 LYS 58 HE1 LYS 58 -20.739 11.197 -24.368 493 HZ1 LYS 58 HZ1 LYS 58 -18.747 9.344 -24.458 494 HZ2 LYS 58 HZ2 LYS 58 -19.828 9.698 -25.716 495 HZ3 LYS 58 HZ3 LYS 58 -20.145 8.410 -24.669 496 H ILE 59 HN ILE 59 -14.865 10.968 -20.363 497 HA ILE 59 HA ILE 59 -15.043 11.382 -17.500 498 HB ILE 59 HB ILE 59 -12.759 11.916 -19.406 499 HG12 ILE 59 HG12 ILE 59 -13.384 9.560 -19.400 500 HG13 ILE 59 HG11 ILE 59 -11.841 9.784 -18.579 501 HG21 ILE 59 HG21 ILE 59 -11.340 12.069 -17.496 502 HG22 ILE 59 HG22 ILE 59 -12.645 11.590 -16.412 503 HG23 ILE 59 HG23 ILE 59 -12.702 13.154 -17.226 504 HD11 ILE 59 HD11 ILE 59 -14.466 8.944 -17.502 505 HD12 ILE 59 HD12 ILE 59 -13.414 9.903 -16.457 506 HD13 ILE 59 HD13 ILE 59 -12.841 8.372 -17.119 507 H LEU 60 HN LEU 60 -16.079 13.175 -16.848 508 HA LEU 60 HA LEU 60 -15.662 15.672 -18.336 509 HB2 LEU 60 HB2 LEU 60 -17.783 14.968 -16.307 510 HB3 LEU 60 HB1 LEU 60 -17.662 16.494 -17.161 511 HG LEU 60 HG LEU 60 -18.174 13.811 -18.454 512 HD11 LEU 60 HD11 LEU 60 -20.072 14.561 -17.128 513 HD12 LEU 60 HD12 LEU 60 -20.427 14.681 -18.851 514 HD13 LEU 60 HD13 LEU 60 -20.029 16.131 -17.930 515 HD21 LEU 60 HD21 LEU 60 -18.813 15.390 -20.388 516 HD22 LEU 60 HD22 LEU 60 -17.103 15.077 -20.088 517 HD23 LEU 60 HD23 LEU 60 -17.833 16.586 -19.537 518 H ALA 61 HN ALA 61 -14.644 14.117 -15.526 519 HA ALA 61 HA ALA 61 -13.663 16.668 -14.453 520 HB1 ALA 61 HB1 ALA 61 -14.469 14.611 -12.469 521 HB2 ALA 61 HB2 ALA 61 -15.749 15.546 -13.244 522 HB3 ALA 61 HB3 ALA 61 -14.475 16.371 -12.346 523 H THR 62 HN THR 62 -11.596 16.604 -13.715 524 HA THR 62 HA THR 62 -10.256 14.015 -13.456 525 HB THR 62 HB THR 62 -8.257 14.972 -14.583 526 HG1 THR 62 HG1 THR 62 -9.294 17.233 -14.229 527 HG21 THR 62 HG21 THR 62 -9.790 13.579 -15.889 528 HG22 THR 62 HG22 THR 62 -9.078 14.851 -16.887 529 HG23 THR 62 HG23 THR 62 -10.739 15.008 -16.305 530 HA PRO 63 HA PRO 63 -8.174 13.419 -13.072 531 HB2 PRO 63 HB2 PRO 63 -7.104 12.178 -10.945 532 HB3 PRO 63 HB1 PRO 63 -6.239 13.428 -11.845 533 HG2 PRO 63 HG2 PRO 63 -7.694 13.631 -9.247 534 HG3 PRO 63 HG1 PRO 63 -6.149 14.351 -9.734 535 HD2 PRO 63 HD2 PRO 63 -8.525 15.718 -9.704 536 HD3 PRO 63 HD1 PRO 63 -7.159 16.128 -10.758 537 H THR 64 HN THR 64 -8.987 11.356 -13.080 538 HA THR 64 HA THR 64 -11.198 10.789 -11.209 539 HB THR 64 HB THR 64 -11.357 9.329 -13.726 540 HG1 THR 64 HG1 THR 64 -11.897 12.107 -13.945 541 HG21 THR 64 HG21 THR 64 -13.684 10.574 -13.593 542 HG22 THR 64 HG22 THR 64 -13.162 10.879 -11.937 543 HG23 THR 64 HG23 THR 64 -13.305 9.220 -12.526 544 H LEU 65 HN LEU 65 -10.871 9.005 -10.023 545 HA LEU 65 HA LEU 65 -8.779 7.110 -10.884 546 HB2 LEU 65 HB2 LEU 65 -8.467 8.234 -8.700 547 HB3 LEU 65 HB1 LEU 65 -9.988 7.558 -8.153 548 HG LEU 65 HG LEU 65 -9.032 5.279 -8.415 549 HD11 LEU 65 HD11 LEU 65 -6.462 5.268 -8.518 550 HD12 LEU 65 HD12 LEU 65 -6.628 6.869 -9.236 551 HD13 LEU 65 HD13 LEU 65 -7.359 5.470 -10.023 552 HD21 LEU 65 HD21 LEU 65 -7.714 5.335 -6.421 553 HD22 LEU 65 HD22 LEU 65 -8.991 6.541 -6.261 554 HD23 LEU 65 HD23 LEU 65 -7.346 7.045 -6.648 555 H ALA 66 HN ALA 66 -9.518 5.268 -11.768 556 HA ALA 66 HA ALA 66 -11.901 4.027 -10.582 557 HB1 ALA 66 HB1 ALA 66 -11.744 3.848 -13.532 558 HB2 ALA 66 HB2 ALA 66 -12.224 5.416 -12.873 559 HB3 ALA 66 HB3 ALA 66 -13.150 3.970 -12.474 560 H LYS 67 HN LYS 67 -11.871 1.933 -10.427 561 HA LYS 67 HA LYS 67 -9.473 0.525 -11.306 562 HB2 LYS 67 HB2 LYS 67 -10.033 0.158 -8.992 563 HB3 LYS 67 HB1 LYS 67 -11.714 -0.149 -9.391 564 HG2 LYS 67 HG2 LYS 67 -11.237 -2.280 -10.260 565 HG3 LYS 67 HG1 LYS 67 -9.508 -1.946 -10.356 566 HD2 LYS 67 HD2 LYS 67 -9.481 -3.179 -8.453 567 HD3 LYS 67 HD1 LYS 67 -9.861 -1.622 -7.721 568 HE2 LYS 67 HE2 LYS 67 -11.293 -3.444 -6.882 569 HE3 LYS 67 HE1 LYS 67 -12.220 -2.176 -7.673 570 HZ1 LYS 67 HZ1 LYS 67 -11.465 -4.187 -9.530 571 HZ2 LYS 67 HZ2 LYS 67 -13.010 -3.635 -9.127 572 HZ3 LYS 67 HZ3 LYS 67 -12.292 -4.870 -8.223 573 H VAL 68 HN VAL 68 -9.702 -0.065 -13.385 574 HA VAL 68 HA VAL 68 -12.286 -0.699 -14.457 575 HB VAL 68 HB VAL 68 -10.326 0.498 -15.633 576 HG11 VAL 68 HG11 VAL 68 -9.201 -2.100 -15.373 577 HG12 VAL 68 HG12 VAL 68 -8.488 -0.642 -16.060 578 HG13 VAL 68 HG13 VAL 68 -9.418 -1.736 -17.084 579 HG21 VAL 68 HG21 VAL 68 -12.272 0.253 -16.842 580 HG22 VAL 68 HG22 VAL 68 -12.175 -1.510 -16.843 581 HG23 VAL 68 HG23 VAL 68 -11.079 -0.566 -17.853 582 H LEU 69 HN LEU 69 -9.521 -2.466 -13.270 583 HA LEU 69 HA LEU 69 -11.070 -4.941 -13.662 584 HB2 LEU 69 HB2 LEU 69 -8.152 -4.623 -14.376 585 HB3 LEU 69 HB1 LEU 69 -8.979 -6.161 -14.270 586 HG LEU 69 HG LEU 69 -9.741 -3.972 -16.206 587 HD11 LEU 69 HD11 LEU 69 -7.758 -6.169 -16.366 588 HD12 LEU 69 HD12 LEU 69 -7.754 -4.577 -17.126 589 HD13 LEU 69 HD13 LEU 69 -8.760 -5.867 -17.786 590 HD21 LEU 69 HD21 LEU 69 -11.596 -5.408 -15.759 591 HD22 LEU 69 HD22 LEU 69 -10.587 -6.848 -15.906 592 HD23 LEU 69 HD23 LEU 69 -10.929 -5.862 -17.327 593 HA PRO 70 HA PRO 70 -10.913 -7.031 -13.171 594 HB2 PRO 70 HB2 PRO 70 -12.096 -8.567 -11.315 595 HB3 PRO 70 HB1 PRO 70 -10.385 -8.763 -11.720 596 HG2 PRO 70 HG2 PRO 70 -11.629 -7.302 -9.415 597 HG3 PRO 70 HG1 PRO 70 -10.249 -8.416 -9.414 598 HD2 PRO 70 HD2 PRO 70 -9.974 -5.705 -9.406 599 HD3 PRO 70 HD1 PRO 70 -8.784 -6.798 -10.140 600 HA PRO 71 HA PRO 71 -14.883 -5.025 -13.260 601 HB2 PRO 71 HB2 PRO 71 -16.020 -7.689 -13.931 602 HB3 PRO 71 HB1 PRO 71 -16.134 -6.164 -14.817 603 HG2 PRO 71 HG2 PRO 71 -14.547 -8.095 -15.699 604 HG3 PRO 71 HG1 PRO 71 -14.014 -6.403 -15.756 605 HD2 PRO 71 HD2 PRO 71 -13.282 -8.551 -13.796 606 HD3 PRO 71 HD1 PRO 71 -12.246 -7.342 -14.579 607 HA PRO 72 HA PRO 72 -17.100 -4.551 -13.210 608 HB2 PRO 72 HB2 PRO 72 -18.562 -2.978 -11.610 609 HB3 PRO 72 HB1 PRO 72 -19.148 -4.562 -12.136 610 HG2 PRO 72 HG2 PRO 72 -17.863 -3.788 -9.538 611 HG3 PRO 72 HG1 PRO 72 -19.305 -4.784 -9.815 612 HD2 PRO 72 HD2 PRO 72 -16.839 -5.837 -9.328 613 HD3 PRO 72 HD1 PRO 72 -18.066 -6.659 -10.310 614 H VAL 73 HN VAL 73 -16.886 -2.203 -13.461 615 HA VAL 73 HA VAL 73 -14.333 -1.281 -12.561 616 HB VAL 73 HB VAL 73 -16.505 0.191 -14.074 617 HG11 VAL 73 HG11 VAL 73 -14.418 1.526 -14.849 618 HG12 VAL 73 HG12 VAL 73 -13.694 0.918 -13.361 619 HG13 VAL 73 HG13 VAL 73 -15.158 1.899 -13.293 620 HG21 VAL 73 HG21 VAL 73 -15.969 -1.219 -15.722 621 HG22 VAL 73 HG22 VAL 73 -14.547 -1.814 -14.866 622 HG23 VAL 73 HG23 VAL 73 -14.446 -0.336 -15.823 623 H ARG 74 HN ARG 74 -13.876 -0.132 -10.801 624 HA ARG 74 HA ARG 74 -16.094 1.089 -9.291 625 HB2 ARG 74 HB2 ARG 74 -15.048 -0.603 -7.981 626 HB3 ARG 74 HB1 ARG 74 -13.442 -0.042 -8.414 627 HG2 ARG 74 HG2 ARG 74 -13.930 0.557 -6.138 628 HG3 ARG 74 HG1 ARG 74 -13.831 2.015 -7.124 629 HD2 ARG 74 HD2 ARG 74 -15.708 2.194 -5.619 630 HD3 ARG 74 HD1 ARG 74 -16.300 2.037 -7.271 631 HE ARG 74 HE ARG 74 -16.159 -0.502 -6.036 632 HH11 ARG 74 HH11 ARG 74 -18.022 2.440 -6.031 633 HH12 ARG 74 HH12 ARG 74 -19.489 1.668 -5.527 634 HH21 ARG 74 HH21 ARG 74 -18.081 -1.534 -5.372 635 HH22 ARG 74 HH22 ARG 74 -19.521 -0.599 -5.150 636 H ARG 75 HN ARG 75 -16.238 3.212 -9.423 637 HA ARG 75 HA ARG 75 -13.828 4.741 -10.068 638 HB2 ARG 75 HB2 ARG 75 -16.752 5.410 -10.269 639 HB3 ARG 75 HB1 ARG 75 -15.489 6.621 -10.424 640 HG2 ARG 75 HG2 ARG 75 -14.545 5.385 -12.314 641 HG3 ARG 75 HG1 ARG 75 -15.858 4.211 -12.185 642 HD2 ARG 75 HD2 ARG 75 -16.276 7.158 -12.607 643 HD3 ARG 75 HD1 ARG 75 -16.162 5.996 -13.925 644 HE ARG 75 HE ARG 75 -18.187 4.974 -13.113 645 HH11 ARG 75 HH11 ARG 75 -17.405 8.076 -11.722 646 HH12 ARG 75 HH12 ARG 75 -19.027 8.402 -11.214 647 HH21 ARG 75 HH21 ARG 75 -20.321 5.394 -12.448 648 HH22 ARG 75 HH22 ARG 75 -20.688 6.873 -11.626 649 H ILE 76 HN ILE 76 -12.806 5.760 -8.549 650 HA ILE 76 HA ILE 76 -14.168 6.334 -6.008 651 HB ILE 76 HB ILE 76 -11.213 6.240 -6.613 652 HG12 ILE 76 HG12 ILE 76 -12.971 4.273 -5.125 653 HG13 ILE 76 HG11 ILE 76 -12.350 4.043 -6.759 654 HG21 ILE 76 HG21 ILE 76 -12.784 6.863 -4.147 655 HG22 ILE 76 HG22 ILE 76 -11.341 7.650 -4.786 656 HG23 ILE 76 HG23 ILE 76 -11.214 6.073 -4.005 657 HD11 ILE 76 HD11 ILE 76 -10.188 3.744 -6.028 658 HD12 ILE 76 HD12 ILE 76 -11.149 2.915 -4.802 659 HD13 ILE 76 HD13 ILE 76 -10.498 4.523 -4.478 660 H ILE 77 HN ILE 77 -14.854 8.389 -5.786 661 HA ILE 77 HA ILE 77 -13.322 10.519 -7.122 662 HB ILE 77 HB ILE 77 -16.254 10.633 -6.440 663 HG12 ILE 77 HG12 ILE 77 -15.982 10.639 -9.217 664 HG13 ILE 77 HG11 ILE 77 -14.882 9.374 -8.674 665 HG21 ILE 77 HG21 ILE 77 -14.821 12.370 -8.415 666 HG22 ILE 77 HG22 ILE 77 -14.806 12.757 -6.695 667 HG23 ILE 77 HG23 ILE 77 -16.338 12.667 -7.563 668 HD11 ILE 77 HD11 ILE 77 -17.144 8.555 -9.212 669 HD12 ILE 77 HD12 ILE 77 -17.785 9.556 -7.910 670 HD13 ILE 77 HD13 ILE 77 -16.669 8.241 -7.543 671 H GLY 78 HN GLY 78 -12.401 11.984 -5.844 672 HA2 GLY 78 HA2 GLY 78 -13.472 13.274 -3.666 673 HA3 GLY 78 HA1 GLY 78 -12.687 11.844 -3.004 674 H ASP 79 HN ASP 79 -11.321 13.451 -1.890 675 HA ASP 79 HA ASP 79 -9.468 14.961 -3.521 676 HB2 ASP 79 HB2 ASP 79 -10.241 15.871 -1.360 677 HB3 ASP 79 HB1 ASP 79 -9.513 14.503 -0.525 678 H LEU 80 HN LEU 80 -8.156 13.630 -4.661 679 HA LEU 80 HA LEU 80 -6.952 11.314 -3.402 680 HB2 LEU 80 HB2 LEU 80 -6.588 12.452 -6.176 681 HB3 LEU 80 HB1 LEU 80 -5.937 10.926 -5.618 682 HG LEU 80 HG LEU 80 -8.876 11.575 -5.863 683 HD11 LEU 80 HD11 LEU 80 -8.908 10.436 -7.868 684 HD12 LEU 80 HD12 LEU 80 -7.399 9.586 -7.529 685 HD13 LEU 80 HD13 LEU 80 -7.369 11.294 -7.967 686 HD21 LEU 80 HD21 LEU 80 -8.674 9.972 -4.156 687 HD22 LEU 80 HD22 LEU 80 -7.376 9.121 -4.993 688 HD23 LEU 80 HD23 LEU 80 -9.024 9.042 -5.613 689 H SER 81 HN SER 81 -6.206 14.552 -3.530 690 HA SER 81 HA SER 81 -3.403 14.453 -3.942 691 HB2 SER 81 HB2 SER 81 -5.047 16.509 -2.437 692 HB3 SER 81 HB1 SER 81 -3.387 16.722 -3.004 693 HG SER 81 HG SER 81 -4.091 17.062 -4.956 694 H ASN 82 HN ASN 82 -5.413 13.616 -1.313 695 HA ASN 82 HA ASN 82 -3.279 13.733 0.659 696 HB2 ASN 82 HB2 ASN 82 -5.642 14.314 1.254 697 HB3 ASN 82 HB1 ASN 82 -6.076 12.640 0.947 698 HD21 ASN 82 HD21 ASN 82 -6.516 13.910 3.376 699 HD22 ASN 82 HD22 ASN 82 -5.524 13.171 4.582 700 H ARG 83 HN ARG 83 -1.879 12.134 0.852 701 HA ARG 83 HA ARG 83 -2.013 9.797 -0.644 702 HB2 ARG 83 HB2 ARG 83 -0.318 10.517 1.748 703 HB3 ARG 83 HB1 ARG 83 -0.135 8.983 0.912 704 HG2 ARG 83 HG2 ARG 83 1.294 9.983 -0.453 705 HG3 ARG 83 HG1 ARG 83 -0.059 10.918 -1.096 706 HD2 ARG 83 HD2 ARG 83 1.263 11.824 1.418 707 HD3 ARG 83 HD1 ARG 83 2.067 12.114 -0.125 708 HE ARG 83 HE ARG 83 -0.422 13.035 -0.580 709 HH11 ARG 83 HH11 ARG 83 1.875 13.616 1.975 710 HH12 ARG 83 HH12 ARG 83 1.322 15.230 2.280 711 HH21 ARG 83 HH21 ARG 83 -1.157 15.145 -0.198 712 HH22 ARG 83 HH22 ARG 83 -0.409 16.102 1.041 713 H GLU 84 HN GLU 84 -3.080 10.375 2.672 714 HA GLU 84 HA GLU 84 -3.404 7.686 3.439 715 HB2 GLU 84 HB2 GLU 84 -4.803 10.205 4.293 716 HB3 GLU 84 HB1 GLU 84 -5.191 8.634 4.983 717 HG2 GLU 84 HG2 GLU 84 -3.002 8.381 5.852 718 HG3 GLU 84 HG1 GLU 84 -2.420 9.796 4.973 719 H LYS 85 HN LYS 85 -5.721 9.867 1.776 720 HA LYS 85 HA LYS 85 -7.782 7.922 1.785 721 HB2 LYS 85 HB2 LYS 85 -7.326 10.337 0.020 722 HB3 LYS 85 HB1 LYS 85 -8.727 9.290 -0.166 723 HG2 LYS 85 HG2 LYS 85 -9.432 9.831 2.109 724 HG3 LYS 85 HG1 LYS 85 -8.027 10.882 2.295 725 HD2 LYS 85 HD2 LYS 85 -8.815 12.266 0.430 726 HD3 LYS 85 HD1 LYS 85 -10.200 11.198 0.223 727 HE2 LYS 85 HE2 LYS 85 -10.865 13.178 1.450 728 HE3 LYS 85 HE1 LYS 85 -10.964 11.760 2.492 729 HZ1 LYS 85 HZ1 LYS 85 -9.966 13.624 3.644 730 HZ2 LYS 85 HZ2 LYS 85 -8.754 13.742 2.470 731 HZ3 LYS 85 HZ3 LYS 85 -8.837 12.376 3.464 732 H VAL 86 HN VAL 86 -5.264 8.645 -0.577 733 HA VAL 86 HA VAL 86 -6.161 6.805 -2.519 734 HB VAL 86 HB VAL 86 -3.385 7.879 -1.970 735 HG11 VAL 86 HG11 VAL 86 -3.227 7.119 -4.515 736 HG12 VAL 86 HG12 VAL 86 -4.357 5.890 -3.946 737 HG13 VAL 86 HG13 VAL 86 -2.774 6.052 -3.186 738 HG21 VAL 86 HG21 VAL 86 -5.747 8.789 -3.450 739 HG22 VAL 86 HG22 VAL 86 -4.239 8.870 -4.361 740 HG23 VAL 86 HG23 VAL 86 -4.382 9.707 -2.814 741 H LEU 87 HN LEU 87 -3.867 6.450 0.180 742 HA LEU 87 HA LEU 87 -3.209 3.741 -0.343 743 HB2 LEU 87 HB2 LEU 87 -1.752 5.116 0.998 744 HB3 LEU 87 HB1 LEU 87 -3.040 5.456 2.134 745 HG LEU 87 HG LEU 87 -3.029 3.087 2.818 746 HD11 LEU 87 HD11 LEU 87 -2.179 1.682 1.285 747 HD12 LEU 87 HD12 LEU 87 -0.649 2.045 2.087 748 HD13 LEU 87 HD13 LEU 87 -1.096 2.904 0.614 749 HD21 LEU 87 HD21 LEU 87 -1.167 3.277 4.237 750 HD22 LEU 87 HD22 LEU 87 -1.660 4.938 3.898 751 HD23 LEU 87 HD23 LEU 87 -0.269 4.240 3.065 752 H ILE 88 HN ILE 88 -5.561 5.211 1.885 753 HA ILE 88 HA ILE 88 -6.442 2.785 3.005 754 HB ILE 88 HB ILE 88 -7.759 5.479 2.777 755 HG12 ILE 88 HG12 ILE 88 -6.700 4.008 5.193 756 HG13 ILE 88 HG11 ILE 88 -5.698 5.069 4.209 757 HG21 ILE 88 HG21 ILE 88 -9.588 3.948 2.889 758 HG22 ILE 88 HG22 ILE 88 -9.368 4.628 4.502 759 HG23 ILE 88 HG23 ILE 88 -8.792 2.999 4.145 760 HD11 ILE 88 HD11 ILE 88 -7.595 5.711 6.283 761 HD12 ILE 88 HD12 ILE 88 -7.919 6.599 4.795 762 HD13 ILE 88 HD13 ILE 88 -6.329 6.702 5.556 763 H ALA 89 HN ALA 89 -7.747 4.669 0.265 764 HA ALA 89 HA ALA 89 -9.915 2.937 -0.267 765 HB1 ALA 89 HB1 ALA 89 -10.429 4.454 -1.816 766 HB2 ALA 89 HB2 ALA 89 -8.891 4.227 -2.651 767 HB3 ALA 89 HB3 ALA 89 -8.999 5.345 -1.290 768 H LEU 90 HN LEU 90 -6.590 2.972 -1.478 769 HA LEU 90 HA LEU 90 -6.946 0.887 -3.376 770 HB2 LEU 90 HB2 LEU 90 -4.651 2.314 -2.167 771 HB3 LEU 90 HB1 LEU 90 -4.311 0.707 -2.773 772 HG LEU 90 HG LEU 90 -4.823 1.313 -4.995 773 HD11 LEU 90 HD11 LEU 90 -6.816 2.516 -4.916 774 HD12 LEU 90 HD12 LEU 90 -5.636 3.710 -5.458 775 HD13 LEU 90 HD13 LEU 90 -6.169 3.698 -3.776 776 HD21 LEU 90 HD21 LEU 90 -3.530 3.805 -3.946 777 HD22 LEU 90 HD22 LEU 90 -3.205 2.933 -5.443 778 HD23 LEU 90 HD23 LEU 90 -2.706 2.246 -3.895 779 H ARG 91 HN ARG 91 -6.048 0.935 0.042 780 HA ARG 91 HA ARG 91 -5.303 -1.796 0.275 781 HB2 ARG 91 HB2 ARG 91 -4.705 -0.071 1.937 782 HB3 ARG 91 HB1 ARG 91 -6.402 0.096 2.364 783 HG2 ARG 91 HG2 ARG 91 -6.464 -2.128 3.249 784 HG3 ARG 91 HG1 ARG 91 -4.835 -2.458 2.658 785 HD2 ARG 91 HD2 ARG 91 -5.513 -0.325 4.678 786 HD3 ARG 91 HD1 ARG 91 -4.957 -1.945 5.095 787 HE ARG 91 HE ARG 91 -3.109 -0.859 3.319 788 HH11 ARG 91 HH11 ARG 91 -4.303 -0.260 6.534 789 HH12 ARG 91 HH12 ARG 91 -2.821 0.435 7.100 790 HH21 ARG 91 HH21 ARG 91 -1.150 0.052 4.045 791 HH22 ARG 91 HH22 ARG 91 -1.023 0.613 5.678 792 H LEU 92 HN LEU 92 -8.378 -0.094 0.849 793 HA LEU 92 HA LEU 92 -9.822 -2.356 1.686 794 HB2 LEU 92 HB2 LEU 92 -10.728 0.211 0.385 795 HB3 LEU 92 HB1 LEU 92 -11.843 -1.006 0.975 796 HG LEU 92 HG LEU 92 -9.819 0.407 2.712 797 HD11 LEU 92 HD11 LEU 92 -11.813 1.621 3.595 798 HD12 LEU 92 HD12 LEU 92 -12.735 0.983 2.233 799 HD13 LEU 92 HD13 LEU 92 -11.363 2.055 1.946 800 HD21 LEU 92 HD21 LEU 92 -10.301 -1.411 3.971 801 HD22 LEU 92 HD22 LEU 92 -11.826 -1.720 3.141 802 HD23 LEU 92 HD23 LEU 92 -11.732 -0.464 4.375 803 H LEU 93 HN LEU 93 -9.249 -1.027 -1.535 804 HA LEU 93 HA LEU 93 -11.042 -2.743 -2.910 805 HB2 LEU 93 HB2 LEU 93 -8.566 -1.289 -3.829 806 HB3 LEU 93 HB1 LEU 93 -9.588 -2.218 -4.908 807 HG LEU 93 HG LEU 93 -10.540 0.154 -3.302 808 HD11 LEU 93 HD11 LEU 93 -9.110 -0.043 -5.850 809 HD12 LEU 93 HD12 LEU 93 -9.329 1.335 -4.770 810 HD13 LEU 93 HD13 LEU 93 -10.597 0.903 -5.920 811 HD21 LEU 93 HD21 LEU 93 -12.588 -0.323 -4.032 812 HD22 LEU 93 HD22 LEU 93 -11.963 -1.884 -4.566 813 HD23 LEU 93 HD23 LEU 93 -12.018 -0.526 -5.688 814 H ALA 94 HN ALA 94 -7.636 -2.988 -2.026 815 HA ALA 94 HA ALA 94 -7.038 -5.319 -3.483 816 HB1 ALA 94 HB1 ALA 94 -5.647 -4.680 -0.915 817 HB2 ALA 94 HB2 ALA 94 -5.454 -3.630 -2.321 818 HB3 ALA 94 HB3 ALA 94 -4.985 -5.327 -2.417 819 H GLU 95 HN GLU 95 -8.315 -4.870 -0.217 820 HA GLU 95 HA GLU 95 -8.078 -7.538 0.635 821 HB2 GLU 95 HB2 GLU 95 -10.014 -5.342 1.378 822 HB3 GLU 95 HB1 GLU 95 -9.973 -6.901 2.191 823 HG2 GLU 95 HG2 GLU 95 -7.719 -4.905 2.065 824 HG3 GLU 95 HG1 GLU 95 -8.763 -5.215 3.452 825 H GLU 96 HN GLU 96 -10.561 -5.822 -1.172 826 HA GLU 96 HA GLU 96 -12.497 -7.871 -1.251 827 HB2 GLU 96 HB2 GLU 96 -11.897 -5.579 -3.130 828 HB3 GLU 96 HB1 GLU 96 -13.280 -6.651 -3.328 829 HG2 GLU 96 HG2 GLU 96 -14.221 -5.938 -1.247 830 HG3 GLU 96 HG1 GLU 96 -12.768 -5.023 -0.847 831 H ILE 97 HN ILE 97 -9.786 -7.056 -3.343 832 HA ILE 97 HA ILE 97 -10.282 -8.965 -5.369 833 HB ILE 97 HB ILE 97 -7.730 -7.580 -4.528 834 HG12 ILE 97 HG12 ILE 97 -9.576 -7.033 -6.855 835 HG13 ILE 97 HG11 ILE 97 -9.701 -6.215 -5.299 836 HG21 ILE 97 HG21 ILE 97 -6.759 -8.227 -6.632 837 HG22 ILE 97 HG22 ILE 97 -8.261 -9.005 -7.137 838 HG23 ILE 97 HG23 ILE 97 -7.318 -9.689 -5.814 839 HD11 ILE 97 HD11 ILE 97 -8.294 -5.310 -7.405 840 HD12 ILE 97 HD12 ILE 97 -7.042 -6.153 -6.492 841 HD13 ILE 97 HD13 ILE 97 -7.989 -4.877 -5.723 842 H GLY 98 HN GLY 98 -8.201 -8.995 -2.494 843 HA2 GLY 98 HA2 GLY 98 -7.088 -11.557 -2.883 844 HA3 GLY 98 HA1 GLY 98 -7.193 -10.710 -1.347 845 H ASP 99 HN ASP 99 -10.068 -10.531 -1.301 846 HA ASP 99 HA ASP 99 -10.663 -13.350 -0.688 847 HB2 ASP 99 HB2 ASP 99 -10.727 -11.471 1.110 848 HB3 ASP 99 HB1 ASP 99 -12.255 -11.024 0.356 849 H TYR 100 HN TYR 100 -10.913 -12.324 -3.356 850 HA TYR 100 HA TYR 100 -13.753 -11.957 -3.797 851 HB2 TYR 100 HB2 TYR 100 -12.172 -10.647 -5.139 852 HB3 TYR 100 HB1 TYR 100 -11.447 -12.128 -5.753 853 HD1 TYR 100 HD1 TYR 100 -14.609 -10.177 -5.711 854 HD2 TYR 100 HD2 TYR 100 -12.313 -13.176 -7.672 855 HE1 TYR 100 HE1 TYR 100 -16.208 -10.174 -7.579 856 HE2 TYR 100 HE2 TYR 100 -13.908 -13.180 -9.544 857 HH TYR 100 HH TYR 100 -16.868 -12.093 -9.441 858 H LYS 101 HN LYS 101 -15.064 -13.609 -3.974 859 HA LYS 101 HA LYS 101 -14.002 -16.199 -4.878 860 HB2 LYS 101 HB2 LYS 101 -16.388 -15.588 -3.121 861 HB3 LYS 101 HB1 LYS 101 -15.959 -17.195 -3.691 862 HG2 LYS 101 HG2 LYS 101 -13.832 -17.055 -2.492 863 HG3 LYS 101 HG1 LYS 101 -14.264 -15.442 -1.920 864 HD2 LYS 101 HD2 LYS 101 -16.207 -16.377 -0.759 865 HD3 LYS 101 HD1 LYS 101 -15.773 -17.989 -1.331 866 HE2 LYS 101 HE2 LYS 101 -13.656 -17.850 -0.117 867 HE3 LYS 101 HE1 LYS 101 -14.082 -16.235 0.447 868 HZ1 LYS 101 HZ1 LYS 101 -16.126 -17.366 1.428 869 HZ2 LYS 101 HZ2 LYS 101 -14.644 -17.633 2.199 870 HZ3 LYS 101 HZ3 LYS 101 -15.298 -18.822 1.190 871 H ASP 102 HN ASP 102 -15.060 -17.339 -6.478 872 HA ASP 102 HA ASP 102 -16.840 -15.753 -8.153 873 HB2 ASP 102 HB2 ASP 102 -14.893 -16.940 -9.158 874 HB3 ASP 102 HB1 ASP 102 -15.623 -18.474 -8.690 875 H ASP 103 HN ASP 103 -18.902 -15.824 -7.458 876 HA ASP 103 HA ASP 103 -20.030 -18.323 -6.476 877 HB2 ASP 103 HB2 ASP 103 -20.535 -16.240 -5.264 878 HB3 ASP 103 HB1 ASP 103 -21.280 -15.575 -6.715 879 H ASP 104 HN ASP 104 -20.501 -19.708 -8.084 880 HA ASP 104 HA ASP 104 -21.790 -18.693 -10.505 881 HB2 ASP 104 HB2 ASP 104 -21.365 -20.910 -11.466 882 HB3 ASP 104 HB1 ASP 104 -19.888 -20.190 -10.844 883 H ASP 105 HN ASP 105 -22.886 -19.426 -7.634 884 HA ASP 105 HA ASP 105 -24.921 -19.922 -6.771 885 HB2 ASP 105 HB2 ASP 105 -25.822 -18.728 -8.761 886 HB3 ASP 105 HB1 ASP 105 -25.881 -20.265 -9.618 887 H LYS 106 HN LYS 106 -24.707 -22.051 -9.642 888 HA LYS 106 HA LYS 106 -25.072 -24.333 -7.805 889 HB2 LYS 106 HB2 LYS 106 -25.970 -24.001 -10.672 890 HB3 LYS 106 HB1 LYS 106 -26.007 -25.534 -9.813 891 HG2 LYS 106 HG2 LYS 106 -27.550 -24.580 -8.172 892 HG3 LYS 106 HG1 LYS 106 -27.513 -23.041 -9.036 893 HD2 LYS 106 HD2 LYS 106 -28.429 -24.151 -11.027 894 HD3 LYS 106 HD1 LYS 106 -28.486 -25.677 -10.142 895 HE2 LYS 106 HE2 LYS 106 -29.970 -23.160 -9.391 896 HE3 LYS 106 HE1 LYS 106 -30.674 -24.551 -10.213 897 HZ1 LYS 106 HZ1 LYS 106 -31.205 -25.073 -8.091 898 HZ2 LYS 106 HZ2 LYS 106 -29.894 -24.243 -7.419 899 HZ3 LYS 106 HZ3 LYS 106 -29.661 -25.768 -8.114 Start of MODEL 16 1 H1 MET 1 HT1 MET 1 -10.363 -6.639 -22.669 2 H2 MET 1 HT2 MET 1 -9.129 -5.660 -22.050 3 H3 MET 1 HT3 MET 1 -10.448 -4.958 -22.840 4 HA MET 1 HA MET 1 -10.362 -4.922 -20.288 5 HB2 MET 1 HB2 MET 1 -12.825 -5.855 -21.777 6 HB3 MET 1 HB1 MET 1 -12.821 -5.105 -20.187 7 HG2 MET 1 HG2 MET 1 -11.983 -3.833 -22.782 8 HG3 MET 1 HG1 MET 1 -13.439 -3.484 -21.852 9 HE1 MET 1 HE1 MET 1 -12.050 -3.111 -18.624 10 HE2 MET 1 HE2 MET 1 -13.489 -2.724 -19.567 11 HE3 MET 1 HE3 MET 1 -12.453 -1.428 -18.966 12 H ALA 2 HN ALA 2 -9.276 -7.561 -21.211 13 HA ALA 2 HA ALA 2 -10.830 -9.540 -19.801 14 HB1 ALA 2 HB1 ALA 2 -9.253 -11.118 -20.544 15 HB2 ALA 2 HB2 ALA 2 -8.004 -9.892 -20.761 16 HB3 ALA 2 HB3 ALA 2 -9.383 -9.953 -21.860 17 HA PRO 3 HA PRO 3 -9.111 -8.461 -15.796 18 HB2 PRO 3 HB2 PRO 3 -10.224 -11.135 -15.115 19 HB3 PRO 3 HB1 PRO 3 -10.488 -9.575 -14.328 20 HG2 PRO 3 HG2 PRO 3 -12.393 -10.634 -15.837 21 HG3 PRO 3 HG1 PRO 3 -12.054 -8.894 -15.917 22 HD2 PRO 3 HD2 PRO 3 -11.234 -11.070 -17.812 23 HD3 PRO 3 HD1 PRO 3 -11.853 -9.441 -18.165 24 H LEU 4 HN LEU 4 -7.280 -8.945 -14.710 25 HA LEU 4 HA LEU 4 -5.672 -11.155 -15.761 26 HB2 LEU 4 HB2 LEU 4 -4.804 -8.804 -14.073 27 HB3 LEU 4 HB1 LEU 4 -3.753 -9.969 -14.857 28 HG LEU 4 HG LEU 4 -5.521 -7.959 -16.253 29 HD11 LEU 4 HD11 LEU 4 -2.516 -8.105 -16.114 30 HD12 LEU 4 HD12 LEU 4 -3.513 -7.039 -15.123 31 HD13 LEU 4 HD13 LEU 4 -3.495 -6.850 -16.876 32 HD21 LEU 4 HD21 LEU 4 -3.908 -10.261 -17.240 33 HD22 LEU 4 HD22 LEU 4 -3.995 -8.795 -18.216 34 HD23 LEU 4 HD23 LEU 4 -5.473 -9.658 -17.787 35 H ARG 5 HN ARG 5 -4.492 -12.524 -14.313 36 HA ARG 5 HA ARG 5 -6.007 -13.204 -11.968 37 HB2 ARG 5 HB2 ARG 5 -3.359 -14.373 -12.835 38 HB3 ARG 5 HB1 ARG 5 -4.539 -15.099 -11.757 39 HG2 ARG 5 HG2 ARG 5 -4.921 -14.592 -14.702 40 HG3 ARG 5 HG1 ARG 5 -4.562 -16.147 -13.954 41 HD2 ARG 5 HD2 ARG 5 -6.783 -16.436 -13.925 42 HD3 ARG 5 HD1 ARG 5 -6.766 -15.326 -12.554 43 HE ARG 5 HE ARG 5 -6.888 -13.875 -14.974 44 HH11 ARG 5 HH11 ARG 5 -8.841 -15.866 -12.884 45 HH12 ARG 5 HH12 ARG 5 -10.340 -15.164 -13.400 46 HH21 ARG 5 HH21 ARG 5 -8.841 -12.934 -15.654 47 HH22 ARG 5 HH22 ARG 5 -10.338 -13.487 -14.976 48 H LYS 6 HN LYS 6 -5.670 -12.533 -9.974 49 HA LYS 6 HA LYS 6 -4.747 -11.705 -8.086 50 HB2 LYS 6 HB2 LYS 6 -2.080 -12.163 -9.413 51 HB3 LYS 6 HB1 LYS 6 -2.334 -11.818 -7.708 52 HG2 LYS 6 HG2 LYS 6 -3.330 -14.262 -9.164 53 HG3 LYS 6 HG1 LYS 6 -1.910 -14.192 -8.120 54 HD2 LYS 6 HD2 LYS 6 -3.406 -13.474 -6.254 55 HD3 LYS 6 HD1 LYS 6 -4.786 -13.755 -7.318 56 HE2 LYS 6 HE2 LYS 6 -2.743 -15.824 -6.510 57 HE3 LYS 6 HE1 LYS 6 -4.356 -15.658 -5.820 58 HZ1 LYS 6 HZ1 LYS 6 -5.203 -15.981 -8.153 59 HZ2 LYS 6 HZ2 LYS 6 -4.499 -17.340 -7.434 60 HZ3 LYS 6 HZ3 LYS 6 -3.633 -16.448 -8.580 61 H THR 7 HN THR 7 -3.058 -10.401 -10.911 62 HA THR 7 HA THR 7 -2.731 -7.852 -9.593 63 HB THR 7 HB THR 7 -2.004 -7.202 -12.040 64 HG1 THR 7 HG1 THR 7 -2.795 -9.337 -12.799 65 HG21 THR 7 HG21 THR 7 0.253 -8.400 -11.509 66 HG22 THR 7 HG22 THR 7 -0.543 -8.816 -9.991 67 HG23 THR 7 HG23 THR 7 -0.335 -7.124 -10.442 68 H ALA 8 HN ALA 8 -4.039 -6.224 -9.631 69 HA ALA 8 HA ALA 8 -6.339 -6.232 -11.461 70 HB1 ALA 8 HB1 ALA 8 -6.845 -6.222 -9.054 71 HB2 ALA 8 HB2 ALA 8 -7.415 -4.755 -9.856 72 HB3 ALA 8 HB3 ALA 8 -5.943 -4.715 -8.882 73 H VAL 9 HN VAL 9 -7.010 -4.191 -12.421 74 HA VAL 9 HA VAL 9 -4.660 -2.511 -12.972 75 HB VAL 9 HB VAL 9 -7.071 -2.997 -14.720 76 HG11 VAL 9 HG11 VAL 9 -5.340 -1.817 -16.375 77 HG12 VAL 9 HG12 VAL 9 -4.825 -1.049 -14.874 78 HG13 VAL 9 HG13 VAL 9 -6.496 -0.893 -15.416 79 HG21 VAL 9 HG21 VAL 9 -5.752 -4.370 -16.050 80 HG22 VAL 9 HG22 VAL 9 -5.248 -4.809 -14.417 81 HG23 VAL 9 HG23 VAL 9 -4.246 -3.731 -15.390 82 H LEU 10 HN LEU 10 -4.727 -0.507 -12.290 83 HA LEU 10 HA LEU 10 -7.332 0.716 -11.609 84 HB2 LEU 10 HB2 LEU 10 -5.805 0.202 -9.666 85 HB3 LEU 10 HB1 LEU 10 -4.635 1.301 -10.364 86 HG LEU 10 HG LEU 10 -6.224 3.171 -10.057 87 HD11 LEU 10 HD11 LEU 10 -7.952 1.011 -8.868 88 HD12 LEU 10 HD12 LEU 10 -8.357 2.140 -10.160 89 HD13 LEU 10 HD13 LEU 10 -8.178 2.723 -8.505 90 HD21 LEU 10 HD21 LEU 10 -5.701 3.485 -7.849 91 HD22 LEU 10 HD22 LEU 10 -4.552 2.223 -8.289 92 HD23 LEU 10 HD23 LEU 10 -6.029 1.808 -7.419 93 H LYS 11 HN LYS 11 -7.796 2.595 -12.747 94 HA LYS 11 HA LYS 11 -5.565 3.633 -14.368 95 HB2 LYS 11 HB2 LYS 11 -8.482 3.406 -15.110 96 HB3 LYS 11 HB1 LYS 11 -7.327 4.376 -16.014 97 HG2 LYS 11 HG2 LYS 11 -6.013 2.359 -16.469 98 HG3 LYS 11 HG1 LYS 11 -7.205 1.396 -15.599 99 HD2 LYS 11 HD2 LYS 11 -8.926 2.067 -17.192 100 HD3 LYS 11 HD1 LYS 11 -7.755 3.072 -18.049 101 HE2 LYS 11 HE2 LYS 11 -6.435 1.086 -18.576 102 HE3 LYS 11 HE1 LYS 11 -7.595 0.078 -17.713 103 HZ1 LYS 11 HZ1 LYS 11 -8.839 -0.028 -19.524 104 HZ2 LYS 11 HZ2 LYS 11 -7.669 0.844 -20.379 105 HZ3 LYS 11 HZ3 LYS 11 -8.943 1.658 -19.622 106 H LEU 12 HN LEU 12 -5.197 5.739 -14.406 107 HA LEU 12 HA LEU 12 -6.948 7.423 -12.758 108 HB2 LEU 12 HB2 LEU 12 -4.206 6.975 -12.576 109 HB3 LEU 12 HB1 LEU 12 -4.325 8.540 -13.354 110 HG LEU 12 HG LEU 12 -5.488 7.783 -10.674 111 HD11 LEU 12 HD11 LEU 12 -3.862 9.268 -9.749 112 HD12 LEU 12 HD12 LEU 12 -3.333 9.773 -11.355 113 HD13 LEU 12 HD13 LEU 12 -3.021 8.129 -10.800 114 HD21 LEU 12 HD21 LEU 12 -5.775 10.249 -12.353 115 HD22 LEU 12 HD22 LEU 12 -5.891 10.319 -10.595 116 HD23 LEU 12 HD23 LEU 12 -7.022 9.325 -11.515 117 H TYR 13 HN TYR 13 -8.040 9.036 -13.865 118 HA TYR 13 HA TYR 13 -7.202 9.604 -16.624 119 HB2 TYR 13 HB2 TYR 13 -9.764 10.198 -15.121 120 HB3 TYR 13 HB1 TYR 13 -9.451 10.637 -16.796 121 HD1 TYR 13 HD1 TYR 13 -10.102 7.845 -14.492 122 HD2 TYR 13 HD2 TYR 13 -9.539 8.983 -18.553 123 HE1 TYR 13 HE1 TYR 13 -10.966 5.661 -15.218 124 HE2 TYR 13 HE2 TYR 13 -10.398 6.800 -19.289 125 HH TYR 13 HH TYR 13 -11.378 4.888 -18.653 126 H VAL 14 HN VAL 14 -6.039 11.434 -16.919 127 HA VAL 14 HA VAL 14 -6.410 13.630 -14.982 128 HB VAL 14 HB VAL 14 -4.009 14.168 -15.229 129 HG11 VAL 14 HG11 VAL 14 -4.705 13.041 -13.239 130 HG12 VAL 14 HG12 VAL 14 -3.208 12.275 -13.784 131 HG13 VAL 14 HG13 VAL 14 -4.758 11.485 -14.074 132 HG21 VAL 14 HG21 VAL 14 -3.862 11.469 -16.570 133 HG22 VAL 14 HG22 VAL 14 -2.481 12.447 -16.075 134 HG23 VAL 14 HG23 VAL 14 -3.567 13.028 -17.337 135 H ALA 15 HN ALA 15 -5.694 15.739 -15.792 136 HA ALA 15 HA ALA 15 -6.110 15.952 -18.698 137 HB1 ALA 15 HB1 ALA 15 -6.772 18.375 -17.247 138 HB2 ALA 15 HB2 ALA 15 -7.748 17.005 -16.715 139 HB3 ALA 15 HB3 ALA 15 -7.731 17.468 -18.417 140 H GLY 16 HN GLY 16 -4.134 16.247 -19.499 141 HA2 GLY 16 HA2 GLY 16 -2.125 17.239 -19.956 142 HA3 GLY 16 HA1 GLY 16 -2.778 18.680 -19.189 143 H ASN 17 HN ASN 17 -1.263 19.395 -17.845 144 HA ASN 17 HA ASN 17 -0.187 17.497 -15.869 145 HB2 ASN 17 HB2 ASN 17 1.400 18.382 -17.821 146 HB3 ASN 17 HB1 ASN 17 1.513 19.787 -16.765 147 HD21 ASN 17 HD21 ASN 17 3.536 19.600 -16.016 148 HD22 ASN 17 HD22 ASN 17 4.133 18.243 -15.130 149 H THR 18 HN THR 18 -2.394 18.868 -15.342 150 HA THR 18 HA THR 18 -1.938 21.409 -14.110 151 HB THR 18 HB THR 18 -4.216 20.796 -12.994 152 HG1 THR 18 HG1 THR 18 -4.522 19.002 -15.128 153 HG21 THR 18 HG21 THR 18 -3.832 21.169 -15.962 154 HG22 THR 18 HG22 THR 18 -4.147 22.407 -14.746 155 HG23 THR 18 HG23 THR 18 -5.408 21.250 -15.174 156 HA PRO 19 HA PRO 19 -0.226 20.291 -10.231 157 HB2 PRO 19 HB2 PRO 19 -1.803 21.781 -8.501 158 HB3 PRO 19 HB1 PRO 19 -0.402 22.399 -9.382 159 HG2 PRO 19 HG2 PRO 19 -3.312 22.608 -10.059 160 HG3 PRO 19 HG1 PRO 19 -2.035 23.828 -10.217 161 HD2 PRO 19 HD2 PRO 19 -2.924 22.485 -12.339 162 HD3 PRO 19 HD1 PRO 19 -1.197 22.874 -12.162 163 H ASN 20 HN ASN 20 -3.731 20.185 -10.473 164 HA ASN 20 HA ASN 20 -4.104 18.497 -8.211 165 HB2 ASN 20 HB2 ASN 20 -6.353 17.993 -9.385 166 HB3 ASN 20 HB1 ASN 20 -6.045 19.643 -8.861 167 HD21 ASN 20 HD21 ASN 20 -7.273 17.875 -11.298 168 HD22 ASN 20 HD22 ASN 20 -7.028 18.965 -12.615 169 H SER 21 HN SER 21 -3.743 17.922 -11.705 170 HA SER 21 HA SER 21 -3.990 15.065 -11.588 171 HB2 SER 21 HB2 SER 21 -2.721 16.892 -13.646 172 HB3 SER 21 HB1 SER 21 -3.002 15.166 -13.864 173 HG SER 21 HG SER 21 -4.792 17.288 -13.912 174 H VAL 22 HN VAL 22 -1.233 17.290 -11.540 175 HA VAL 22 HA VAL 22 0.722 15.249 -11.581 176 HB VAL 22 HB VAL 22 0.842 18.094 -10.541 177 HG11 VAL 22 HG11 VAL 22 3.344 17.781 -10.653 178 HG12 VAL 22 HG12 VAL 22 3.036 16.046 -10.729 179 HG13 VAL 22 HG13 VAL 22 2.518 16.973 -9.318 180 HG21 VAL 22 HG21 VAL 22 1.740 16.776 -13.092 181 HG22 VAL 22 HG22 VAL 22 2.290 18.376 -12.592 182 HG23 VAL 22 HG23 VAL 22 0.575 18.085 -12.887 183 H ARG 23 HN ARG 23 -0.850 16.974 -8.934 184 HA ARG 23 HA ARG 23 0.578 15.845 -6.799 185 HB2 ARG 23 HB2 ARG 23 -1.259 17.755 -6.984 186 HB3 ARG 23 HB1 ARG 23 -2.335 16.431 -6.546 187 HG2 ARG 23 HG2 ARG 23 -1.891 17.091 -4.461 188 HG3 ARG 23 HG1 ARG 23 -0.412 16.148 -4.671 189 HD2 ARG 23 HD2 ARG 23 0.778 18.151 -5.375 190 HD3 ARG 23 HD1 ARG 23 -0.705 19.097 -5.228 191 HE ARG 23 HE ARG 23 -0.226 17.889 -2.763 192 HH11 ARG 23 HH11 ARG 23 1.253 20.254 -4.845 193 HH12 ARG 23 HH12 ARG 23 1.988 21.134 -3.546 194 HH21 ARG 23 HH21 ARG 23 0.735 19.031 -1.041 195 HH22 ARG 23 HH22 ARG 23 1.693 20.434 -1.376 196 H ALA 24 HN ALA 24 -2.466 14.923 -8.347 197 HA ALA 24 HA ALA 24 -3.009 12.695 -6.716 198 HB1 ALA 24 HB1 ALA 24 -4.868 12.492 -7.946 199 HB2 ALA 24 HB2 ALA 24 -3.975 12.475 -9.467 200 HB3 ALA 24 HB3 ALA 24 -4.355 14.010 -8.684 201 H LEU 25 HN LEU 25 -1.346 13.004 -9.817 202 HA LEU 25 HA LEU 25 -0.905 10.279 -10.324 203 HB2 LEU 25 HB2 LEU 25 -0.634 12.003 -12.025 204 HB3 LEU 25 HB1 LEU 25 0.716 12.692 -11.144 205 HG LEU 25 HG LEU 25 2.016 10.637 -11.550 206 HD11 LEU 25 HD11 LEU 25 1.034 9.168 -13.446 207 HD12 LEU 25 HD12 LEU 25 -0.519 9.795 -12.896 208 HD13 LEU 25 HD13 LEU 25 0.510 8.893 -11.786 209 HD21 LEU 25 HD21 LEU 25 2.362 10.994 -13.957 210 HD22 LEU 25 HD22 LEU 25 2.254 12.512 -13.066 211 HD23 LEU 25 HD23 LEU 25 0.880 11.947 -14.016 212 H LYS 26 HN LYS 26 1.167 12.668 -8.673 213 HA LYS 26 HA LYS 26 3.302 10.890 -8.165 214 HB2 LYS 26 HB2 LYS 26 2.424 13.358 -6.644 215 HB3 LYS 26 HB1 LYS 26 3.953 12.527 -6.396 216 HG2 LYS 26 HG2 LYS 26 3.081 13.811 -8.976 217 HG3 LYS 26 HG1 LYS 26 4.168 14.536 -7.792 218 HD2 LYS 26 HD2 LYS 26 5.739 12.673 -8.117 219 HD3 LYS 26 HD1 LYS 26 4.656 11.985 -9.330 220 HE2 LYS 26 HE2 LYS 26 4.895 14.011 -10.686 221 HE3 LYS 26 HE1 LYS 26 5.987 14.689 -9.478 222 HZ1 LYS 26 HZ1 LYS 26 7.544 12.914 -9.907 223 HZ2 LYS 26 HZ2 LYS 26 7.174 13.703 -11.357 224 HZ3 LYS 26 HZ3 LYS 26 6.485 12.197 -11.016 225 H THR 27 HN THR 27 0.406 11.714 -6.318 226 HA THR 27 HA THR 27 1.027 10.277 -3.967 227 HB THR 27 HB THR 27 -1.660 11.030 -5.135 228 HG1 THR 27 HG1 THR 27 -0.569 12.900 -4.736 229 HG21 THR 27 HG21 THR 27 -0.850 9.808 -2.554 230 HG22 THR 27 HG22 THR 27 -2.326 9.594 -3.493 231 HG23 THR 27 HG23 THR 27 -2.104 11.049 -2.521 232 H LEU 28 HN LEU 28 -0.826 9.397 -6.878 233 HA LEU 28 HA LEU 28 -1.566 6.816 -5.953 234 HB2 LEU 28 HB2 LEU 28 -1.830 8.377 -8.392 235 HB3 LEU 28 HB1 LEU 28 -1.534 6.684 -8.732 236 HG LEU 28 HG LEU 28 -3.898 7.059 -8.726 237 HD11 LEU 28 HD11 LEU 28 -2.611 5.253 -6.962 238 HD12 LEU 28 HD12 LEU 28 -4.153 5.073 -7.797 239 HD13 LEU 28 HD13 LEU 28 -4.100 5.806 -6.194 240 HD21 LEU 28 HD21 LEU 28 -3.274 8.754 -6.455 241 HD22 LEU 28 HD22 LEU 28 -4.651 7.694 -6.153 242 HD23 LEU 28 HD23 LEU 28 -4.661 8.781 -7.543 243 H ALA 29 HN ALA 29 0.996 7.876 -8.229 244 HA ALA 29 HA ALA 29 1.945 5.306 -8.819 245 HB1 ALA 29 HB1 ALA 29 4.137 6.871 -9.177 246 HB2 ALA 29 HB2 ALA 29 2.833 8.056 -9.258 247 HB3 ALA 29 HB3 ALA 29 2.833 6.669 -10.347 248 H ASN 30 HN ASN 30 2.988 7.607 -6.301 249 HA ASN 30 HA ASN 30 5.254 6.108 -5.450 250 HB2 ASN 30 HB2 ASN 30 4.878 8.496 -4.876 251 HB3 ASN 30 HB1 ASN 30 3.541 8.015 -3.837 252 HD21 ASN 30 HD21 ASN 30 4.075 8.040 -1.785 253 HD22 ASN 30 HD22 ASN 30 5.611 7.613 -1.123 254 H ILE 31 HN ILE 31 1.908 6.176 -4.326 255 HA ILE 31 HA ILE 31 2.290 4.342 -2.242 256 HB ILE 31 HB ILE 31 -0.159 5.273 -3.673 257 HG12 ILE 31 HG12 ILE 31 0.739 5.522 -0.805 258 HG13 ILE 31 HG11 ILE 31 1.141 6.692 -2.061 259 HG21 ILE 31 HG21 ILE 31 -0.472 2.885 -2.987 260 HG22 ILE 31 HG22 ILE 31 -1.582 4.032 -2.241 261 HG23 ILE 31 HG23 ILE 31 -0.216 3.401 -1.319 262 HD11 ILE 31 HD11 ILE 31 -1.132 7.289 -2.335 263 HD12 ILE 31 HD12 ILE 31 -0.776 7.309 -0.607 264 HD13 ILE 31 HD13 ILE 31 -1.663 5.958 -1.309 265 H LEU 32 HN LEU 32 1.184 3.869 -5.583 266 HA LEU 32 HA LEU 32 0.824 1.078 -5.305 267 HB2 LEU 32 HB2 LEU 32 1.109 2.861 -7.702 268 HB3 LEU 32 HB1 LEU 32 0.870 1.126 -7.845 269 HG LEU 32 HG LEU 32 -1.037 2.924 -6.331 270 HD11 LEU 32 HD11 LEU 32 -2.377 3.140 -8.212 271 HD12 LEU 32 HD12 LEU 32 -1.573 1.821 -9.064 272 HD13 LEU 32 HD13 LEU 32 -0.756 3.372 -8.867 273 HD21 LEU 32 HD21 LEU 32 -2.445 0.785 -7.148 274 HD22 LEU 32 HD22 LEU 32 -1.623 0.886 -5.591 275 HD23 LEU 32 HD23 LEU 32 -0.855 0.050 -6.940 276 H GLU 33 HN GLU 33 3.621 3.008 -6.225 277 HA GLU 33 HA GLU 33 5.192 0.859 -7.200 278 HB2 GLU 33 HB2 GLU 33 5.972 3.575 -6.154 279 HB3 GLU 33 HB1 GLU 33 7.139 2.417 -6.781 280 HG2 GLU 33 HG2 GLU 33 5.984 2.429 -8.937 281 HG3 GLU 33 HG1 GLU 33 4.826 3.596 -8.296 282 H LYS 34 HN LYS 34 4.734 2.121 -3.926 283 HA LYS 34 HA LYS 34 6.733 0.154 -3.018 284 HB2 LYS 34 HB2 LYS 34 5.887 2.807 -1.918 285 HB3 LYS 34 HB1 LYS 34 6.584 1.599 -0.848 286 HG2 LYS 34 HG2 LYS 34 7.921 2.621 -3.344 287 HG3 LYS 34 HG1 LYS 34 8.212 3.257 -1.726 288 HD2 LYS 34 HD2 LYS 34 8.617 0.366 -2.488 289 HD3 LYS 34 HD1 LYS 34 9.898 1.578 -2.526 290 HE2 LYS 34 HE2 LYS 34 9.501 2.008 -0.118 291 HE3 LYS 34 HE1 LYS 34 8.310 0.708 -0.111 292 HZ1 LYS 34 HZ1 LYS 34 11.179 0.379 -0.804 293 HZ2 LYS 34 HZ2 LYS 34 10.027 -0.856 -0.698 294 HZ3 LYS 34 HZ3 LYS 34 10.491 -0.012 0.691 295 H GLU 35 HN GLU 35 3.691 1.642 -1.907 296 HA GLU 35 HA GLU 35 3.175 -0.265 0.100 297 HB2 GLU 35 HB2 GLU 35 1.461 1.762 -1.316 298 HB3 GLU 35 HB1 GLU 35 0.770 0.659 -0.132 299 HG2 GLU 35 HG2 GLU 35 1.251 2.723 0.957 300 HG3 GLU 35 HG1 GLU 35 2.394 1.520 1.544 301 H PHE 36 HN PHE 36 2.084 -0.132 -3.292 302 HA PHE 36 HA PHE 36 1.005 -2.844 -2.873 303 HB2 PHE 36 HB2 PHE 36 -0.084 -0.697 -4.688 304 HB3 PHE 36 HB1 PHE 36 -0.650 -2.363 -4.667 305 HD1 PHE 36 HD1 PHE 36 -0.674 0.838 -2.960 306 HD2 PHE 36 HD2 PHE 36 -1.862 -3.240 -2.739 307 HE1 PHE 36 HE1 PHE 36 -2.225 1.394 -1.135 308 HE2 PHE 36 HE2 PHE 36 -3.417 -2.692 -0.915 309 HZ PHE 36 HZ PHE 36 -3.599 -0.373 -0.113 310 H LYS 37 HN LYS 37 3.697 -2.074 -3.813 311 HA LYS 37 HA LYS 37 3.992 -2.385 -6.562 312 HB2 LYS 37 HB2 LYS 37 5.804 -1.701 -5.031 313 HB3 LYS 37 HB1 LYS 37 5.869 -3.339 -4.394 314 HG2 LYS 37 HG2 LYS 37 6.554 -4.180 -6.570 315 HG3 LYS 37 HG1 LYS 37 6.443 -2.554 -7.244 316 HD2 LYS 37 HD2 LYS 37 8.175 -1.803 -5.661 317 HD3 LYS 37 HD1 LYS 37 8.312 -3.455 -5.053 318 HE2 LYS 37 HE2 LYS 37 8.816 -2.592 -7.898 319 HE3 LYS 37 HE1 LYS 37 10.065 -2.901 -6.693 320 HZ1 LYS 37 HZ1 LYS 37 8.576 -4.756 -8.292 321 HZ2 LYS 37 HZ2 LYS 37 8.557 -5.160 -6.650 322 HZ3 LYS 37 HZ3 LYS 37 10.031 -4.976 -7.457 323 H GLY 38 HN GLY 38 3.637 -4.020 -7.901 324 HA2 GLY 38 HA2 GLY 38 3.793 -6.219 -8.682 325 HA3 GLY 38 HA1 GLY 38 4.110 -6.757 -7.043 326 H VAL 39 HN VAL 39 1.495 -4.888 -6.597 327 HA VAL 39 HA VAL 39 -0.276 -7.190 -7.032 328 HB VAL 39 HB VAL 39 -0.622 -4.929 -5.045 329 HG11 VAL 39 HG11 VAL 39 -2.706 -6.105 -6.029 330 HG12 VAL 39 HG12 VAL 39 -2.573 -5.933 -4.278 331 HG13 VAL 39 HG13 VAL 39 -2.199 -7.477 -5.043 332 HG21 VAL 39 HG21 VAL 39 -0.023 -7.813 -4.433 333 HG22 VAL 39 HG22 VAL 39 0.021 -6.433 -3.338 334 HG23 VAL 39 HG23 VAL 39 1.236 -6.590 -4.607 335 H TYR 40 HN TYR 40 -0.183 -3.635 -7.308 336 HA TYR 40 HA TYR 40 -2.527 -3.915 -9.035 337 HB2 TYR 40 HB2 TYR 40 -1.886 -1.980 -6.947 338 HB3 TYR 40 HB1 TYR 40 -2.293 -1.183 -8.454 339 HD1 TYR 40 HD1 TYR 40 -3.555 -2.722 -5.504 340 HD2 TYR 40 HD2 TYR 40 -4.528 -1.795 -9.540 341 HE1 TYR 40 HE1 TYR 40 -5.948 -2.903 -4.964 342 HE2 TYR 40 HE2 TYR 40 -6.921 -1.980 -9.014 343 HH TYR 40 HH TYR 40 -8.195 -3.466 -6.749 344 H ALA 41 HN ALA 41 -2.563 -2.992 -11.046 345 HA ALA 41 HA ALA 41 0.012 -1.960 -12.023 346 HB1 ALA 41 HB1 ALA 41 -0.558 -2.726 -14.158 347 HB2 ALA 41 HB2 ALA 41 -2.282 -2.766 -13.785 348 HB3 ALA 41 HB3 ALA 41 -1.202 -3.981 -13.097 349 H LEU 42 HN LEU 42 0.170 0.180 -12.453 350 HA LEU 42 HA LEU 42 -2.286 1.745 -12.331 351 HB2 LEU 42 HB2 LEU 42 -0.529 2.459 -10.835 352 HB3 LEU 42 HB1 LEU 42 0.612 2.570 -12.160 353 HG LEU 42 HG LEU 42 -0.710 4.432 -13.118 354 HD11 LEU 42 HD11 LEU 42 -2.847 4.546 -12.482 355 HD12 LEU 42 HD12 LEU 42 -2.230 5.400 -11.068 356 HD13 LEU 42 HD13 LEU 42 -2.549 3.668 -10.980 357 HD21 LEU 42 HD21 LEU 42 -0.227 5.374 -10.376 358 HD22 LEU 42 HD22 LEU 42 0.423 5.948 -11.913 359 HD23 LEU 42 HD23 LEU 42 1.118 4.524 -11.136 360 H LYS 43 HN LYS 43 -3.208 2.612 -13.994 361 HA LYS 43 HA LYS 43 -1.651 3.074 -16.451 362 HB2 LYS 43 HB2 LYS 43 -4.126 1.563 -16.038 363 HB3 LYS 43 HB1 LYS 43 -4.289 2.815 -17.261 364 HG2 LYS 43 HG2 LYS 43 -3.597 1.133 -18.591 365 HG3 LYS 43 HG1 LYS 43 -2.013 1.738 -18.104 366 HD2 LYS 43 HD2 LYS 43 -1.667 -0.017 -16.615 367 HD3 LYS 43 HD1 LYS 43 -3.388 -0.392 -16.511 368 HE2 LYS 43 HE2 LYS 43 -2.382 -2.110 -17.808 369 HE3 LYS 43 HE1 LYS 43 -3.289 -1.082 -18.917 370 HZ1 LYS 43 HZ1 LYS 43 -0.673 -1.806 -19.174 371 HZ2 LYS 43 HZ2 LYS 43 -0.580 -0.219 -18.597 372 HZ3 LYS 43 HZ3 LYS 43 -1.444 -0.555 -20.013 373 H VAL 44 HN VAL 44 -1.929 5.021 -17.424 374 HA VAL 44 HA VAL 44 -3.814 6.913 -16.140 375 HB VAL 44 HB VAL 44 -1.633 7.583 -15.456 376 HG11 VAL 44 HG11 VAL 44 -0.855 6.908 -18.232 377 HG12 VAL 44 HG12 VAL 44 -0.024 6.583 -16.708 378 HG13 VAL 44 HG13 VAL 44 0.027 8.199 -17.415 379 HG21 VAL 44 HG21 VAL 44 -2.282 9.324 -17.814 380 HG22 VAL 44 HG22 VAL 44 -1.453 9.790 -16.328 381 HG23 VAL 44 HG23 VAL 44 -3.163 9.359 -16.287 382 H ILE 45 HN ILE 45 -5.142 7.971 -17.325 383 HA ILE 45 HA ILE 45 -4.905 7.713 -20.241 384 HB ILE 45 HB ILE 45 -7.387 8.110 -18.574 385 HG12 ILE 45 HG12 ILE 45 -6.421 5.937 -18.066 386 HG13 ILE 45 HG11 ILE 45 -7.900 5.737 -18.995 387 HG21 ILE 45 HG21 ILE 45 -7.195 7.222 -21.448 388 HG22 ILE 45 HG22 ILE 45 -7.474 8.890 -20.950 389 HG23 ILE 45 HG23 ILE 45 -8.656 7.640 -20.549 390 HD11 ILE 45 HD11 ILE 45 -6.666 5.186 -20.957 391 HD12 ILE 45 HD12 ILE 45 -6.040 4.212 -19.624 392 HD13 ILE 45 HD13 ILE 45 -5.142 5.624 -20.185 393 H ASP 46 HN ASP 46 -3.976 9.638 -20.823 394 HA ASP 46 HA ASP 46 -4.616 12.133 -19.566 395 HB2 ASP 46 HB2 ASP 46 -2.428 11.627 -20.683 396 HB3 ASP 46 HB1 ASP 46 -3.260 11.686 -22.232 397 H VAL 47 HN VAL 47 -6.693 12.806 -19.778 398 HA VAL 47 HA VAL 47 -8.328 12.197 -22.002 399 HB VAL 47 HB VAL 47 -10.010 13.627 -20.999 400 HG11 VAL 47 HG11 VAL 47 -8.616 11.496 -19.626 401 HG12 VAL 47 HG12 VAL 47 -10.348 11.811 -19.749 402 HG13 VAL 47 HG13 VAL 47 -9.400 12.590 -18.484 403 HG21 VAL 47 HG21 VAL 47 -8.411 15.438 -20.305 404 HG22 VAL 47 HG22 VAL 47 -7.974 14.425 -18.929 405 HG23 VAL 47 HG23 VAL 47 -9.628 15.010 -19.102 406 H LEU 48 HN LEU 48 -6.353 15.052 -21.322 407 HA LEU 48 HA LEU 48 -7.566 16.646 -23.351 408 HB2 LEU 48 HB2 LEU 48 -4.938 16.925 -21.911 409 HB3 LEU 48 HB1 LEU 48 -5.478 18.056 -23.138 410 HG LEU 48 HG LEU 48 -6.951 17.470 -20.567 411 HD11 LEU 48 HD11 LEU 48 -5.161 19.756 -21.366 412 HD12 LEU 48 HD12 LEU 48 -4.926 18.618 -20.039 413 HD13 LEU 48 HD13 LEU 48 -6.246 19.787 -19.974 414 HD21 LEU 48 HD21 LEU 48 -7.964 19.784 -21.396 415 HD22 LEU 48 HD22 LEU 48 -8.638 18.232 -21.887 416 HD23 LEU 48 HD23 LEU 48 -7.552 19.102 -22.970 417 H LYS 49 HN LYS 49 -4.783 14.494 -23.266 418 HA LYS 49 HA LYS 49 -3.819 15.139 -25.862 419 HB2 LYS 49 HB2 LYS 49 -2.420 14.099 -24.131 420 HB3 LYS 49 HB1 LYS 49 -3.414 12.650 -24.204 421 HG2 LYS 49 HG2 LYS 49 -2.722 12.256 -26.490 422 HG3 LYS 49 HG1 LYS 49 -1.771 13.744 -26.474 423 HD2 LYS 49 HD2 LYS 49 -0.399 12.844 -24.664 424 HD3 LYS 49 HD1 LYS 49 -1.341 11.351 -24.693 425 HE2 LYS 49 HE2 LYS 49 0.257 12.446 -27.000 426 HE3 LYS 49 HE1 LYS 49 0.795 11.166 -25.915 427 HZ1 LYS 49 HZ1 LYS 49 -1.657 10.332 -26.776 428 HZ2 LYS 49 HZ2 LYS 49 -0.163 9.775 -27.343 429 HZ3 LYS 49 HZ3 LYS 49 -0.966 11.020 -28.160 430 H ASN 50 HN ASN 50 -5.953 12.639 -24.571 431 HA ASN 50 HA ASN 50 -6.845 12.090 -27.323 432 HB2 ASN 50 HB2 ASN 50 -6.435 10.051 -25.124 433 HB3 ASN 50 HB1 ASN 50 -7.183 9.715 -26.679 434 HD21 ASN 50 HD21 ASN 50 -5.749 10.514 -28.578 435 HD22 ASN 50 HD22 ASN 50 -4.090 10.047 -28.483 436 HA PRO 51 HA PRO 51 -10.356 13.437 -24.599 437 HB2 PRO 51 HB2 PRO 51 -11.576 14.820 -26.653 438 HB3 PRO 51 HB1 PRO 51 -10.462 15.531 -25.482 439 HG2 PRO 51 HG2 PRO 51 -9.929 14.582 -28.266 440 HG3 PRO 51 HG1 PRO 51 -9.305 16.014 -27.427 441 HD2 PRO 51 HD2 PRO 51 -7.825 13.808 -27.766 442 HD3 PRO 51 HD1 PRO 51 -7.698 14.808 -26.303 443 H GLN 52 HN GLN 52 -10.096 11.877 -27.700 444 HA GLN 52 HA GLN 52 -12.788 11.082 -28.040 445 HB2 GLN 52 HB2 GLN 52 -10.205 9.769 -28.922 446 HB3 GLN 52 HB1 GLN 52 -11.799 9.237 -29.434 447 HG2 GLN 52 HG2 GLN 52 -11.334 10.556 -31.199 448 HG3 GLN 52 HG1 GLN 52 -11.970 11.809 -30.134 449 HE21 GLN 52 HE21 GLN 52 -10.181 12.243 -32.276 450 HE22 GLN 52 HE22 GLN 52 -8.702 12.845 -31.619 451 H LEU 53 HN LEU 53 -10.067 9.706 -26.302 452 HA LEU 53 HA LEU 53 -11.451 7.318 -25.587 453 HB2 LEU 53 HB2 LEU 53 -8.935 8.571 -24.483 454 HB3 LEU 53 HB1 LEU 53 -9.559 7.022 -23.948 455 HG LEU 53 HG LEU 53 -8.725 7.645 -26.781 456 HD11 LEU 53 HD11 LEU 53 -7.270 5.932 -24.783 457 HD12 LEU 53 HD12 LEU 53 -6.874 7.627 -25.073 458 HD13 LEU 53 HD13 LEU 53 -6.723 6.450 -26.378 459 HD21 LEU 53 HD21 LEU 53 -10.122 5.901 -27.117 460 HD22 LEU 53 HD22 LEU 53 -9.977 5.316 -25.459 461 HD23 LEU 53 HD23 LEU 53 -8.698 4.983 -26.627 462 H ALA 54 HN ALA 54 -10.966 10.490 -24.171 463 HA ALA 54 HA ALA 54 -11.945 9.943 -21.578 464 HB1 ALA 54 HB1 ALA 54 -12.107 12.562 -23.053 465 HB2 ALA 54 HB2 ALA 54 -10.644 11.970 -22.265 466 HB3 ALA 54 HB3 ALA 54 -12.088 12.307 -21.307 467 H GLU 55 HN GLU 55 -13.445 11.044 -24.575 468 HA GLU 55 HA GLU 55 -16.080 11.357 -23.538 469 HB2 GLU 55 HB2 GLU 55 -15.319 12.405 -25.655 470 HB3 GLU 55 HB1 GLU 55 -15.213 10.809 -26.386 471 HG2 GLU 55 HG2 GLU 55 -17.611 10.499 -26.102 472 HG3 GLU 55 HG1 GLU 55 -17.732 12.074 -25.323 473 H GLU 56 HN GLU 56 -14.347 8.680 -25.016 474 HA GLU 56 HA GLU 56 -16.518 6.926 -25.321 475 HB2 GLU 56 HB2 GLU 56 -13.580 6.390 -24.845 476 HB3 GLU 56 HB1 GLU 56 -14.746 5.124 -25.206 477 HG2 GLU 56 HG2 GLU 56 -14.045 7.460 -26.991 478 HG3 GLU 56 HG1 GLU 56 -13.514 5.786 -27.197 479 H ASP 57 HN ASP 57 -14.349 7.498 -22.552 480 HA ASP 57 HA ASP 57 -16.006 5.682 -20.972 481 HB2 ASP 57 HB2 ASP 57 -13.330 6.999 -20.396 482 HB3 ASP 57 HB1 ASP 57 -14.240 6.139 -19.158 483 H LYS 58 HN LYS 58 -16.438 8.620 -21.898 484 HA LYS 58 HA LYS 58 -17.520 10.468 -21.177 485 HB2 LYS 58 HB2 LYS 58 -18.747 8.420 -19.338 486 HB3 LYS 58 HB1 LYS 58 -19.369 10.052 -19.550 487 HG2 LYS 58 HG2 LYS 58 -19.725 9.604 -21.935 488 HG3 LYS 58 HG1 LYS 58 -19.117 7.962 -21.708 489 HD2 LYS 58 HD2 LYS 58 -20.940 7.522 -20.116 490 HD3 LYS 58 HD1 LYS 58 -21.558 9.152 -20.387 491 HE2 LYS 58 HE2 LYS 58 -21.272 7.013 -22.497 492 HE3 LYS 58 HE1 LYS 58 -22.776 7.459 -21.693 493 HZ1 LYS 58 HZ1 LYS 58 -22.201 9.804 -22.570 494 HZ2 LYS 58 HZ2 LYS 58 -22.867 8.669 -23.630 495 HZ3 LYS 58 HZ3 LYS 58 -21.204 8.980 -23.661 496 H ILE 59 HN ILE 59 -15.086 10.683 -20.235 497 HA ILE 59 HA ILE 59 -15.141 11.139 -17.358 498 HB ILE 59 HB ILE 59 -12.929 11.625 -19.364 499 HG12 ILE 59 HG12 ILE 59 -13.529 9.259 -19.227 500 HG13 ILE 59 HG11 ILE 59 -11.953 9.541 -18.494 501 HG21 ILE 59 HG21 ILE 59 -11.446 11.746 -17.435 502 HG22 ILE 59 HG22 ILE 59 -12.817 11.527 -16.349 503 HG23 ILE 59 HG23 ILE 59 -12.699 12.984 -17.337 504 HD11 ILE 59 HD11 ILE 59 -12.881 8.160 -16.947 505 HD12 ILE 59 HD12 ILE 59 -14.519 8.745 -17.239 506 HD13 ILE 59 HD13 ILE 59 -13.387 9.719 -16.299 507 H LEU 60 HN LEU 60 -16.125 12.959 -16.698 508 HA LEU 60 HA LEU 60 -15.807 15.394 -18.314 509 HB2 LEU 60 HB2 LEU 60 -17.856 14.750 -16.194 510 HB3 LEU 60 HB1 LEU 60 -17.776 16.246 -17.106 511 HG LEU 60 HG LEU 60 -18.305 13.513 -18.285 512 HD11 LEU 60 HD11 LEU 60 -20.576 14.356 -18.643 513 HD12 LEU 60 HD12 LEU 60 -20.161 15.835 -17.777 514 HD13 LEU 60 HD13 LEU 60 -20.166 14.287 -16.929 515 HD21 LEU 60 HD21 LEU 60 -18.033 16.251 -19.478 516 HD22 LEU 60 HD22 LEU 60 -19.014 15.008 -20.254 517 HD23 LEU 60 HD23 LEU 60 -17.291 14.735 -19.991 518 H ALA 61 HN ALA 61 -14.530 13.992 -15.578 519 HA ALA 61 HA ALA 61 -13.580 16.590 -14.640 520 HB1 ALA 61 HB1 ALA 61 -14.429 14.648 -12.539 521 HB2 ALA 61 HB2 ALA 61 -15.646 15.667 -13.308 522 HB3 ALA 61 HB3 ALA 61 -14.288 16.405 -12.461 523 H THR 62 HN THR 62 -11.543 16.542 -13.743 524 HA THR 62 HA THR 62 -10.199 13.963 -13.450 525 HB THR 62 HB THR 62 -8.177 14.918 -14.552 526 HG1 THR 62 HG1 THR 62 -9.247 17.171 -14.283 527 HG21 THR 62 HG21 THR 62 -9.674 13.470 -15.847 528 HG22 THR 62 HG22 THR 62 -8.938 14.712 -16.865 529 HG23 THR 62 HG23 THR 62 -10.616 14.880 -16.334 530 HA PRO 63 HA PRO 63 -8.117 13.388 -13.030 531 HB2 PRO 63 HB2 PRO 63 -7.061 12.189 -10.870 532 HB3 PRO 63 HB1 PRO 63 -6.194 13.430 -11.782 533 HG2 PRO 63 HG2 PRO 63 -7.676 13.662 -9.201 534 HG3 PRO 63 HG1 PRO 63 -6.134 14.390 -9.688 535 HD2 PRO 63 HD2 PRO 63 -8.529 15.729 -9.700 536 HD3 PRO 63 HD1 PRO 63 -7.155 16.142 -10.741 537 H THR 64 HN THR 64 -8.919 11.322 -13.020 538 HA THR 64 HA THR 64 -11.138 10.761 -11.158 539 HB THR 64 HB THR 64 -11.321 9.289 -13.656 540 HG1 THR 64 HG1 THR 64 -11.827 12.058 -13.961 541 HG21 THR 64 HG21 THR 64 -13.090 10.926 -11.906 542 HG22 THR 64 HG22 THR 64 -13.278 9.261 -12.462 543 HG23 THR 64 HG23 THR 64 -13.613 10.601 -13.560 544 H LEU 65 HN LEU 65 -10.835 8.958 -9.985 545 HA LEU 65 HA LEU 65 -8.738 7.068 -10.844 546 HB2 LEU 65 HB2 LEU 65 -8.422 8.141 -8.648 547 HB3 LEU 65 HB1 LEU 65 -9.971 7.506 -8.122 548 HG LEU 65 HG LEU 65 -9.089 5.205 -8.379 549 HD11 LEU 65 HD11 LEU 65 -7.353 4.999 -9.774 550 HD12 LEU 65 HD12 LEU 65 -6.370 5.462 -8.385 551 HD13 LEU 65 HD13 LEU 65 -6.860 6.679 -9.561 552 HD21 LEU 65 HD21 LEU 65 -8.900 6.675 -6.257 553 HD22 LEU 65 HD22 LEU 65 -7.178 6.718 -6.640 554 HD23 LEU 65 HD23 LEU 65 -7.978 5.173 -6.343 555 H ALA 66 HN ALA 66 -9.451 5.228 -11.735 556 HA ALA 66 HA ALA 66 -11.860 3.982 -10.616 557 HB1 ALA 66 HB1 ALA 66 -12.223 5.432 -12.818 558 HB2 ALA 66 HB2 ALA 66 -13.070 3.908 -12.547 559 HB3 ALA 66 HB3 ALA 66 -11.640 3.949 -13.579 560 H LYS 67 HN LYS 67 -11.861 1.860 -10.559 561 HA LYS 67 HA LYS 67 -9.467 0.496 -11.542 562 HB2 LYS 67 HB2 LYS 67 -9.840 0.113 -9.202 563 HB3 LYS 67 HB1 LYS 67 -11.542 -0.230 -9.470 564 HG2 LYS 67 HG2 LYS 67 -10.893 -2.282 -10.696 565 HG3 LYS 67 HG1 LYS 67 -9.209 -1.944 -10.304 566 HD2 LYS 67 HD2 LYS 67 -9.845 -3.474 -8.670 567 HD3 LYS 67 HD1 LYS 67 -10.001 -1.922 -7.853 568 HE2 LYS 67 HE2 LYS 67 -11.895 -3.812 -7.794 569 HE3 LYS 67 HE1 LYS 67 -12.257 -2.096 -7.677 570 HZ1 LYS 67 HZ1 LYS 67 -12.506 -2.186 -10.189 571 HZ2 LYS 67 HZ2 LYS 67 -13.715 -2.946 -9.286 572 HZ3 LYS 67 HZ3 LYS 67 -12.516 -3.874 -10.038 573 H VAL 68 HN VAL 68 -9.825 -0.151 -13.597 574 HA VAL 68 HA VAL 68 -12.457 -0.849 -14.507 575 HB VAL 68 HB VAL 68 -11.346 -1.329 -16.667 576 HG11 VAL 68 HG11 VAL 68 -12.154 0.936 -16.007 577 HG12 VAL 68 HG12 VAL 68 -10.860 0.948 -17.204 578 HG13 VAL 68 HG13 VAL 68 -10.504 1.321 -15.516 579 HG21 VAL 68 HG21 VAL 68 -9.116 -1.447 -16.962 580 HG22 VAL 68 HG22 VAL 68 -9.096 -1.785 -15.232 581 HG23 VAL 68 HG23 VAL 68 -8.796 -0.147 -15.815 582 H LEU 69 HN LEU 69 -9.646 -2.562 -13.393 583 HA LEU 69 HA LEU 69 -11.139 -5.075 -13.756 584 HB2 LEU 69 HB2 LEU 69 -8.201 -4.705 -14.354 585 HB3 LEU 69 HB1 LEU 69 -9.033 -6.245 -14.331 586 HG LEU 69 HG LEU 69 -9.675 -3.995 -16.241 587 HD11 LEU 69 HD11 LEU 69 -7.968 -4.648 -17.492 588 HD12 LEU 69 HD12 LEU 69 -8.610 -6.291 -17.529 589 HD13 LEU 69 HD13 LEU 69 -7.496 -5.808 -16.250 590 HD21 LEU 69 HD21 LEU 69 -11.600 -5.313 -16.030 591 HD22 LEU 69 HD22 LEU 69 -10.671 -6.810 -15.929 592 HD23 LEU 69 HD23 LEU 69 -10.784 -5.945 -17.460 593 HA PRO 70 HA PRO 70 -11.222 -7.035 -13.121 594 HB2 PRO 70 HB2 PRO 70 -12.412 -8.086 -10.697 595 HB3 PRO 70 HB1 PRO 70 -11.366 -8.908 -11.857 596 HG2 PRO 70 HG2 PRO 70 -10.587 -8.317 -9.318 597 HG3 PRO 70 HG1 PRO 70 -9.454 -8.410 -10.682 598 HD2 PRO 70 HD2 PRO 70 -10.706 -5.985 -9.424 599 HD3 PRO 70 HD1 PRO 70 -9.018 -6.249 -9.921 600 HA PRO 71 HA PRO 71 -14.997 -4.638 -13.112 601 HB2 PRO 71 HB2 PRO 71 -16.244 -7.102 -14.204 602 HB3 PRO 71 HB1 PRO 71 -16.203 -5.470 -14.882 603 HG2 PRO 71 HG2 PRO 71 -14.695 -7.389 -15.926 604 HG3 PRO 71 HG1 PRO 71 -14.058 -5.742 -15.742 605 HD2 PRO 71 HD2 PRO 71 -13.570 -8.160 -14.035 606 HD3 PRO 71 HD1 PRO 71 -12.420 -6.938 -14.613 607 HA PRO 72 HA PRO 72 -17.470 -4.210 -13.153 608 HB2 PRO 72 HB2 PRO 72 -18.435 -2.967 -10.665 609 HB3 PRO 72 HB1 PRO 72 -19.331 -3.406 -12.123 610 HG2 PRO 72 HG2 PRO 72 -19.637 -4.780 -9.850 611 HG3 PRO 72 HG1 PRO 72 -19.649 -5.595 -11.426 612 HD2 PRO 72 HD2 PRO 72 -17.411 -5.372 -9.434 613 HD3 PRO 72 HD1 PRO 72 -17.979 -6.802 -10.326 614 H VAL 73 HN VAL 73 -17.017 -1.969 -13.410 615 HA VAL 73 HA VAL 73 -14.420 -1.211 -12.499 616 HB VAL 73 HB VAL 73 -16.492 0.392 -14.020 617 HG11 VAL 73 HG11 VAL 73 -15.017 1.988 -13.162 618 HG12 VAL 73 HG12 VAL 73 -14.392 1.655 -14.777 619 HG13 VAL 73 HG13 VAL 73 -13.615 0.938 -13.365 620 HG21 VAL 73 HG21 VAL 73 -14.686 -1.741 -14.802 621 HG22 VAL 73 HG22 VAL 73 -14.424 -0.270 -15.738 622 HG23 VAL 73 HG23 VAL 73 -16.024 -1.009 -15.691 623 H ARG 74 HN ARG 74 -13.882 -0.066 -10.762 624 HA ARG 74 HA ARG 74 -16.017 1.227 -9.198 625 HB2 ARG 74 HB2 ARG 74 -14.935 -0.472 -7.921 626 HB3 ARG 74 HB1 ARG 74 -13.342 0.075 -8.418 627 HG2 ARG 74 HG2 ARG 74 -13.739 0.691 -6.127 628 HG3 ARG 74 HG1 ARG 74 -13.669 2.144 -7.126 629 HD2 ARG 74 HD2 ARG 74 -15.487 2.339 -5.549 630 HD3 ARG 74 HD1 ARG 74 -16.142 2.181 -7.177 631 HE ARG 74 HE ARG 74 -15.972 -0.357 -5.944 632 HH11 ARG 74 HH11 ARG 74 -17.809 2.600 -5.866 633 HH12 ARG 74 HH12 ARG 74 -19.261 1.840 -5.305 634 HH21 ARG 74 HH21 ARG 74 -17.873 -1.374 -5.204 635 HH22 ARG 74 HH22 ARG 74 -19.297 -0.427 -4.927 636 H ARG 75 HN ARG 75 -16.136 3.352 -9.292 637 HA ARG 75 HA ARG 75 -13.705 4.839 -9.979 638 HB2 ARG 75 HB2 ARG 75 -16.609 5.578 -10.258 639 HB3 ARG 75 HB1 ARG 75 -15.297 6.731 -10.454 640 HG2 ARG 75 HG2 ARG 75 -14.389 5.391 -12.278 641 HG3 ARG 75 HG1 ARG 75 -15.727 4.252 -12.103 642 HD2 ARG 75 HD2 ARG 75 -17.307 6.038 -12.623 643 HD3 ARG 75 HD1 ARG 75 -15.971 7.179 -12.771 644 HE ARG 75 HE ARG 75 -15.582 4.982 -14.506 645 HH11 ARG 75 HH11 ARG 75 -17.507 7.863 -14.139 646 HH12 ARG 75 HH12 ARG 75 -17.753 8.072 -15.841 647 HH21 ARG 75 HH21 ARG 75 -15.900 5.243 -16.742 648 HH22 ARG 75 HH22 ARG 75 -16.829 6.584 -17.328 649 H ILE 76 HN ILE 76 -12.736 5.955 -8.519 650 HA ILE 76 HA ILE 76 -14.098 6.556 -5.984 651 HB ILE 76 HB ILE 76 -11.147 6.458 -6.604 652 HG12 ILE 76 HG12 ILE 76 -12.882 4.525 -5.046 653 HG13 ILE 76 HG11 ILE 76 -12.309 4.263 -6.692 654 HG21 ILE 76 HG21 ILE 76 -11.220 6.305 -3.953 655 HG22 ILE 76 HG22 ILE 76 -12.703 7.227 -4.190 656 HG23 ILE 76 HG23 ILE 76 -11.170 7.855 -4.794 657 HD11 ILE 76 HD11 ILE 76 -10.383 4.786 -4.490 658 HD12 ILE 76 HD12 ILE 76 -10.137 3.951 -6.023 659 HD13 ILE 76 HD13 ILE 76 -11.061 3.177 -4.734 660 H ILE 77 HN ILE 77 -14.765 8.618 -5.751 661 HA ILE 77 HA ILE 77 -13.238 10.742 -7.106 662 HB ILE 77 HB ILE 77 -16.197 10.786 -6.523 663 HG12 ILE 77 HG12 ILE 77 -15.768 10.905 -9.289 664 HG13 ILE 77 HG11 ILE 77 -14.700 9.628 -8.718 665 HG21 ILE 77 HG21 ILE 77 -16.305 12.862 -7.536 666 HG22 ILE 77 HG22 ILE 77 -14.779 12.640 -8.392 667 HG23 ILE 77 HG23 ILE 77 -14.779 12.961 -6.657 668 HD11 ILE 77 HD11 ILE 77 -16.956 8.866 -9.434 669 HD12 ILE 77 HD12 ILE 77 -17.631 9.761 -8.072 670 HD13 ILE 77 HD13 ILE 77 -16.520 8.421 -7.783 671 H GLY 78 HN GLY 78 -12.399 12.275 -5.834 672 HA2 GLY 78 HA2 GLY 78 -13.525 13.560 -3.691 673 HA3 GLY 78 HA1 GLY 78 -12.744 12.146 -2.994 674 H ASP 79 HN ASP 79 -11.367 13.679 -1.849 675 HA ASP 79 HA ASP 79 -9.518 15.263 -3.422 676 HB2 ASP 79 HB2 ASP 79 -10.331 16.050 -1.203 677 HB3 ASP 79 HB1 ASP 79 -9.525 14.681 -0.446 678 H LEU 80 HN LEU 80 -8.252 13.921 -4.622 679 HA LEU 80 HA LEU 80 -7.059 11.574 -3.428 680 HB2 LEU 80 HB2 LEU 80 -7.105 12.746 -6.186 681 HB3 LEU 80 HB1 LEU 80 -5.935 11.504 -5.782 682 HG LEU 80 HG LEU 80 -8.280 10.396 -4.887 683 HD11 LEU 80 HD11 LEU 80 -8.873 11.826 -7.474 684 HD12 LEU 80 HD12 LEU 80 -9.586 12.204 -5.906 685 HD13 LEU 80 HD13 LEU 80 -9.909 10.647 -6.670 686 HD21 LEU 80 HD21 LEU 80 -8.029 8.880 -6.703 687 HD22 LEU 80 HD22 LEU 80 -6.414 9.395 -6.220 688 HD23 LEU 80 HD23 LEU 80 -7.162 10.078 -7.664 689 H SER 81 HN SER 81 -6.223 14.800 -3.494 690 HA SER 81 HA SER 81 -3.418 14.596 -3.928 691 HB2 SER 81 HB2 SER 81 -5.015 16.691 -2.427 692 HB3 SER 81 HB1 SER 81 -3.313 16.843 -2.865 693 HG SER 81 HG SER 81 -4.078 17.653 -4.647 694 H ASN 82 HN ASN 82 -5.478 13.848 -1.315 695 HA ASN 82 HA ASN 82 -3.395 13.865 0.694 696 HB2 ASN 82 HB2 ASN 82 -5.678 14.463 1.339 697 HB3 ASN 82 HB1 ASN 82 -6.250 12.895 0.792 698 HD21 ASN 82 HD21 ASN 82 -4.262 14.532 3.171 699 HD22 ASN 82 HD22 ASN 82 -4.336 13.282 4.362 700 H ARG 83 HN ARG 83 -1.985 12.273 0.862 701 HA ARG 83 HA ARG 83 -2.096 9.948 -0.657 702 HB2 ARG 83 HB2 ARG 83 -0.419 10.627 1.758 703 HB3 ARG 83 HB1 ARG 83 -0.217 9.125 0.869 704 HG2 ARG 83 HG2 ARG 83 0.419 10.311 -1.114 705 HG3 ARG 83 HG1 ARG 83 0.040 11.861 -0.363 706 HD2 ARG 83 HD2 ARG 83 2.436 11.478 -0.345 707 HD3 ARG 83 HD1 ARG 83 1.802 11.474 1.300 708 HE ARG 83 HE ARG 83 1.907 8.842 0.235 709 HH11 ARG 83 HH11 ARG 83 3.902 11.368 1.564 710 HH12 ARG 83 HH12 ARG 83 5.104 10.281 2.175 711 HH21 ARG 83 HH21 ARG 83 3.477 7.396 1.039 712 HH22 ARG 83 HH22 ARG 83 4.861 8.015 1.875 713 H GLU 84 HN GLU 84 -3.132 10.454 2.683 714 HA GLU 84 HA GLU 84 -3.484 7.748 3.378 715 HB2 GLU 84 HB2 GLU 84 -4.783 10.274 4.340 716 HB3 GLU 84 HB1 GLU 84 -5.245 8.696 4.965 717 HG2 GLU 84 HG2 GLU 84 -3.022 8.286 5.747 718 HG3 GLU 84 HG1 GLU 84 -2.439 9.775 5.000 719 H LYS 85 HN LYS 85 -5.807 10.004 1.802 720 HA LYS 85 HA LYS 85 -7.878 8.067 1.790 721 HB2 LYS 85 HB2 LYS 85 -7.415 10.479 0.019 722 HB3 LYS 85 HB1 LYS 85 -8.833 9.453 -0.135 723 HG2 LYS 85 HG2 LYS 85 -9.473 10.014 2.163 724 HG3 LYS 85 HG1 LYS 85 -8.061 11.064 2.290 725 HD2 LYS 85 HD2 LYS 85 -8.917 12.371 0.355 726 HD3 LYS 85 HD1 LYS 85 -10.357 11.355 0.353 727 HE2 LYS 85 HE2 LYS 85 -9.450 13.083 2.654 728 HE3 LYS 85 HE1 LYS 85 -10.730 13.492 1.514 729 HZ1 LYS 85 HZ1 LYS 85 -10.743 11.588 3.719 730 HZ2 LYS 85 HZ2 LYS 85 -11.598 11.139 2.330 731 HZ3 LYS 85 HZ3 LYS 85 -11.987 12.576 3.135 732 H VAL 86 HN VAL 86 -5.367 8.812 -0.566 733 HA VAL 86 HA VAL 86 -6.239 6.983 -2.530 734 HB VAL 86 HB VAL 86 -3.476 8.078 -1.956 735 HG11 VAL 86 HG11 VAL 86 -4.442 6.185 -4.063 736 HG12 VAL 86 HG12 VAL 86 -2.941 6.160 -3.136 737 HG13 VAL 86 HG13 VAL 86 -3.158 7.337 -4.432 738 HG21 VAL 86 HG21 VAL 86 -4.489 9.900 -2.798 739 HG22 VAL 86 HG22 VAL 86 -5.837 8.970 -3.453 740 HG23 VAL 86 HG23 VAL 86 -4.320 9.074 -4.346 741 H LEU 87 HN LEU 87 -4.023 6.627 0.214 742 HA LEU 87 HA LEU 87 -3.314 3.921 -0.339 743 HB2 LEU 87 HB2 LEU 87 -2.629 5.916 1.554 744 HB3 LEU 87 HB1 LEU 87 -3.203 4.536 2.469 745 HG LEU 87 HG LEU 87 -0.998 4.406 0.416 746 HD11 LEU 87 HD11 LEU 87 -0.102 3.949 3.076 747 HD12 LEU 87 HD12 LEU 87 -0.969 5.487 3.038 748 HD13 LEU 87 HD13 LEU 87 0.390 5.212 1.946 749 HD21 LEU 87 HD21 LEU 87 -2.556 2.374 1.385 750 HD22 LEU 87 HD22 LEU 87 -1.201 2.371 2.516 751 HD23 LEU 87 HD23 LEU 87 -0.906 2.190 0.785 752 H ILE 88 HN ILE 88 -5.676 5.353 1.902 753 HA ILE 88 HA ILE 88 -6.556 2.916 2.992 754 HB ILE 88 HB ILE 88 -7.891 5.602 2.762 755 HG12 ILE 88 HG12 ILE 88 -6.851 4.132 5.187 756 HG13 ILE 88 HG11 ILE 88 -5.836 5.189 4.211 757 HG21 ILE 88 HG21 ILE 88 -8.901 3.209 4.302 758 HG22 ILE 88 HG22 ILE 88 -9.627 3.853 2.828 759 HG23 ILE 88 HG23 ILE 88 -9.603 4.828 4.299 760 HD11 ILE 88 HD11 ILE 88 -8.051 6.732 4.769 761 HD12 ILE 88 HD12 ILE 88 -6.472 6.822 5.557 762 HD13 ILE 88 HD13 ILE 88 -7.759 5.838 6.261 763 H ALA 89 HN ALA 89 -7.831 4.813 0.251 764 HA ALA 89 HA ALA 89 -9.973 3.068 -0.336 765 HB1 ALA 89 HB1 ALA 89 -9.219 5.499 -1.255 766 HB2 ALA 89 HB2 ALA 89 -10.428 4.478 -2.033 767 HB3 ALA 89 HB3 ALA 89 -8.765 4.477 -2.619 768 H LEU 90 HN LEU 90 -6.616 3.141 -1.463 769 HA LEU 90 HA LEU 90 -6.918 1.048 -3.362 770 HB2 LEU 90 HB2 LEU 90 -4.681 2.569 -2.201 771 HB3 LEU 90 HB1 LEU 90 -4.271 0.938 -2.685 772 HG LEU 90 HG LEU 90 -4.854 1.370 -4.960 773 HD11 LEU 90 HD11 LEU 90 -5.896 3.311 -5.779 774 HD12 LEU 90 HD12 LEU 90 -5.678 4.171 -4.253 775 HD13 LEU 90 HD13 LEU 90 -6.837 2.847 -4.360 776 HD21 LEU 90 HD21 LEU 90 -3.127 2.788 -5.525 777 HD22 LEU 90 HD22 LEU 90 -2.692 2.323 -3.879 778 HD23 LEU 90 HD23 LEU 90 -3.449 3.887 -4.182 779 H ARG 91 HN ARG 91 -6.065 1.084 0.090 780 HA ARG 91 HA ARG 91 -5.327 -1.659 0.275 781 HB2 ARG 91 HB2 ARG 91 -6.377 0.284 2.332 782 HB3 ARG 91 HB1 ARG 91 -5.906 -1.365 2.718 783 HG2 ARG 91 HG2 ARG 91 -3.637 -0.915 1.991 784 HG3 ARG 91 HG1 ARG 91 -4.099 0.726 1.526 785 HD2 ARG 91 HD2 ARG 91 -3.003 0.767 3.682 786 HD3 ARG 91 HD1 ARG 91 -4.703 1.196 3.867 787 HE ARG 91 HE ARG 91 -4.322 -1.582 4.275 788 HH11 ARG 91 HH11 ARG 91 -3.825 1.510 5.797 789 HH12 ARG 91 HH12 ARG 91 -3.922 0.883 7.408 790 HH21 ARG 91 HH21 ARG 91 -4.454 -2.425 6.388 791 HH22 ARG 91 HH22 ARG 91 -4.281 -1.364 7.744 792 H LEU 92 HN LEU 92 -8.420 0.031 0.716 793 HA LEU 92 HA LEU 92 -9.898 -2.252 1.455 794 HB2 LEU 92 HB2 LEU 92 -10.742 0.334 0.146 795 HB3 LEU 92 HB1 LEU 92 -11.883 -0.896 0.650 796 HG LEU 92 HG LEU 92 -9.969 0.492 2.526 797 HD11 LEU 92 HD11 LEU 92 -12.049 1.664 3.310 798 HD12 LEU 92 HD12 LEU 92 -12.838 1.089 1.840 799 HD13 LEU 92 HD13 LEU 92 -11.447 2.167 1.731 800 HD21 LEU 92 HD21 LEU 92 -11.767 -0.385 4.168 801 HD22 LEU 92 HD22 LEU 92 -10.556 -1.507 3.548 802 HD23 LEU 92 HD23 LEU 92 -12.181 -1.498 2.864 803 H LEU 93 HN LEU 93 -9.147 -0.840 -1.684 804 HA LEU 93 HA LEU 93 -10.802 -2.545 -3.224 805 HB2 LEU 93 HB2 LEU 93 -8.304 -1.012 -3.917 806 HB3 LEU 93 HB1 LEU 93 -9.215 -1.931 -5.100 807 HG LEU 93 HG LEU 93 -10.353 0.361 -3.497 808 HD11 LEU 93 HD11 LEU 93 -8.797 0.268 -6.001 809 HD12 LEU 93 HD12 LEU 93 -8.994 1.572 -4.829 810 HD13 LEU 93 HD13 LEU 93 -10.253 1.264 -6.027 811 HD21 LEU 93 HD21 LEU 93 -11.552 -1.674 -5.082 812 HD22 LEU 93 HD22 LEU 93 -11.700 -0.142 -5.944 813 HD23 LEU 93 HD23 LEU 93 -12.317 -0.290 -4.299 814 H ALA 94 HN ALA 94 -7.443 -2.768 -2.145 815 HA ALA 94 HA ALA 94 -6.760 -5.069 -3.602 816 HB1 ALA 94 HB1 ALA 94 -5.609 -4.005 -1.022 817 HB2 ALA 94 HB2 ALA 94 -5.037 -3.669 -2.657 818 HB3 ALA 94 HB3 ALA 94 -4.884 -5.293 -1.986 819 H GLU 95 HN GLU 95 -8.200 -4.682 -0.399 820 HA GLU 95 HA GLU 95 -8.015 -7.369 0.401 821 HB2 GLU 95 HB2 GLU 95 -9.935 -5.161 1.144 822 HB3 GLU 95 HB1 GLU 95 -9.971 -6.746 1.905 823 HG2 GLU 95 HG2 GLU 95 -7.772 -6.440 2.796 824 HG3 GLU 95 HG1 GLU 95 -7.555 -4.952 1.876 825 H GLU 96 HN GLU 96 -10.398 -5.608 -1.482 826 HA GLU 96 HA GLU 96 -12.397 -7.581 -1.637 827 HB2 GLU 96 HB2 GLU 96 -11.601 -5.362 -3.536 828 HB3 GLU 96 HB1 GLU 96 -13.029 -6.364 -3.768 829 HG2 GLU 96 HG2 GLU 96 -12.497 -4.565 -1.410 830 HG3 GLU 96 HG1 GLU 96 -13.603 -4.238 -2.742 831 H ILE 97 HN ILE 97 -9.530 -6.949 -3.562 832 HA ILE 97 HA ILE 97 -9.968 -8.778 -5.646 833 HB ILE 97 HB ILE 97 -7.413 -7.666 -4.484 834 HG12 ILE 97 HG12 ILE 97 -8.792 -6.959 -7.064 835 HG13 ILE 97 HG11 ILE 97 -9.189 -6.165 -5.542 836 HG21 ILE 97 HG21 ILE 97 -6.602 -8.289 -6.901 837 HG22 ILE 97 HG22 ILE 97 -7.883 -9.500 -6.794 838 HG23 ILE 97 HG23 ILE 97 -6.573 -9.494 -5.613 839 HD11 ILE 97 HD11 ILE 97 -7.361 -4.923 -5.576 840 HD12 ILE 97 HD12 ILE 97 -7.304 -5.335 -7.290 841 HD13 ILE 97 HD13 ILE 97 -6.340 -6.251 -6.129 842 H GLY 98 HN GLY 98 -8.201 -9.108 -2.570 843 HA2 GLY 98 HA2 GLY 98 -7.334 -11.765 -2.964 844 HA3 GLY 98 HA1 GLY 98 -7.507 -10.969 -1.406 845 H ASP 99 HN ASP 99 -10.302 -10.447 -1.621 846 HA ASP 99 HA ASP 99 -11.358 -12.866 -0.604 847 HB2 ASP 99 HB2 ASP 99 -12.172 -10.597 0.024 848 HB3 ASP 99 HB1 ASP 99 -12.887 -10.444 -1.578 849 H TYR 100 HN TYR 100 -11.643 -11.281 -3.750 850 HA TYR 100 HA TYR 100 -13.467 -13.291 -4.748 851 HB2 TYR 100 HB2 TYR 100 -13.727 -10.985 -5.505 852 HB3 TYR 100 HB1 TYR 100 -12.078 -10.978 -6.124 853 HD1 TYR 100 HD1 TYR 100 -15.375 -12.664 -6.565 854 HD2 TYR 100 HD2 TYR 100 -11.656 -11.591 -8.337 855 HE1 TYR 100 HE1 TYR 100 -16.195 -13.442 -8.748 856 HE2 TYR 100 HE2 TYR 100 -12.469 -12.366 -10.524 857 HH TYR 100 HH TYR 100 -15.413 -12.722 -11.372 858 H LYS 101 HN LYS 101 -12.675 -15.235 -5.181 859 HA LYS 101 HA LYS 101 -10.033 -15.419 -6.462 860 HB2 LYS 101 HB2 LYS 101 -11.545 -17.513 -4.882 861 HB3 LYS 101 HB1 LYS 101 -9.968 -17.742 -5.623 862 HG2 LYS 101 HG2 LYS 101 -9.044 -15.985 -4.179 863 HG3 LYS 101 HG1 LYS 101 -10.625 -15.798 -3.419 864 HD2 LYS 101 HD2 LYS 101 -10.517 -18.178 -2.726 865 HD3 LYS 101 HD1 LYS 101 -8.884 -18.263 -3.389 866 HE2 LYS 101 HE2 LYS 101 -9.807 -16.429 -1.177 867 HE3 LYS 101 HE1 LYS 101 -8.852 -17.896 -0.970 868 HZ1 LYS 101 HZ1 LYS 101 -7.315 -16.627 -2.686 869 HZ2 LYS 101 HZ2 LYS 101 -7.190 -16.379 -1.017 870 HZ3 LYS 101 HZ3 LYS 101 -8.047 -15.276 -1.973 871 H ASP 102 HN ASP 102 -9.924 -16.134 -8.497 872 HA ASP 102 HA ASP 102 -12.043 -17.832 -9.565 873 HB2 ASP 102 HB2 ASP 102 -12.751 -15.528 -10.090 874 HB3 ASP 102 HB1 ASP 102 -11.209 -15.240 -10.889 875 H ASP 103 HN ASP 103 -10.866 -19.557 -10.143 876 HA ASP 103 HA ASP 103 -8.205 -19.207 -11.273 877 HB2 ASP 103 HB2 ASP 103 -8.615 -20.965 -9.562 878 HB3 ASP 103 HB1 ASP 103 -9.726 -21.757 -10.673 879 H ASP 104 HN ASP 104 -8.222 -18.633 -13.366 880 HA ASP 104 HA ASP 104 -10.094 -19.990 -15.186 881 HB2 ASP 104 HB2 ASP 104 -9.895 -17.398 -15.014 882 HB3 ASP 104 HB1 ASP 104 -8.422 -17.612 -15.954 883 H ASP 105 HN ASP 105 -7.284 -20.763 -14.062 884 HA ASP 105 HA ASP 105 -5.805 -21.075 -16.557 885 HB2 ASP 105 HB2 ASP 105 -4.613 -20.432 -14.468 886 HB3 ASP 105 HB1 ASP 105 -5.068 -21.979 -13.763 887 H LYS 106 HN LYS 106 -6.636 -22.631 -17.811 888 HA LYS 106 HA LYS 106 -7.290 -24.665 -18.574 889 HB2 LYS 106 HB2 LYS 106 -5.458 -25.404 -16.321 890 HB3 LYS 106 HB1 LYS 106 -6.336 -26.661 -17.182 891 HG2 LYS 106 HG2 LYS 106 -5.300 -26.040 -19.260 892 HG3 LYS 106 HG1 LYS 106 -4.529 -24.645 -18.503 893 HD2 LYS 106 HD2 LYS 106 -2.878 -26.353 -18.682 894 HD3 LYS 106 HD1 LYS 106 -3.340 -26.251 -16.982 895 HE2 LYS 106 HE2 LYS 106 -3.184 -28.566 -17.605 896 HE3 LYS 106 HE1 LYS 106 -4.879 -28.164 -17.334 897 HZ1 LYS 106 HZ1 LYS 106 -3.844 -29.373 -19.548 898 HZ2 LYS 106 HZ2 LYS 106 -4.092 -27.779 -20.056 899 HZ3 LYS 106 HZ3 LYS 106 -5.379 -28.675 -19.425 Start of MODEL 17 1 H1 MET 1 HT1 MET 1 -17.643 -14.733 -17.323 2 H2 MET 1 HT2 MET 1 -17.645 -15.518 -15.824 3 H3 MET 1 HT3 MET 1 -19.078 -15.391 -16.714 4 HA MET 1 HA MET 1 -18.111 -17.617 -16.835 5 HB2 MET 1 HB2 MET 1 -18.187 -17.808 -19.302 6 HB3 MET 1 HB1 MET 1 -19.518 -16.855 -18.659 7 HG2 MET 1 HG2 MET 1 -18.328 -14.801 -19.276 8 HG3 MET 1 HG1 MET 1 -17.021 -15.773 -19.949 9 HE1 MET 1 HE1 MET 1 -17.220 -14.540 -22.323 10 HE2 MET 1 HE2 MET 1 -18.448 -13.514 -21.581 11 HE3 MET 1 HE3 MET 1 -18.764 -14.286 -23.135 12 H ALA 2 HN ALA 2 -15.907 -15.261 -16.700 13 HA ALA 2 HA ALA 2 -13.742 -17.044 -17.590 14 HB1 ALA 2 HB1 ALA 2 -14.326 -14.318 -18.471 15 HB2 ALA 2 HB2 ALA 2 -13.321 -15.559 -19.217 16 HB3 ALA 2 HB3 ALA 2 -12.663 -14.549 -17.929 17 HA PRO 3 HA PRO 3 -12.093 -16.366 -13.545 18 HB2 PRO 3 HB2 PRO 3 -9.482 -16.880 -13.951 19 HB3 PRO 3 HB1 PRO 3 -10.713 -18.151 -13.981 20 HG2 PRO 3 HG2 PRO 3 -9.460 -16.680 -16.266 21 HG3 PRO 3 HG1 PRO 3 -9.735 -18.420 -16.083 22 HD2 PRO 3 HD2 PRO 3 -11.377 -16.859 -17.544 23 HD3 PRO 3 HD1 PRO 3 -11.982 -18.246 -16.612 24 H LEU 4 HN LEU 4 -10.807 -14.954 -12.275 25 HA LEU 4 HA LEU 4 -10.125 -12.472 -13.685 26 HB2 LEU 4 HB2 LEU 4 -10.661 -12.906 -10.744 27 HB3 LEU 4 HB1 LEU 4 -10.378 -11.361 -11.523 28 HG LEU 4 HG LEU 4 -12.751 -13.167 -11.995 29 HD11 LEU 4 HD11 LEU 4 -13.771 -10.861 -11.077 30 HD12 LEU 4 HD12 LEU 4 -12.241 -10.887 -10.201 31 HD13 LEU 4 HD13 LEU 4 -13.371 -12.232 -10.042 32 HD21 LEU 4 HD21 LEU 4 -12.534 -12.110 -14.024 33 HD22 LEU 4 HD22 LEU 4 -11.814 -10.663 -13.318 34 HD23 LEU 4 HD23 LEU 4 -13.544 -10.961 -13.143 35 H ARG 5 HN ARG 5 -8.128 -11.598 -13.567 36 HA ARG 5 HA ARG 5 -5.969 -13.286 -12.736 37 HB2 ARG 5 HB2 ARG 5 -6.186 -10.606 -14.057 38 HB3 ARG 5 HB1 ARG 5 -4.640 -11.119 -13.394 39 HG2 ARG 5 HG2 ARG 5 -4.578 -11.718 -15.657 40 HG3 ARG 5 HG1 ARG 5 -4.902 -13.222 -14.793 41 HD2 ARG 5 HD2 ARG 5 -6.343 -13.141 -16.698 42 HD3 ARG 5 HD1 ARG 5 -7.328 -12.883 -15.258 43 HE ARG 5 HE ARG 5 -6.469 -10.420 -16.405 44 HH11 ARG 5 HH11 ARG 5 -8.797 -12.994 -16.721 45 HH12 ARG 5 HH12 ARG 5 -9.964 -12.016 -17.545 46 HH21 ARG 5 HH21 ARG 5 -7.996 -9.119 -17.489 47 HH22 ARG 5 HH22 ARG 5 -9.506 -9.807 -17.985 48 H LYS 6 HN LYS 6 -4.341 -12.782 -11.208 49 HA LYS 6 HA LYS 6 -5.282 -11.799 -8.747 50 HB2 LYS 6 HB2 LYS 6 -2.476 -12.367 -9.700 51 HB3 LYS 6 HB1 LYS 6 -2.871 -11.941 -8.042 52 HG2 LYS 6 HG2 LYS 6 -3.982 -14.336 -9.491 53 HG3 LYS 6 HG1 LYS 6 -2.584 -14.372 -8.417 54 HD2 LYS 6 HD2 LYS 6 -4.053 -13.461 -6.607 55 HD3 LYS 6 HD1 LYS 6 -5.425 -13.665 -7.697 56 HE2 LYS 6 HE2 LYS 6 -3.578 -15.864 -6.771 57 HE3 LYS 6 HE1 LYS 6 -5.191 -15.548 -6.135 58 HZ1 LYS 6 HZ1 LYS 6 -5.453 -17.253 -7.695 59 HZ2 LYS 6 HZ2 LYS 6 -4.447 -16.508 -8.832 60 HZ3 LYS 6 HZ3 LYS 6 -5.976 -15.861 -8.506 61 H THR 7 HN THR 7 -3.321 -10.347 -11.255 62 HA THR 7 HA THR 7 -2.928 -7.923 -9.735 63 HB THR 7 HB THR 7 -2.082 -7.176 -12.140 64 HG1 THR 7 HG1 THR 7 -2.652 -8.983 -13.299 65 HG21 THR 7 HG21 THR 7 0.132 -8.389 -11.534 66 HG22 THR 7 HG22 THR 7 -0.739 -8.891 -10.085 67 HG23 THR 7 HG23 THR 7 -0.514 -7.175 -10.428 68 H ALA 8 HN ALA 8 -4.253 -6.301 -9.674 69 HA ALA 8 HA ALA 8 -6.500 -6.166 -11.541 70 HB1 ALA 8 HB1 ALA 8 -6.797 -6.111 -9.032 71 HB2 ALA 8 HB2 ALA 8 -7.597 -4.828 -9.943 72 HB3 ALA 8 HB3 ALA 8 -6.094 -4.494 -9.080 73 H VAL 9 HN VAL 9 -7.126 -4.149 -12.506 74 HA VAL 9 HA VAL 9 -4.778 -2.470 -13.071 75 HB VAL 9 HB VAL 9 -7.199 -2.960 -14.809 76 HG11 VAL 9 HG11 VAL 9 -4.929 -1.038 -14.992 77 HG12 VAL 9 HG12 VAL 9 -6.609 -0.854 -15.493 78 HG13 VAL 9 HG13 VAL 9 -5.495 -1.795 -16.483 79 HG21 VAL 9 HG21 VAL 9 -6.005 -4.477 -16.000 80 HG22 VAL 9 HG22 VAL 9 -5.197 -4.693 -14.446 81 HG23 VAL 9 HG23 VAL 9 -4.465 -3.673 -15.688 82 H LEU 10 HN LEU 10 -4.850 -0.482 -12.348 83 HA LEU 10 HA LEU 10 -7.462 0.739 -11.680 84 HB2 LEU 10 HB2 LEU 10 -5.986 0.241 -9.719 85 HB3 LEU 10 HB1 LEU 10 -4.761 1.277 -10.420 86 HG LEU 10 HG LEU 10 -6.274 3.218 -10.163 87 HD11 LEU 10 HD11 LEU 10 -8.098 1.153 -8.952 88 HD12 LEU 10 HD12 LEU 10 -8.447 2.275 -10.267 89 HD13 LEU 10 HD13 LEU 10 -8.258 2.878 -8.620 90 HD21 LEU 10 HD21 LEU 10 -6.156 1.894 -7.502 91 HD22 LEU 10 HD22 LEU 10 -5.763 3.551 -7.954 92 HD23 LEU 10 HD23 LEU 10 -4.658 2.240 -8.365 93 H LYS 11 HN LYS 11 -7.922 2.629 -12.803 94 HA LYS 11 HA LYS 11 -5.691 3.663 -14.425 95 HB2 LYS 11 HB2 LYS 11 -8.620 3.481 -15.138 96 HB3 LYS 11 HB1 LYS 11 -7.460 4.442 -16.045 97 HG2 LYS 11 HG2 LYS 11 -6.182 2.415 -16.540 98 HG3 LYS 11 HG1 LYS 11 -7.373 1.458 -15.659 99 HD2 LYS 11 HD2 LYS 11 -9.110 2.164 -17.218 100 HD3 LYS 11 HD1 LYS 11 -7.942 3.164 -18.084 101 HE2 LYS 11 HE2 LYS 11 -6.655 1.172 -18.656 102 HE3 LYS 11 HE1 LYS 11 -7.808 0.166 -17.779 103 HZ1 LYS 11 HZ1 LYS 11 -9.190 1.769 -19.638 104 HZ2 LYS 11 HZ2 LYS 11 -9.076 0.082 -19.576 105 HZ3 LYS 11 HZ3 LYS 11 -7.927 0.975 -20.437 106 H LEU 12 HN LEU 12 -5.263 5.754 -14.373 107 HA LEU 12 HA LEU 12 -7.033 7.429 -12.737 108 HB2 LEU 12 HB2 LEU 12 -4.348 6.937 -12.400 109 HB3 LEU 12 HB1 LEU 12 -4.333 8.452 -13.278 110 HG LEU 12 HG LEU 12 -5.625 7.914 -10.604 111 HD11 LEU 12 HD11 LEU 12 -3.082 8.357 -10.943 112 HD12 LEU 12 HD12 LEU 12 -3.964 9.195 -9.667 113 HD13 LEU 12 HD13 LEU 12 -3.602 10.025 -11.180 114 HD21 LEU 12 HD21 LEU 12 -7.142 9.403 -11.489 115 HD22 LEU 12 HD22 LEU 12 -5.936 10.194 -12.503 116 HD23 LEU 12 HD23 LEU 12 -5.960 10.493 -10.766 117 H TYR 13 HN TYR 13 -8.064 9.083 -13.826 118 HA TYR 13 HA TYR 13 -7.181 9.666 -16.569 119 HB2 TYR 13 HB2 TYR 13 -9.770 10.259 -15.113 120 HB3 TYR 13 HB1 TYR 13 -9.428 10.661 -16.793 121 HD1 TYR 13 HD1 TYR 13 -10.089 7.912 -14.437 122 HD2 TYR 13 HD2 TYR 13 -9.498 8.971 -18.514 123 HE1 TYR 13 HE1 TYR 13 -10.929 5.708 -15.122 124 HE2 TYR 13 HE2 TYR 13 -10.334 6.763 -19.212 125 HH TYR 13 HH TYR 13 -11.319 4.863 -18.540 126 H VAL 14 HN VAL 14 -6.029 11.499 -16.827 127 HA VAL 14 HA VAL 14 -6.447 13.681 -14.885 128 HB VAL 14 HB VAL 14 -4.042 14.285 -15.199 129 HG11 VAL 14 HG11 VAL 14 -4.628 11.600 -13.946 130 HG12 VAL 14 HG12 VAL 14 -4.797 13.177 -13.169 131 HG13 VAL 14 HG13 VAL 14 -3.196 12.583 -13.627 132 HG21 VAL 14 HG21 VAL 14 -3.426 13.165 -17.186 133 HG22 VAL 14 HG22 VAL 14 -3.994 11.610 -16.575 134 HG23 VAL 14 HG23 VAL 14 -2.552 12.354 -15.884 135 H ALA 15 HN ALA 15 -5.838 15.823 -15.704 136 HA ALA 15 HA ALA 15 -6.246 16.003 -18.614 137 HB1 ALA 15 HB1 ALA 15 -7.977 17.385 -18.358 138 HB2 ALA 15 HB2 ALA 15 -7.080 18.391 -17.220 139 HB3 ALA 15 HB3 ALA 15 -7.959 16.975 -16.642 140 H GLY 16 HN GLY 16 -4.141 16.301 -19.233 141 HA2 GLY 16 HA2 GLY 16 -2.251 17.525 -19.680 142 HA3 GLY 16 HA1 GLY 16 -3.012 18.882 -18.866 143 H ASN 17 HN ASN 17 -1.083 19.486 -17.871 144 HA ASN 17 HA ASN 17 -0.147 17.646 -15.771 145 HB2 ASN 17 HB2 ASN 17 1.369 19.730 -17.351 146 HB3 ASN 17 HB1 ASN 17 1.994 19.033 -15.861 147 HD21 ASN 17 HD21 ASN 17 3.250 18.859 -18.366 148 HD22 ASN 17 HD22 ASN 17 3.291 17.197 -18.833 149 H THR 18 HN THR 18 -2.370 19.198 -15.307 150 HA THR 18 HA THR 18 -1.713 21.660 -14.018 151 HB THR 18 HB THR 18 -3.992 21.587 -13.104 152 HG1 THR 18 HG1 THR 18 -5.291 19.693 -13.830 153 HG21 THR 18 HG21 THR 18 -5.022 22.054 -15.077 154 HG22 THR 18 HG22 THR 18 -4.430 20.587 -15.860 155 HG23 THR 18 HG23 THR 18 -3.361 21.978 -15.666 156 HA PRO 19 HA PRO 19 -0.209 20.415 -10.096 157 HB2 PRO 19 HB2 PRO 19 -2.402 22.052 -8.871 158 HB3 PRO 19 HB1 PRO 19 -0.664 22.075 -8.541 159 HG2 PRO 19 HG2 PRO 19 -1.722 23.995 -10.010 160 HG3 PRO 19 HG1 PRO 19 -0.181 23.264 -10.500 161 HD2 PRO 19 HD2 PRO 19 -2.932 22.795 -11.592 162 HD3 PRO 19 HD1 PRO 19 -1.388 22.956 -12.456 163 H ASN 20 HN ASN 20 -3.741 20.319 -10.397 164 HA ASN 20 HA ASN 20 -4.172 18.507 -8.251 165 HB2 ASN 20 HB2 ASN 20 -5.880 18.979 -10.725 166 HB3 ASN 20 HB1 ASN 20 -6.368 18.030 -9.329 167 HD21 ASN 20 HD21 ASN 20 -6.029 19.262 -7.186 168 HD22 ASN 20 HD22 ASN 20 -6.631 20.880 -7.175 169 H SER 21 HN SER 21 -3.788 18.040 -11.764 170 HA SER 21 HA SER 21 -3.965 15.197 -11.758 171 HB2 SER 21 HB2 SER 21 -2.681 17.115 -13.719 172 HB3 SER 21 HB1 SER 21 -2.936 15.396 -14.016 173 HG SER 21 HG SER 21 -4.701 17.474 -14.169 174 H VAL 22 HN VAL 22 -1.196 17.415 -11.636 175 HA VAL 22 HA VAL 22 0.732 15.363 -11.710 176 HB VAL 22 HB VAL 22 0.877 18.191 -10.638 177 HG11 VAL 22 HG11 VAL 22 3.365 17.876 -10.702 178 HG12 VAL 22 HG12 VAL 22 3.071 16.143 -10.850 179 HG13 VAL 22 HG13 VAL 22 2.528 17.011 -9.411 180 HG21 VAL 22 HG21 VAL 22 0.721 18.379 -12.925 181 HG22 VAL 22 HG22 VAL 22 1.571 16.861 -13.216 182 HG23 VAL 22 HG23 VAL 22 2.469 18.292 -12.707 183 H ARG 23 HN ARG 23 -0.831 17.031 -9.030 184 HA ARG 23 HA ARG 23 0.573 15.832 -6.913 185 HB2 ARG 23 HB2 ARG 23 -1.252 17.764 -7.079 186 HB3 ARG 23 HB1 ARG 23 -2.332 16.440 -6.649 187 HG2 ARG 23 HG2 ARG 23 -1.871 17.034 -4.553 188 HG3 ARG 23 HG1 ARG 23 -0.360 16.152 -4.800 189 HD2 ARG 23 HD2 ARG 23 0.748 18.208 -5.470 190 HD3 ARG 23 HD1 ARG 23 -0.766 19.097 -5.302 191 HE ARG 23 HE ARG 23 -0.209 17.859 -2.860 192 HH11 ARG 23 HH11 ARG 23 1.094 20.354 -4.909 193 HH12 ARG 23 HH12 ARG 23 1.786 21.253 -3.599 194 HH21 ARG 23 HH21 ARG 23 0.696 19.028 -1.124 195 HH22 ARG 23 HH22 ARG 23 1.560 20.495 -1.441 196 H ALA 24 HN ALA 24 -2.467 14.971 -8.515 197 HA ALA 24 HA ALA 24 -3.075 12.741 -6.916 198 HB1 ALA 24 HB1 ALA 24 -4.921 12.639 -8.158 199 HB2 ALA 24 HB2 ALA 24 -4.006 12.485 -9.657 200 HB3 ALA 24 HB3 ALA 24 -4.315 14.081 -8.973 201 H LEU 25 HN LEU 25 -1.366 12.957 -10.039 202 HA LEU 25 HA LEU 25 -1.002 10.184 -10.363 203 HB2 LEU 25 HB2 LEU 25 0.440 12.554 -11.496 204 HB3 LEU 25 HB1 LEU 25 0.949 10.918 -11.865 205 HG LEU 25 HG LEU 25 -1.829 11.956 -12.384 206 HD11 LEU 25 HD11 LEU 25 0.675 12.250 -13.902 207 HD12 LEU 25 HD12 LEU 25 -0.812 13.198 -13.966 208 HD13 LEU 25 HD13 LEU 25 -0.706 11.662 -14.828 209 HD21 LEU 25 HD21 LEU 25 -2.314 9.873 -13.002 210 HD22 LEU 25 HD22 LEU 25 -0.766 9.372 -12.316 211 HD23 LEU 25 HD23 LEU 25 -0.881 9.787 -14.028 212 H LYS 26 HN LYS 26 1.133 12.604 -8.837 213 HA LYS 26 HA LYS 26 3.244 10.798 -8.338 214 HB2 LYS 26 HB2 LYS 26 2.436 13.343 -6.934 215 HB3 LYS 26 HB1 LYS 26 3.869 12.426 -6.494 216 HG2 LYS 26 HG2 LYS 26 4.751 12.726 -8.761 217 HG3 LYS 26 HG1 LYS 26 3.318 13.667 -9.183 218 HD2 LYS 26 HD2 LYS 26 3.888 15.319 -7.480 219 HD3 LYS 26 HD1 LYS 26 5.305 14.372 -7.022 220 HE2 LYS 26 HE2 LYS 26 6.232 14.676 -9.267 221 HE3 LYS 26 HE1 LYS 26 4.814 15.618 -9.727 222 HZ1 LYS 26 HZ1 LYS 26 5.407 17.222 -7.979 223 HZ2 LYS 26 HZ2 LYS 26 6.610 17.084 -9.160 224 HZ3 LYS 26 HZ3 LYS 26 6.816 16.341 -7.655 225 H THR 27 HN THR 27 0.382 11.670 -6.466 226 HA THR 27 HA THR 27 1.017 10.200 -4.132 227 HB THR 27 HB THR 27 -1.679 11.036 -5.223 228 HG1 THR 27 HG1 THR 27 -0.543 12.881 -4.852 229 HG21 THR 27 HG21 THR 27 -2.278 9.563 -3.563 230 HG22 THR 27 HG22 THR 27 -2.092 11.048 -2.626 231 HG23 THR 27 HG23 THR 27 -0.804 9.842 -2.635 232 H LEU 28 HN LEU 28 -0.913 9.410 -7.016 233 HA LEU 28 HA LEU 28 -1.722 6.850 -6.086 234 HB2 LEU 28 HB2 LEU 28 -2.065 8.468 -8.452 235 HB3 LEU 28 HB1 LEU 28 -1.739 6.805 -8.895 236 HG LEU 28 HG LEU 28 -4.096 7.069 -8.815 237 HD11 LEU 28 HD11 LEU 28 -4.230 5.789 -6.295 238 HD12 LEU 28 HD12 LEU 28 -2.730 5.293 -7.079 239 HD13 LEU 28 HD13 LEU 28 -4.273 5.068 -7.903 240 HD21 LEU 28 HD21 LEU 28 -3.506 8.819 -6.606 241 HD22 LEU 28 HD22 LEU 28 -4.766 7.663 -6.177 242 HD23 LEU 28 HD23 LEU 28 -4.965 8.700 -7.589 243 H ALA 29 HN ALA 29 0.794 7.834 -8.449 244 HA ALA 29 HA ALA 29 1.631 5.237 -9.091 245 HB1 ALA 29 HB1 ALA 29 2.459 7.927 -9.668 246 HB2 ALA 29 HB2 ALA 29 2.663 6.457 -10.621 247 HB3 ALA 29 HB3 ALA 29 3.858 6.886 -9.398 248 H ASN 30 HN ASN 30 2.859 7.491 -6.621 249 HA ASN 30 HA ASN 30 5.083 5.851 -5.888 250 HB2 ASN 30 HB2 ASN 30 5.015 8.246 -5.329 251 HB3 ASN 30 HB1 ASN 30 3.636 7.967 -4.272 252 HD21 ASN 30 HD21 ASN 30 7.039 7.229 -4.753 253 HD22 ASN 30 HD22 ASN 30 7.397 6.941 -3.088 254 H ILE 31 HN ILE 31 1.820 6.135 -4.571 255 HA ILE 31 HA ILE 31 2.234 4.338 -2.470 256 HB ILE 31 HB ILE 31 -0.259 5.284 -3.825 257 HG12 ILE 31 HG12 ILE 31 0.808 5.642 -1.026 258 HG13 ILE 31 HG11 ILE 31 1.128 6.753 -2.353 259 HG21 ILE 31 HG21 ILE 31 -1.587 3.800 -2.843 260 HG22 ILE 31 HG22 ILE 31 -0.744 3.957 -1.300 261 HG23 ILE 31 HG23 ILE 31 -0.140 2.840 -2.526 262 HD11 ILE 31 HD11 ILE 31 -1.143 7.370 -2.493 263 HD12 ILE 31 HD12 ILE 31 -0.686 7.433 -0.790 264 HD13 ILE 31 HD13 ILE 31 -1.626 6.072 -1.402 265 H LEU 32 HN LEU 32 0.983 3.818 -5.754 266 HA LEU 32 HA LEU 32 0.579 1.031 -5.415 267 HB2 LEU 32 HB2 LEU 32 0.831 2.767 -7.853 268 HB3 LEU 32 HB1 LEU 32 0.557 1.036 -7.955 269 HG LEU 32 HG LEU 32 -1.277 2.900 -6.440 270 HD11 LEU 32 HD11 LEU 32 -1.866 1.760 -9.148 271 HD12 LEU 32 HD12 LEU 32 -1.052 3.316 -8.971 272 HD13 LEU 32 HD13 LEU 32 -2.665 3.082 -8.297 273 HD21 LEU 32 HD21 LEU 32 -1.911 0.896 -5.649 274 HD22 LEU 32 HD22 LEU 32 -1.158 0.012 -6.976 275 HD23 LEU 32 HD23 LEU 32 -2.737 0.762 -7.202 276 H GLU 33 HN GLU 33 3.373 2.900 -6.479 277 HA GLU 33 HA GLU 33 4.855 0.678 -7.450 278 HB2 GLU 33 HB2 GLU 33 5.722 3.429 -6.586 279 HB3 GLU 33 HB1 GLU 33 6.839 2.228 -7.217 280 HG2 GLU 33 HG2 GLU 33 5.618 2.166 -9.315 281 HG3 GLU 33 HG1 GLU 33 4.446 3.317 -8.674 282 H LYS 34 HN LYS 34 4.484 2.022 -4.222 283 HA LYS 34 HA LYS 34 6.561 0.131 -3.316 284 HB2 LYS 34 HB2 LYS 34 5.606 2.634 -1.919 285 HB3 LYS 34 HB1 LYS 34 6.873 1.555 -1.352 286 HG2 LYS 34 HG2 LYS 34 6.968 3.169 -3.895 287 HG3 LYS 34 HG1 LYS 34 7.765 3.594 -2.380 288 HD2 LYS 34 HD2 LYS 34 9.073 1.511 -2.507 289 HD3 LYS 34 HD1 LYS 34 8.295 1.133 -4.047 290 HE2 LYS 34 HE2 LYS 34 9.224 3.185 -5.012 291 HE3 LYS 34 HE1 LYS 34 10.006 3.552 -3.475 292 HZ1 LYS 34 HZ1 LYS 34 10.534 1.054 -4.977 293 HZ2 LYS 34 HZ2 LYS 34 11.428 1.708 -3.699 294 HZ3 LYS 34 HZ3 LYS 34 11.436 2.466 -5.210 295 H GLU 35 HN GLU 35 3.536 1.631 -2.168 296 HA GLU 35 HA GLU 35 3.135 -0.197 -0.054 297 HB2 GLU 35 HB2 GLU 35 1.272 1.705 -1.479 298 HB3 GLU 35 HB1 GLU 35 0.767 0.725 -0.105 299 HG2 GLU 35 HG2 GLU 35 2.973 2.776 -0.097 300 HG3 GLU 35 HG1 GLU 35 1.361 2.980 0.581 301 H PHE 36 HN PHE 36 1.881 -0.162 -3.386 302 HA PHE 36 HA PHE 36 0.813 -2.858 -2.845 303 HB2 PHE 36 HB2 PHE 36 -0.333 -0.766 -4.696 304 HB3 PHE 36 HB1 PHE 36 -0.927 -2.417 -4.556 305 HD1 PHE 36 HD1 PHE 36 -0.899 0.887 -3.099 306 HD2 PHE 36 HD2 PHE 36 -1.958 -3.179 -2.439 307 HE1 PHE 36 HE1 PHE 36 -2.331 1.569 -1.221 308 HE2 PHE 36 HE2 PHE 36 -3.395 -2.506 -0.561 309 HZ PHE 36 HZ PHE 36 -3.582 -0.127 0.050 310 H LYS 37 HN LYS 37 3.466 -2.106 -3.919 311 HA LYS 37 HA LYS 37 3.660 -2.522 -6.665 312 HB2 LYS 37 HB2 LYS 37 5.534 -1.757 -5.275 313 HB3 LYS 37 HB1 LYS 37 5.617 -3.340 -4.512 314 HG2 LYS 37 HG2 LYS 37 7.354 -3.207 -6.134 315 HG3 LYS 37 HG1 LYS 37 6.129 -4.318 -6.743 316 HD2 LYS 37 HD2 LYS 37 5.224 -2.561 -8.171 317 HD3 LYS 37 HD1 LYS 37 6.406 -1.417 -7.533 318 HE2 LYS 37 HE2 LYS 37 7.033 -3.935 -9.072 319 HE3 LYS 37 HE1 LYS 37 7.080 -2.296 -9.719 320 HZ1 LYS 37 HZ1 LYS 37 8.990 -3.676 -8.041 321 HZ2 LYS 37 HZ2 LYS 37 8.675 -2.080 -7.579 322 HZ3 LYS 37 HZ3 LYS 37 9.227 -2.414 -9.143 323 H GLY 38 HN GLY 38 3.341 -4.217 -7.939 324 HA2 GLY 38 HA2 GLY 38 3.525 -6.453 -8.617 325 HA3 GLY 38 HA1 GLY 38 3.795 -6.914 -6.947 326 H VAL 39 HN VAL 39 1.201 -5.034 -6.597 327 HA VAL 39 HA VAL 39 -0.597 -7.313 -7.053 328 HB VAL 39 HB VAL 39 -0.960 -5.062 -5.060 329 HG11 VAL 39 HG11 VAL 39 -3.048 -6.139 -5.986 330 HG12 VAL 39 HG12 VAL 39 -2.855 -6.222 -4.234 331 HG13 VAL 39 HG13 VAL 39 -2.509 -7.637 -5.227 332 HG21 VAL 39 HG21 VAL 39 0.919 -6.685 -4.598 333 HG22 VAL 39 HG22 VAL 39 -0.314 -7.937 -4.452 334 HG23 VAL 39 HG23 VAL 39 -0.317 -6.563 -3.347 335 H TYR 40 HN TYR 40 -0.453 -3.754 -7.285 336 HA TYR 40 HA TYR 40 -2.765 -3.990 -9.061 337 HB2 TYR 40 HB2 TYR 40 -2.214 -2.150 -6.887 338 HB3 TYR 40 HB1 TYR 40 -2.487 -1.261 -8.375 339 HD1 TYR 40 HD1 TYR 40 -4.010 -3.038 -5.652 340 HD2 TYR 40 HD2 TYR 40 -4.660 -1.610 -9.605 341 HE1 TYR 40 HE1 TYR 40 -6.439 -3.168 -5.295 342 HE2 TYR 40 HE2 TYR 40 -7.089 -1.742 -9.261 343 HH TYR 40 HH TYR 40 -8.598 -3.372 -7.391 344 H ALA 41 HN ALA 41 -2.750 -3.027 -11.054 345 HA ALA 41 HA ALA 41 -0.152 -1.984 -11.966 346 HB1 ALA 41 HB1 ALA 41 -0.697 -2.712 -14.132 347 HB2 ALA 41 HB2 ALA 41 -2.416 -2.834 -13.753 348 HB3 ALA 41 HB3 ALA 41 -1.280 -4.005 -13.083 349 H LEU 42 HN LEU 42 -0.003 0.159 -12.449 350 HA LEU 42 HA LEU 42 -2.480 1.700 -12.371 351 HB2 LEU 42 HB2 LEU 42 -0.753 2.440 -10.850 352 HB3 LEU 42 HB1 LEU 42 0.398 2.577 -12.166 353 HG LEU 42 HG LEU 42 -0.979 4.393 -13.147 354 HD11 LEU 42 HD11 LEU 42 -2.709 3.743 -10.824 355 HD12 LEU 42 HD12 LEU 42 -3.144 4.231 -12.461 356 HD13 LEU 42 HD13 LEU 42 -2.565 5.432 -11.307 357 HD21 LEU 42 HD21 LEU 42 -0.490 5.346 -10.402 358 HD22 LEU 42 HD22 LEU 42 0.093 5.967 -11.948 359 HD23 LEU 42 HD23 LEU 42 0.868 4.564 -11.210 360 H LYS 43 HN LYS 43 -3.366 2.594 -14.039 361 HA LYS 43 HA LYS 43 -1.772 3.050 -16.475 362 HB2 LYS 43 HB2 LYS 43 -4.252 1.546 -16.102 363 HB3 LYS 43 HB1 LYS 43 -4.426 2.832 -17.287 364 HG2 LYS 43 HG2 LYS 43 -3.743 1.189 -18.667 365 HG3 LYS 43 HG1 LYS 43 -2.158 1.790 -18.182 366 HD2 LYS 43 HD2 LYS 43 -1.785 -0.002 -16.744 367 HD3 LYS 43 HD1 LYS 43 -3.503 -0.391 -16.632 368 HE2 LYS 43 HE2 LYS 43 -2.508 -2.068 -17.985 369 HE3 LYS 43 HE1 LYS 43 -3.420 -1.011 -19.062 370 HZ1 LYS 43 HZ1 LYS 43 -0.760 -0.079 -18.783 371 HZ2 LYS 43 HZ2 LYS 43 -1.583 -0.549 -20.184 372 HZ3 LYS 43 HZ3 LYS 43 -0.754 -1.702 -19.265 373 H VAL 44 HN VAL 44 -1.993 5.015 -17.415 374 HA VAL 44 HA VAL 44 -3.876 6.916 -16.142 375 HB VAL 44 HB VAL 44 -1.702 7.552 -15.409 376 HG11 VAL 44 HG11 VAL 44 -0.091 6.529 -16.656 377 HG12 VAL 44 HG12 VAL 44 0.013 8.165 -17.309 378 HG13 VAL 44 HG13 VAL 44 -0.877 6.922 -18.188 379 HG21 VAL 44 HG21 VAL 44 -3.104 9.403 -16.111 380 HG22 VAL 44 HG22 VAL 44 -2.452 9.289 -17.746 381 HG23 VAL 44 HG23 VAL 44 -1.403 9.759 -16.409 382 H ILE 45 HN ILE 45 -5.174 7.986 -17.326 383 HA ILE 45 HA ILE 45 -4.895 7.792 -20.242 384 HB ILE 45 HB ILE 45 -7.387 8.254 -18.603 385 HG12 ILE 45 HG12 ILE 45 -6.499 6.043 -18.093 386 HG13 ILE 45 HG11 ILE 45 -7.970 5.898 -19.043 387 HG21 ILE 45 HG21 ILE 45 -7.129 7.418 -21.491 388 HG22 ILE 45 HG22 ILE 45 -7.455 9.063 -20.942 389 HG23 ILE 45 HG23 ILE 45 -8.623 7.779 -20.618 390 HD11 ILE 45 HD11 ILE 45 -6.159 4.314 -19.657 391 HD12 ILE 45 HD12 ILE 45 -5.201 5.696 -20.193 392 HD13 ILE 45 HD13 ILE 45 -6.728 5.319 -20.992 393 H ASP 46 HN ASP 46 -3.922 9.715 -20.795 394 HA ASP 46 HA ASP 46 -4.501 12.163 -19.432 395 HB2 ASP 46 HB2 ASP 46 -2.313 11.618 -20.572 396 HB3 ASP 46 HB1 ASP 46 -3.135 11.862 -22.110 397 H VAL 47 HN VAL 47 -6.482 12.916 -19.602 398 HA VAL 47 HA VAL 47 -8.282 12.485 -21.692 399 HB VAL 47 HB VAL 47 -8.244 14.497 -19.484 400 HG11 VAL 47 HG11 VAL 47 -9.963 14.462 -21.773 401 HG12 VAL 47 HG12 VAL 47 -9.892 15.616 -20.442 402 HG13 VAL 47 HG13 VAL 47 -10.885 14.165 -20.298 403 HG21 VAL 47 HG21 VAL 47 -8.653 11.772 -19.463 404 HG22 VAL 47 HG22 VAL 47 -10.286 12.444 -19.438 405 HG23 VAL 47 HG23 VAL 47 -9.124 12.908 -18.198 406 H LEU 48 HN LEU 48 -6.183 15.311 -21.098 407 HA LEU 48 HA LEU 48 -7.345 16.835 -23.202 408 HB2 LEU 48 HB2 LEU 48 -4.761 17.167 -21.704 409 HB3 LEU 48 HB1 LEU 48 -5.261 18.256 -22.984 410 HG LEU 48 HG LEU 48 -6.825 17.749 -20.450 411 HD11 LEU 48 HD11 LEU 48 -4.669 19.633 -21.122 412 HD12 LEU 48 HD12 LEU 48 -5.212 19.034 -19.556 413 HD13 LEU 48 HD13 LEU 48 -6.086 20.344 -20.349 414 HD21 LEU 48 HD21 LEU 48 -7.833 20.014 -21.359 415 HD22 LEU 48 HD22 LEU 48 -8.449 18.451 -21.892 416 HD23 LEU 48 HD23 LEU 48 -7.319 19.346 -22.908 417 H LYS 49 HN LYS 49 -4.473 14.743 -23.067 418 HA LYS 49 HA LYS 49 -3.644 15.400 -25.719 419 HB2 LYS 49 HB2 LYS 49 -2.910 13.107 -23.916 420 HB3 LYS 49 HB1 LYS 49 -2.249 13.299 -25.533 421 HG2 LYS 49 HG2 LYS 49 -1.358 15.503 -24.875 422 HG3 LYS 49 HG1 LYS 49 -1.952 15.225 -23.236 423 HD2 LYS 49 HD2 LYS 49 -0.531 13.266 -23.031 424 HD3 LYS 49 HD1 LYS 49 0.022 13.475 -24.693 425 HE2 LYS 49 HE2 LYS 49 1.688 14.338 -23.168 426 HE3 LYS 49 HE1 LYS 49 0.967 15.667 -24.076 427 HZ1 LYS 49 HZ1 LYS 49 0.065 16.548 -22.235 428 HZ2 LYS 49 HZ2 LYS 49 1.259 15.662 -21.427 429 HZ3 LYS 49 HZ3 LYS 49 -0.314 15.045 -21.546 430 H ASN 50 HN ASN 50 -5.647 12.862 -24.329 431 HA ASN 50 HA ASN 50 -6.478 12.157 -27.070 432 HB2 ASN 50 HB2 ASN 50 -6.086 10.240 -24.759 433 HB3 ASN 50 HB1 ASN 50 -6.766 9.813 -26.324 434 HD21 ASN 50 HD21 ASN 50 -5.260 10.612 -28.195 435 HD22 ASN 50 HD22 ASN 50 -3.600 10.168 -28.013 436 HA PRO 51 HA PRO 51 -10.064 13.532 -24.444 437 HB2 PRO 51 HB2 PRO 51 -11.256 14.868 -26.542 438 HB3 PRO 51 HB1 PRO 51 -10.167 15.612 -25.365 439 HG2 PRO 51 HG2 PRO 51 -9.578 14.616 -28.122 440 HG3 PRO 51 HG1 PRO 51 -8.985 16.072 -27.300 441 HD2 PRO 51 HD2 PRO 51 -7.476 13.877 -27.570 442 HD3 PRO 51 HD1 PRO 51 -7.384 14.909 -26.127 443 H GLN 52 HN GLN 52 -9.729 11.952 -27.535 444 HA GLN 52 HA GLN 52 -12.406 11.123 -27.907 445 HB2 GLN 52 HB2 GLN 52 -9.795 9.848 -28.763 446 HB3 GLN 52 HB1 GLN 52 -11.376 9.291 -29.291 447 HG2 GLN 52 HG2 GLN 52 -10.917 10.618 -31.052 448 HG3 GLN 52 HG1 GLN 52 -11.584 11.861 -29.991 449 HE21 GLN 52 HE21 GLN 52 -9.781 12.321 -32.117 450 HE22 GLN 52 HE22 GLN 52 -8.318 12.948 -31.445 451 H LEU 53 HN LEU 53 -9.681 9.743 -26.171 452 HA LEU 53 HA LEU 53 -11.056 7.346 -25.480 453 HB2 LEU 53 HB2 LEU 53 -8.530 8.604 -24.412 454 HB3 LEU 53 HB1 LEU 53 -9.145 7.059 -23.849 455 HG LEU 53 HG LEU 53 -8.453 7.632 -26.726 456 HD11 LEU 53 HD11 LEU 53 -6.526 7.712 -25.031 457 HD12 LEU 53 HD12 LEU 53 -6.359 6.642 -26.422 458 HD13 LEU 53 HD13 LEU 53 -6.796 5.980 -24.847 459 HD21 LEU 53 HD21 LEU 53 -9.730 5.805 -26.966 460 HD22 LEU 53 HD22 LEU 53 -9.584 5.343 -25.269 461 HD23 LEU 53 HD23 LEU 53 -8.288 4.959 -26.403 462 H ALA 54 HN ALA 54 -10.550 10.490 -23.999 463 HA ALA 54 HA ALA 54 -11.564 9.902 -21.425 464 HB1 ALA 54 HB1 ALA 54 -10.420 11.906 -21.476 465 HB2 ALA 54 HB2 ALA 54 -12.094 12.462 -21.545 466 HB3 ALA 54 HB3 ALA 54 -11.132 12.386 -23.018 467 H GLU 55 HN GLU 55 -13.006 11.055 -24.426 468 HA GLU 55 HA GLU 55 -15.661 11.375 -23.451 469 HB2 GLU 55 HB2 GLU 55 -14.834 12.448 -25.530 470 HB3 GLU 55 HB1 GLU 55 -14.729 10.866 -26.286 471 HG2 GLU 55 HG2 GLU 55 -17.139 10.583 -26.062 472 HG3 GLU 55 HG1 GLU 55 -17.257 12.150 -25.266 473 H GLU 56 HN GLU 56 -13.912 8.693 -24.910 474 HA GLU 56 HA GLU 56 -16.095 6.975 -25.324 475 HB2 GLU 56 HB2 GLU 56 -13.200 6.343 -24.691 476 HB3 GLU 56 HB1 GLU 56 -14.382 5.129 -25.154 477 HG2 GLU 56 HG2 GLU 56 -14.704 6.335 -27.301 478 HG3 GLU 56 HG1 GLU 56 -13.408 7.444 -26.831 479 H ASP 57 HN ASP 57 -14.064 7.515 -22.459 480 HA ASP 57 HA ASP 57 -15.807 5.707 -20.963 481 HB2 ASP 57 HB2 ASP 57 -13.159 7.014 -20.257 482 HB3 ASP 57 HB1 ASP 57 -14.131 6.151 -19.067 483 H LYS 58 HN LYS 58 -16.207 8.623 -21.926 484 HA LYS 58 HA LYS 58 -17.320 10.478 -21.274 485 HB2 LYS 58 HB2 LYS 58 -18.605 8.457 -19.447 486 HB3 LYS 58 HB1 LYS 58 -19.224 10.083 -19.710 487 HG2 LYS 58 HG2 LYS 58 -19.493 9.592 -22.098 488 HG3 LYS 58 HG1 LYS 58 -18.885 7.958 -21.821 489 HD2 LYS 58 HD2 LYS 58 -20.762 7.532 -20.290 490 HD3 LYS 58 HD1 LYS 58 -21.379 9.154 -20.610 491 HE2 LYS 58 HE2 LYS 58 -21.004 6.982 -22.671 492 HE3 LYS 58 HE1 LYS 58 -22.540 7.434 -21.932 493 HZ1 LYS 58 HZ1 LYS 58 -20.913 8.914 -23.881 494 HZ2 LYS 58 HZ2 LYS 58 -21.918 9.772 -22.825 495 HZ3 LYS 58 HZ3 LYS 58 -22.580 8.623 -23.875 496 H ILE 59 HN ILE 59 -14.909 10.691 -20.235 497 HA ILE 59 HA ILE 59 -15.061 11.175 -17.374 498 HB ILE 59 HB ILE 59 -12.820 11.721 -19.329 499 HG12 ILE 59 HG12 ILE 59 -13.357 9.341 -19.194 500 HG13 ILE 59 HG11 ILE 59 -11.809 9.668 -18.423 501 HG21 ILE 59 HG21 ILE 59 -12.697 11.578 -16.320 502 HG22 ILE 59 HG22 ILE 59 -12.748 13.079 -17.247 503 HG23 ILE 59 HG23 ILE 59 -11.382 11.978 -17.424 504 HD11 ILE 59 HD11 ILE 59 -13.302 9.821 -16.264 505 HD12 ILE 59 HD12 ILE 59 -12.742 8.271 -16.892 506 HD13 ILE 59 HD13 ILE 59 -14.386 8.816 -17.227 507 H LEU 60 HN LEU 60 -16.154 12.943 -16.762 508 HA LEU 60 HA LEU 60 -15.859 15.407 -18.333 509 HB2 LEU 60 HB2 LEU 60 -17.915 14.685 -16.245 510 HB3 LEU 60 HB1 LEU 60 -17.869 16.186 -17.147 511 HG LEU 60 HG LEU 60 -18.298 13.447 -18.349 512 HD11 LEU 60 HD11 LEU 60 -20.232 15.707 -17.851 513 HD12 LEU 60 HD12 LEU 60 -20.201 14.156 -17.011 514 HD13 LEU 60 HD13 LEU 60 -20.591 14.220 -18.730 515 HD21 LEU 60 HD21 LEU 60 -18.092 16.199 -19.520 516 HD22 LEU 60 HD22 LEU 60 -19.031 14.937 -20.317 517 HD23 LEU 60 HD23 LEU 60 -17.305 14.707 -20.037 518 H ALA 61 HN ALA 61 -14.735 13.981 -15.495 519 HA ALA 61 HA ALA 61 -13.805 16.589 -14.533 520 HB1 ALA 61 HB1 ALA 61 -15.872 15.528 -13.261 521 HB2 ALA 61 HB2 ALA 61 -14.584 16.365 -12.395 522 HB3 ALA 61 HB3 ALA 61 -14.598 14.602 -12.465 523 H THR 62 HN THR 62 -11.743 16.582 -13.764 524 HA THR 62 HA THR 62 -10.361 14.023 -13.434 525 HB THR 62 HB THR 62 -8.362 15.016 -14.541 526 HG1 THR 62 HG1 THR 62 -9.409 17.250 -14.237 527 HG21 THR 62 HG21 THR 62 -9.117 14.800 -16.845 528 HG22 THR 62 HG22 THR 62 -10.796 14.972 -16.327 529 HG23 THR 62 HG23 THR 62 -9.865 13.558 -15.836 530 HA PRO 63 HA PRO 63 -8.246 13.488 -13.011 531 HB2 PRO 63 HB2 PRO 63 -7.226 12.294 -10.821 532 HB3 PRO 63 HB1 PRO 63 -6.348 13.525 -11.734 533 HG2 PRO 63 HG2 PRO 63 -7.859 13.783 -9.174 534 HG3 PRO 63 HG1 PRO 63 -6.315 14.511 -9.653 535 HD2 PRO 63 HD2 PRO 63 -8.708 15.848 -9.699 536 HD3 PRO 63 HD1 PRO 63 -7.333 16.247 -10.748 537 H THR 64 HN THR 64 -9.022 11.411 -13.031 538 HA THR 64 HA THR 64 -11.287 10.817 -11.233 539 HB THR 64 HB THR 64 -11.347 9.352 -13.751 540 HG1 THR 64 HG1 THR 64 -11.911 12.121 -14.004 541 HG21 THR 64 HG21 THR 64 -13.341 9.234 -12.631 542 HG22 THR 64 HG22 THR 64 -13.683 10.594 -13.702 543 HG23 THR 64 HG23 THR 64 -13.224 10.890 -12.027 544 H LEU 65 HN LEU 65 -10.986 9.031 -10.038 545 HA LEU 65 HA LEU 65 -8.865 7.142 -10.848 546 HB2 LEU 65 HB2 LEU 65 -8.577 8.248 -8.662 547 HB3 LEU 65 HB1 LEU 65 -10.129 7.619 -8.144 548 HG LEU 65 HG LEU 65 -9.241 5.318 -8.338 549 HD11 LEU 65 HD11 LEU 65 -7.466 5.009 -9.640 550 HD12 LEU 65 HD12 LEU 65 -6.495 5.676 -8.327 551 HD13 LEU 65 HD13 LEU 65 -7.063 6.725 -9.626 552 HD21 LEU 65 HD21 LEU 65 -9.122 6.706 -6.227 553 HD22 LEU 65 HD22 LEU 65 -7.428 6.999 -6.623 554 HD23 LEU 65 HD23 LEU 65 -7.994 5.354 -6.328 555 H ALA 66 HN ALA 66 -9.567 5.293 -11.739 556 HA ALA 66 HA ALA 66 -11.978 4.044 -10.620 557 HB1 ALA 66 HB1 ALA 66 -13.185 3.969 -12.549 558 HB2 ALA 66 HB2 ALA 66 -11.756 3.979 -13.580 559 HB3 ALA 66 HB3 ALA 66 -12.323 5.479 -12.841 560 H LYS 67 HN LYS 67 -11.969 1.915 -10.557 561 HA LYS 67 HA LYS 67 -9.561 0.564 -11.530 562 HB2 LYS 67 HB2 LYS 67 -9.991 0.296 -9.138 563 HB3 LYS 67 HB1 LYS 67 -11.632 -0.228 -9.459 564 HG2 LYS 67 HG2 LYS 67 -9.619 -1.897 -10.760 565 HG3 LYS 67 HG1 LYS 67 -9.485 -1.863 -9.001 566 HD2 LYS 67 HD2 LYS 67 -12.232 -2.155 -9.965 567 HD3 LYS 67 HD1 LYS 67 -11.167 -3.476 -10.448 568 HE2 LYS 67 HE2 LYS 67 -10.496 -3.756 -8.088 569 HE3 LYS 67 HE1 LYS 67 -11.637 -2.492 -7.633 570 HZ1 LYS 67 HZ1 LYS 67 -12.229 -5.097 -7.685 571 HZ2 LYS 67 HZ2 LYS 67 -12.752 -4.639 -9.230 572 HZ3 LYS 67 HZ3 LYS 67 -13.378 -3.867 -7.858 573 H VAL 68 HN VAL 68 -9.930 -0.140 -13.568 574 HA VAL 68 HA VAL 68 -12.583 -0.841 -14.431 575 HB VAL 68 HB VAL 68 -11.530 -1.296 -16.618 576 HG11 VAL 68 HG11 VAL 68 -12.303 0.966 -15.931 577 HG12 VAL 68 HG12 VAL 68 -11.023 0.984 -17.143 578 HG13 VAL 68 HG13 VAL 68 -10.646 1.337 -15.456 579 HG21 VAL 68 HG21 VAL 68 -9.244 -1.785 -15.251 580 HG22 VAL 68 HG22 VAL 68 -8.947 -0.143 -15.820 581 HG23 VAL 68 HG23 VAL 68 -9.308 -1.425 -16.975 582 H LEU 69 HN LEU 69 -9.738 -2.541 -13.376 583 HA LEU 69 HA LEU 69 -11.234 -5.058 -13.694 584 HB2 LEU 69 HB2 LEU 69 -8.336 -4.662 -14.442 585 HB3 LEU 69 HB1 LEU 69 -9.129 -6.220 -14.337 586 HG LEU 69 HG LEU 69 -9.947 -4.031 -16.250 587 HD11 LEU 69 HD11 LEU 69 -8.019 -4.600 -17.269 588 HD12 LEU 69 HD12 LEU 69 -8.963 -5.989 -17.811 589 HD13 LEU 69 HD13 LEU 69 -7.894 -6.138 -16.415 590 HD21 LEU 69 HD21 LEU 69 -11.045 -6.058 -17.364 591 HD22 LEU 69 HD22 LEU 69 -11.810 -5.403 -15.916 592 HD23 LEU 69 HD23 LEU 69 -10.828 -6.866 -15.813 593 HA PRO 70 HA PRO 70 -11.227 -7.056 -13.088 594 HB2 PRO 70 HB2 PRO 70 -12.432 -8.438 -11.129 595 HB3 PRO 70 HB1 PRO 70 -10.751 -8.753 -11.579 596 HG2 PRO 70 HG2 PRO 70 -11.829 -7.125 -9.302 597 HG3 PRO 70 HG1 PRO 70 -10.516 -8.320 -9.296 598 HD2 PRO 70 HD2 PRO 70 -10.086 -5.629 -9.417 599 HD3 PRO 70 HD1 PRO 70 -8.985 -6.822 -10.136 600 HA PRO 71 HA PRO 71 -15.046 -4.793 -13.004 601 HB2 PRO 71 HB2 PRO 71 -16.754 -6.621 -14.069 602 HB3 PRO 71 HB1 PRO 71 -15.544 -5.763 -15.033 603 HG2 PRO 71 HG2 PRO 71 -15.411 -8.514 -13.841 604 HG3 PRO 71 HG1 PRO 71 -14.964 -7.984 -15.475 605 HD2 PRO 71 HD2 PRO 71 -13.114 -8.362 -13.563 606 HD3 PRO 71 HD1 PRO 71 -12.962 -7.063 -14.763 607 HA PRO 72 HA PRO 72 -17.434 -4.399 -13.110 608 HB2 PRO 72 HB2 PRO 72 -18.820 -2.815 -11.425 609 HB3 PRO 72 HB1 PRO 72 -19.471 -4.341 -12.034 610 HG2 PRO 72 HG2 PRO 72 -18.151 -3.764 -9.402 611 HG3 PRO 72 HG1 PRO 72 -19.636 -4.680 -9.727 612 HD2 PRO 72 HD2 PRO 72 -17.255 -5.889 -9.291 613 HD3 PRO 72 HD1 PRO 72 -18.479 -6.568 -10.382 614 H VAL 73 HN VAL 73 -17.100 -2.103 -13.398 615 HA VAL 73 HA VAL 73 -14.534 -1.255 -12.506 616 HB VAL 73 HB VAL 73 -16.669 0.283 -14.000 617 HG11 VAL 73 HG11 VAL 73 -13.812 0.926 -13.359 618 HG12 VAL 73 HG12 VAL 73 -15.247 1.933 -13.172 619 HG13 VAL 73 HG13 VAL 73 -14.606 1.602 -14.782 620 HG21 VAL 73 HG21 VAL 73 -16.173 -1.085 -15.685 621 HG22 VAL 73 HG22 VAL 73 -14.825 -1.799 -14.800 622 HG23 VAL 73 HG23 VAL 73 -14.584 -0.319 -15.728 623 H ARG 74 HN ARG 74 -13.990 -0.085 -10.798 624 HA ARG 74 HA ARG 74 -16.123 1.165 -9.195 625 HB2 ARG 74 HB2 ARG 74 -14.961 -0.532 -7.956 626 HB3 ARG 74 HB1 ARG 74 -13.400 0.102 -8.446 627 HG2 ARG 74 HG2 ARG 74 -13.822 0.678 -6.152 628 HG3 ARG 74 HG1 ARG 74 -13.830 2.140 -7.138 629 HD2 ARG 74 HD2 ARG 74 -16.282 2.102 -7.162 630 HD3 ARG 74 HD1 ARG 74 -16.273 0.641 -6.177 631 HE ARG 74 HE ARG 74 -15.755 3.351 -5.296 632 HH11 ARG 74 HH11 ARG 74 -15.544 -0.050 -4.560 633 HH12 ARG 74 HH12 ARG 74 -15.423 0.195 -2.849 634 HH21 ARG 74 HH21 ARG 74 -15.598 3.685 -3.049 635 HH22 ARG 74 HH22 ARG 74 -15.454 2.323 -1.988 636 H ARG 75 HN ARG 75 -16.274 3.294 -9.307 637 HA ARG 75 HA ARG 75 -13.869 4.809 -10.030 638 HB2 ARG 75 HB2 ARG 75 -16.786 5.499 -10.268 639 HB3 ARG 75 HB1 ARG 75 -15.504 6.683 -10.461 640 HG2 ARG 75 HG2 ARG 75 -14.589 5.429 -12.323 641 HG3 ARG 75 HG1 ARG 75 -15.845 4.201 -12.128 642 HD2 ARG 75 HD2 ARG 75 -16.390 7.108 -12.673 643 HD3 ARG 75 HD1 ARG 75 -16.274 5.880 -13.931 644 HE ARG 75 HE ARG 75 -18.141 4.986 -12.076 645 HH11 ARG 75 HH11 ARG 75 -17.761 7.620 -14.321 646 HH12 ARG 75 HH12 ARG 75 -19.462 7.814 -14.587 647 HH21 ARG 75 HH21 ARG 75 -20.383 5.226 -12.413 648 HH22 ARG 75 HH22 ARG 75 -20.958 6.449 -13.497 649 H ILE 76 HN ILE 76 -12.872 5.880 -8.541 650 HA ILE 76 HA ILE 76 -14.238 6.475 -6.008 651 HB ILE 76 HB ILE 76 -11.282 6.367 -6.613 652 HG12 ILE 76 HG12 ILE 76 -13.041 4.426 -5.091 653 HG13 ILE 76 HG11 ILE 76 -12.452 4.178 -6.732 654 HG21 ILE 76 HG21 ILE 76 -12.763 6.710 -4.003 655 HG22 ILE 76 HG22 ILE 76 -11.746 7.909 -4.802 656 HG23 ILE 76 HG23 ILE 76 -11.028 6.435 -4.153 657 HD11 ILE 76 HD11 ILE 76 -10.252 3.934 -6.024 658 HD12 ILE 76 HD12 ILE 76 -11.214 3.021 -4.860 659 HD13 ILE 76 HD13 ILE 76 -10.597 4.619 -4.438 660 H ILE 77 HN ILE 77 -14.897 8.538 -5.769 661 HA ILE 77 HA ILE 77 -13.387 10.657 -7.150 662 HB ILE 77 HB ILE 77 -16.320 10.679 -6.442 663 HG12 ILE 77 HG12 ILE 77 -15.855 9.129 -8.282 664 HG13 ILE 77 HG11 ILE 77 -16.717 10.547 -8.868 665 HG21 ILE 77 HG21 ILE 77 -16.454 12.831 -7.110 666 HG22 ILE 77 HG22 ILE 77 -15.224 12.632 -8.359 667 HG23 ILE 77 HG23 ILE 77 -14.745 12.851 -6.675 668 HD11 ILE 77 HD11 ILE 77 -15.095 10.186 -10.479 669 HD12 ILE 77 HD12 ILE 77 -13.862 9.767 -9.289 670 HD13 ILE 77 HD13 ILE 77 -14.381 11.444 -9.471 671 H GLY 78 HN GLY 78 -12.442 12.134 -5.892 672 HA2 GLY 78 HA2 GLY 78 -13.474 13.421 -3.693 673 HA3 GLY 78 HA1 GLY 78 -12.667 11.997 -3.049 674 H ASP 79 HN ASP 79 -11.302 13.627 -1.962 675 HA ASP 79 HA ASP 79 -9.482 15.147 -3.623 676 HB2 ASP 79 HB2 ASP 79 -10.262 16.016 -1.425 677 HB3 ASP 79 HB1 ASP 79 -9.444 14.679 -0.626 678 H LEU 80 HN LEU 80 -8.159 13.836 -4.773 679 HA LEU 80 HA LEU 80 -6.969 11.502 -3.543 680 HB2 LEU 80 HB2 LEU 80 -6.625 12.657 -6.313 681 HB3 LEU 80 HB1 LEU 80 -5.960 11.130 -5.771 682 HG LEU 80 HG LEU 80 -8.907 11.768 -5.967 683 HD11 LEU 80 HD11 LEU 80 -7.375 9.840 -7.679 684 HD12 LEU 80 HD12 LEU 80 -7.528 11.541 -8.118 685 HD13 LEU 80 HD13 LEU 80 -8.971 10.540 -7.949 686 HD21 LEU 80 HD21 LEU 80 -8.660 10.158 -4.269 687 HD22 LEU 80 HD22 LEU 80 -7.386 9.308 -5.142 688 HD23 LEU 80 HD23 LEU 80 -9.050 9.237 -5.722 689 H SER 81 HN SER 81 -6.171 14.739 -3.606 690 HA SER 81 HA SER 81 -3.357 14.564 -4.007 691 HB2 SER 81 HB2 SER 81 -5.006 16.653 -2.549 692 HB3 SER 81 HB1 SER 81 -3.297 16.821 -2.955 693 HG SER 81 HG SER 81 -3.918 17.471 -4.841 694 H ASN 82 HN ASN 82 -5.440 13.765 -1.435 695 HA ASN 82 HA ASN 82 -3.380 13.819 0.608 696 HB2 ASN 82 HB2 ASN 82 -5.714 14.407 1.182 697 HB3 ASN 82 HB1 ASN 82 -6.215 12.787 0.720 698 HD21 ASN 82 HD21 ASN 82 -7.025 13.184 3.049 699 HD22 ASN 82 HD22 ASN 82 -6.000 12.575 4.299 700 H ARG 83 HN ARG 83 -1.970 12.237 0.775 701 HA ARG 83 HA ARG 83 -2.065 9.901 -0.727 702 HB2 ARG 83 HB2 ARG 83 -0.422 10.626 1.700 703 HB3 ARG 83 HB1 ARG 83 -0.211 9.098 0.858 704 HG2 ARG 83 HG2 ARG 83 1.228 10.115 -0.482 705 HG3 ARG 83 HG1 ARG 83 -0.118 11.052 -1.134 706 HD2 ARG 83 HD2 ARG 83 1.166 11.936 1.408 707 HD3 ARG 83 HD1 ARG 83 1.991 12.244 -0.120 708 HE ARG 83 HE ARG 83 -0.494 13.165 -0.600 709 HH11 ARG 83 HH11 ARG 83 1.763 13.723 1.996 710 HH12 ARG 83 HH12 ARG 83 1.203 15.330 2.312 711 HH21 ARG 83 HH21 ARG 83 -1.238 15.269 -0.206 712 HH22 ARG 83 HH22 ARG 83 -0.513 16.214 1.054 713 H GLU 84 HN GLU 84 -3.174 10.474 2.576 714 HA GLU 84 HA GLU 84 -3.516 7.789 3.342 715 HB2 GLU 84 HB2 GLU 84 -4.925 10.311 4.169 716 HB3 GLU 84 HB1 GLU 84 -5.318 8.744 4.861 717 HG2 GLU 84 HG2 GLU 84 -3.142 8.496 5.758 718 HG3 GLU 84 HG1 GLU 84 -2.551 9.908 4.879 719 H LYS 85 HN LYS 85 -5.814 9.970 1.645 720 HA LYS 85 HA LYS 85 -7.879 8.026 1.647 721 HB2 LYS 85 HB2 LYS 85 -7.407 10.433 -0.129 722 HB3 LYS 85 HB1 LYS 85 -8.817 9.393 -0.304 723 HG2 LYS 85 HG2 LYS 85 -9.511 9.952 1.970 724 HG3 LYS 85 HG1 LYS 85 -8.099 10.998 2.143 725 HD2 LYS 85 HD2 LYS 85 -8.902 12.323 0.198 726 HD3 LYS 85 HD1 LYS 85 -10.344 11.310 0.150 727 HE2 LYS 85 HE2 LYS 85 -9.493 13.015 2.490 728 HE3 LYS 85 HE1 LYS 85 -10.740 13.440 1.319 729 HZ1 LYS 85 HZ1 LYS 85 -11.618 11.066 2.099 730 HZ2 LYS 85 HZ2 LYS 85 -12.057 12.505 2.872 731 HZ3 LYS 85 HZ3 LYS 85 -10.829 11.538 3.518 732 H VAL 86 HN VAL 86 -5.346 8.755 -0.696 733 HA VAL 86 HA VAL 86 -6.214 6.917 -2.654 734 HB VAL 86 HB VAL 86 -3.444 7.983 -2.058 735 HG11 VAL 86 HG11 VAL 86 -4.408 6.052 -4.110 736 HG12 VAL 86 HG12 VAL 86 -2.865 6.120 -3.258 737 HG13 VAL 86 HG13 VAL 86 -3.196 7.246 -4.574 738 HG21 VAL 86 HG21 VAL 86 -4.254 9.003 -4.445 739 HG22 VAL 86 HG22 VAL 86 -4.433 9.820 -2.893 740 HG23 VAL 86 HG23 VAL 86 -5.782 8.909 -3.572 741 H LEU 87 HN LEU 87 -3.955 6.558 0.074 742 HA LEU 87 HA LEU 87 -3.281 3.854 -0.446 743 HB2 LEU 87 HB2 LEU 87 -1.857 5.243 0.921 744 HB3 LEU 87 HB1 LEU 87 -3.164 5.556 2.044 745 HG LEU 87 HG LEU 87 -3.128 3.177 2.703 746 HD11 LEU 87 HD11 LEU 87 -0.791 2.104 2.038 747 HD12 LEU 87 HD12 LEU 87 -1.062 3.070 0.586 748 HD13 LEU 87 HD13 LEU 87 -2.251 1.863 1.077 749 HD21 LEU 87 HD21 LEU 87 -1.298 3.386 4.158 750 HD22 LEU 87 HD22 LEU 87 -1.804 5.044 3.820 751 HD23 LEU 87 HD23 LEU 87 -0.390 4.369 3.007 752 H ILE 88 HN ILE 88 -5.666 5.316 1.752 753 HA ILE 88 HA ILE 88 -6.563 2.887 2.856 754 HB ILE 88 HB ILE 88 -7.866 5.588 2.633 755 HG12 ILE 88 HG12 ILE 88 -6.827 4.098 5.049 756 HG13 ILE 88 HG11 ILE 88 -5.816 5.162 4.077 757 HG21 ILE 88 HG21 ILE 88 -9.727 4.138 2.748 758 HG22 ILE 88 HG22 ILE 88 -9.451 4.690 4.402 759 HG23 ILE 88 HG23 ILE 88 -8.928 3.078 3.911 760 HD11 ILE 88 HD11 ILE 88 -8.038 6.693 4.662 761 HD12 ILE 88 HD12 ILE 88 -6.448 6.793 5.423 762 HD13 ILE 88 HD13 ILE 88 -7.716 5.798 6.147 763 H ALA 89 HN ALA 89 -7.849 4.788 0.114 764 HA ALA 89 HA ALA 89 -10.018 3.060 -0.428 765 HB1 ALA 89 HB1 ALA 89 -9.212 5.482 -1.385 766 HB2 ALA 89 HB2 ALA 89 -10.516 4.509 -2.066 767 HB3 ALA 89 HB3 ALA 89 -8.896 4.426 -2.761 768 H LEU 90 HN LEU 90 -6.697 3.103 -1.635 769 HA LEU 90 HA LEU 90 -7.042 1.016 -3.534 770 HB2 LEU 90 HB2 LEU 90 -4.767 2.469 -2.330 771 HB3 LEU 90 HB1 LEU 90 -4.405 0.857 -2.909 772 HG LEU 90 HG LEU 90 -4.943 1.425 -5.146 773 HD11 LEU 90 HD11 LEU 90 -5.833 4.173 -4.324 774 HD12 LEU 90 HD12 LEU 90 -6.967 2.829 -4.476 775 HD13 LEU 90 HD13 LEU 90 -6.040 3.364 -5.880 776 HD21 LEU 90 HD21 LEU 90 -3.279 2.978 -5.625 777 HD22 LEU 90 HD22 LEU 90 -2.803 2.338 -4.050 778 HD23 LEU 90 HD23 LEU 90 -3.594 3.911 -4.163 779 H ARG 91 HN ARG 91 -6.215 1.078 -0.111 780 HA ARG 91 HA ARG 91 -5.397 -1.622 0.188 781 HB2 ARG 91 HB2 ARG 91 -5.003 0.152 1.871 782 HB3 ARG 91 HB1 ARG 91 -6.730 0.208 2.194 783 HG2 ARG 91 HG2 ARG 91 -6.666 -2.102 2.977 784 HG3 ARG 91 HG1 ARG 91 -4.936 -2.170 2.641 785 HD2 ARG 91 HD2 ARG 91 -4.559 -0.364 4.256 786 HD3 ARG 91 HD1 ARG 91 -6.287 -0.315 4.600 787 HE ARG 91 HE ARG 91 -4.375 -2.266 5.534 788 HH11 ARG 91 HH11 ARG 91 -7.742 -1.542 4.997 789 HH12 ARG 91 HH12 ARG 91 -8.312 -2.698 6.154 790 HH21 ARG 91 HH21 ARG 91 -5.110 -3.791 7.058 791 HH22 ARG 91 HH22 ARG 91 -6.811 -3.979 7.329 792 H LEU 92 HN LEU 92 -8.580 -0.067 0.563 793 HA LEU 92 HA LEU 92 -9.944 -2.418 1.327 794 HB2 LEU 92 HB2 LEU 92 -10.716 0.280 0.380 795 HB3 LEU 92 HB1 LEU 92 -11.915 -0.982 0.174 796 HG LEU 92 HG LEU 92 -11.742 -1.470 2.622 797 HD11 LEU 92 HD11 LEU 92 -10.790 0.567 3.925 798 HD12 LEU 92 HD12 LEU 92 -9.829 0.820 2.467 799 HD13 LEU 92 HD13 LEU 92 -9.698 -0.696 3.357 800 HD21 LEU 92 HD21 LEU 92 -13.551 -0.113 1.774 801 HD22 LEU 92 HD22 LEU 92 -12.533 1.326 1.821 802 HD23 LEU 92 HD23 LEU 92 -13.003 0.528 3.321 803 H LEU 93 HN LEU 93 -9.294 -0.994 -1.818 804 HA LEU 93 HA LEU 93 -10.947 -2.736 -3.330 805 HB2 LEU 93 HB2 LEU 93 -8.545 -1.089 -4.092 806 HB3 LEU 93 HB1 LEU 93 -9.452 -2.040 -5.251 807 HG LEU 93 HG LEU 93 -10.636 0.186 -3.592 808 HD11 LEU 93 HD11 LEU 93 -9.342 1.436 -4.969 809 HD12 LEU 93 HD12 LEU 93 -10.675 1.139 -6.084 810 HD13 LEU 93 HD13 LEU 93 -9.210 0.163 -6.183 811 HD21 LEU 93 HD21 LEU 93 -11.856 -1.901 -4.979 812 HD22 LEU 93 HD22 LEU 93 -11.970 -0.511 -6.059 813 HD23 LEU 93 HD23 LEU 93 -12.616 -0.409 -4.421 814 H ALA 94 HN ALA 94 -7.582 -2.843 -2.318 815 HA ALA 94 HA ALA 94 -6.852 -5.132 -3.858 816 HB1 ALA 94 HB1 ALA 94 -5.409 -3.272 -2.569 817 HB2 ALA 94 HB2 ALA 94 -4.777 -4.863 -2.995 818 HB3 ALA 94 HB3 ALA 94 -5.376 -4.561 -1.364 819 H GLU 95 HN GLU 95 -8.121 -4.526 -0.667 820 HA GLU 95 HA GLU 95 -7.799 -7.056 0.446 821 HB2 GLU 95 HB2 GLU 95 -8.308 -5.027 1.715 822 HB3 GLU 95 HB1 GLU 95 -9.863 -4.893 0.908 823 HG2 GLU 95 HG2 GLU 95 -10.615 -6.905 1.939 824 HG3 GLU 95 HG1 GLU 95 -9.038 -7.156 2.677 825 H GLU 96 HN GLU 96 -10.387 -5.603 -1.469 826 HA GLU 96 HA GLU 96 -12.238 -7.719 -1.323 827 HB2 GLU 96 HB2 GLU 96 -11.760 -5.595 -3.428 828 HB3 GLU 96 HB1 GLU 96 -13.118 -6.716 -3.480 829 HG2 GLU 96 HG2 GLU 96 -12.559 -4.713 -1.302 830 HG3 GLU 96 HG1 GLU 96 -13.785 -4.570 -2.561 831 H ILE 97 HN ILE 97 -9.590 -7.021 -3.518 832 HA ILE 97 HA ILE 97 -10.037 -9.102 -5.374 833 HB ILE 97 HB ILE 97 -7.511 -7.610 -4.645 834 HG12 ILE 97 HG12 ILE 97 -9.371 -7.241 -6.993 835 HG13 ILE 97 HG11 ILE 97 -9.528 -6.342 -5.486 836 HG21 ILE 97 HG21 ILE 97 -6.640 -8.343 -6.820 837 HG22 ILE 97 HG22 ILE 97 -8.088 -9.321 -7.070 838 HG23 ILE 97 HG23 ILE 97 -6.970 -9.722 -5.768 839 HD11 ILE 97 HD11 ILE 97 -6.875 -6.296 -6.726 840 HD12 ILE 97 HD12 ILE 97 -7.802 -5.016 -5.939 841 HD13 ILE 97 HD13 ILE 97 -8.165 -5.472 -7.603 842 H GLY 98 HN GLY 98 -7.938 -8.853 -2.517 843 HA2 GLY 98 HA2 GLY 98 -6.757 -11.404 -2.704 844 HA3 GLY 98 HA1 GLY 98 -6.891 -10.449 -1.236 845 H ASP 99 HN ASP 99 -9.756 -10.334 -1.222 846 HA ASP 99 HA ASP 99 -10.354 -12.659 0.241 847 HB2 ASP 99 HB2 ASP 99 -11.513 -10.479 0.524 848 HB3 ASP 99 HB1 ASP 99 -12.306 -10.725 -1.028 849 H TYR 100 HN TYR 100 -11.029 -11.787 -3.117 850 HA TYR 100 HA TYR 100 -12.584 -14.167 -3.585 851 HB2 TYR 100 HB2 TYR 100 -13.110 -12.096 -4.796 852 HB3 TYR 100 HB1 TYR 100 -11.504 -12.097 -5.516 853 HD1 TYR 100 HD1 TYR 100 -14.691 -14.003 -5.369 854 HD2 TYR 100 HD2 TYR 100 -11.083 -13.280 -7.508 855 HE1 TYR 100 HE1 TYR 100 -15.541 -15.341 -7.248 856 HE2 TYR 100 HE2 TYR 100 -11.927 -14.615 -9.392 857 HH TYR 100 HH TYR 100 -14.335 -16.725 -9.217 858 H LYS 101 HN LYS 101 -11.670 -16.067 -3.806 859 HA LYS 101 HA LYS 101 -8.992 -16.235 -5.007 860 HB2 LYS 101 HB2 LYS 101 -10.371 -18.114 -3.085 861 HB3 LYS 101 HB1 LYS 101 -8.816 -18.436 -3.839 862 HG2 LYS 101 HG2 LYS 101 -7.839 -16.526 -2.723 863 HG3 LYS 101 HG1 LYS 101 -9.407 -16.091 -2.039 864 HD2 LYS 101 HD2 LYS 101 -8.161 -17.213 -0.340 865 HD3 LYS 101 HD1 LYS 101 -9.426 -18.315 -0.887 866 HE2 LYS 101 HE2 LYS 101 -7.816 -19.488 -2.291 867 HE3 LYS 101 HE1 LYS 101 -6.549 -18.367 -1.798 868 HZ1 LYS 101 HZ1 LYS 101 -7.733 -20.590 -0.338 869 HZ2 LYS 101 HZ2 LYS 101 -7.352 -19.216 0.572 870 HZ3 LYS 101 HZ3 LYS 101 -6.147 -20.001 -0.317 871 H ASP 102 HN ASP 102 -8.602 -17.657 -6.664 872 HA ASP 102 HA ASP 102 -10.903 -18.433 -8.219 873 HB2 ASP 102 HB2 ASP 102 -8.827 -17.444 -9.227 874 HB3 ASP 102 HB1 ASP 102 -7.984 -18.937 -8.824 875 H ASP 103 HN ASP 103 -11.899 -20.305 -8.055 876 HA ASP 103 HA ASP 103 -12.392 -22.483 -7.655 877 HB2 ASP 103 HB2 ASP 103 -10.525 -22.690 -9.412 878 HB3 ASP 103 HB1 ASP 103 -9.488 -23.154 -8.066 879 H ASP 104 HN ASP 104 -12.227 -21.169 -5.365 880 HA ASP 104 HA ASP 104 -10.465 -22.649 -3.555 881 HB2 ASP 104 HB2 ASP 104 -10.843 -20.085 -3.491 882 HB3 ASP 104 HB1 ASP 104 -12.367 -20.480 -2.706 883 H ASP 105 HN ASP 105 -13.129 -23.526 -4.923 884 HA ASP 105 HA ASP 105 -14.739 -24.168 -2.582 885 HB2 ASP 105 HB2 ASP 105 -15.829 -23.459 -4.707 886 HB3 ASP 105 HB1 ASP 105 -15.198 -24.909 -5.481 887 H LYS 106 HN LYS 106 -13.847 -25.739 -1.388 888 HA LYS 106 HA LYS 106 -13.053 -27.760 -0.730 889 HB2 LYS 106 HB2 LYS 106 -14.545 -28.620 -3.211 890 HB3 LYS 106 HB1 LYS 106 -13.838 -29.750 -2.064 891 HG2 LYS 106 HG2 LYS 106 -15.268 -28.852 -0.294 892 HG3 LYS 106 HG1 LYS 106 -15.977 -27.717 -1.446 893 HD2 LYS 106 HD2 LYS 106 -16.808 -29.592 -2.782 894 HD3 LYS 106 HD1 LYS 106 -16.094 -30.728 -1.635 895 HE2 LYS 106 HE2 LYS 106 -17.531 -29.843 0.136 896 HE3 LYS 106 HE1 LYS 106 -18.238 -28.700 -1.006 897 HZ1 LYS 106 HZ1 LYS 106 -19.090 -30.556 -2.289 898 HZ2 LYS 106 HZ2 LYS 106 -19.642 -30.644 -0.695 899 HZ3 LYS 106 HZ3 LYS 106 -18.394 -31.660 -1.212 Start of MODEL 18 1 H1 MET 1 HT1 MET 1 5.920 -8.034 -20.225 2 H2 MET 1 HT2 MET 1 5.137 -9.338 -20.961 3 H3 MET 1 HT3 MET 1 4.759 -8.916 -19.366 4 HA MET 1 HA MET 1 3.952 -6.742 -20.171 5 HB2 MET 1 HB2 MET 1 4.251 -8.098 -22.862 6 HB3 MET 1 HB1 MET 1 3.452 -6.558 -22.582 7 HG2 MET 1 HG2 MET 1 5.548 -5.580 -21.843 8 HG3 MET 1 HG1 MET 1 6.360 -7.129 -22.055 9 HE1 MET 1 HE1 MET 1 7.863 -4.998 -24.964 10 HE2 MET 1 HE2 MET 1 8.247 -6.191 -23.724 11 HE3 MET 1 HE3 MET 1 7.577 -4.626 -23.264 12 H ALA 2 HN ALA 2 3.433 -10.002 -20.144 13 HA ALA 2 HA ALA 2 0.671 -9.993 -20.995 14 HB1 ALA 2 HB1 ALA 2 2.053 -12.210 -19.510 15 HB2 ALA 2 HB2 ALA 2 2.276 -11.949 -21.240 16 HB3 ALA 2 HB3 ALA 2 0.673 -12.316 -20.603 17 HA PRO 3 HA PRO 3 -0.730 -8.675 -16.959 18 HB2 PRO 3 HB2 PRO 3 -3.369 -8.698 -17.482 19 HB3 PRO 3 HB1 PRO 3 -2.293 -7.431 -18.088 20 HG2 PRO 3 HG2 PRO 3 -3.307 -9.874 -19.483 21 HG3 PRO 3 HG1 PRO 3 -3.229 -8.206 -20.077 22 HD2 PRO 3 HD2 PRO 3 -1.387 -10.064 -20.749 23 HD3 PRO 3 HD1 PRO 3 -0.967 -8.348 -20.543 24 H LEU 4 HN LEU 4 -1.723 -9.565 -15.149 25 HA LEU 4 HA LEU 4 -2.380 -12.425 -15.387 26 HB2 LEU 4 HB2 LEU 4 -1.250 -10.972 -12.990 27 HB3 LEU 4 HB1 LEU 4 -1.572 -12.693 -13.100 28 HG LEU 4 HG LEU 4 0.499 -11.179 -14.694 29 HD11 LEU 4 HD11 LEU 4 1.046 -11.461 -12.311 30 HD12 LEU 4 HD12 LEU 4 2.124 -12.370 -13.369 31 HD13 LEU 4 HD13 LEU 4 0.842 -13.203 -12.490 32 HD21 LEU 4 HD21 LEU 4 -0.465 -14.007 -14.789 33 HD22 LEU 4 HD22 LEU 4 1.210 -13.621 -15.185 34 HD23 LEU 4 HD23 LEU 4 -0.106 -12.898 -16.112 35 H ARG 5 HN ARG 5 -4.086 -13.238 -14.099 36 HA ARG 5 HA ARG 5 -6.338 -11.573 -13.882 37 HB2 ARG 5 HB2 ARG 5 -5.710 -14.341 -12.905 38 HB3 ARG 5 HB1 ARG 5 -7.212 -13.561 -12.436 39 HG2 ARG 5 HG2 ARG 5 -7.688 -14.917 -14.315 40 HG3 ARG 5 HG1 ARG 5 -7.706 -13.244 -14.873 41 HD2 ARG 5 HD2 ARG 5 -5.412 -13.525 -15.723 42 HD3 ARG 5 HD1 ARG 5 -5.437 -15.207 -15.199 43 HE ARG 5 HE ARG 5 -6.775 -15.732 -16.999 44 HH11 ARG 5 HH11 ARG 5 -6.475 -12.271 -16.718 45 HH12 ARG 5 HH12 ARG 5 -7.197 -11.951 -18.259 46 HH21 ARG 5 HH21 ARG 5 -7.725 -15.326 -19.027 47 HH22 ARG 5 HH22 ARG 5 -7.910 -13.693 -19.575 48 H LYS 6 HN LYS 6 -4.000 -12.657 -11.480 49 HA LYS 6 HA LYS 6 -5.335 -11.729 -9.190 50 HB2 LYS 6 HB2 LYS 6 -2.401 -12.175 -9.716 51 HB3 LYS 6 HB1 LYS 6 -3.052 -11.771 -8.134 52 HG2 LYS 6 HG2 LYS 6 -3.840 -14.203 -9.729 53 HG3 LYS 6 HG1 LYS 6 -2.623 -14.188 -8.452 54 HD2 LYS 6 HD2 LYS 6 -4.385 -13.343 -6.891 55 HD3 LYS 6 HD1 LYS 6 -5.567 -13.589 -8.177 56 HE2 LYS 6 HE2 LYS 6 -3.806 -15.728 -6.983 57 HE3 LYS 6 HE1 LYS 6 -5.506 -15.470 -6.595 58 HZ1 LYS 6 HZ1 LYS 6 -5.421 -17.197 -8.182 59 HZ2 LYS 6 HZ2 LYS 6 -4.355 -16.340 -9.181 60 HZ3 LYS 6 HZ3 LYS 6 -5.960 -15.825 -9.021 61 H THR 7 HN THR 7 -3.126 -10.121 -11.384 62 HA THR 7 HA THR 7 -2.910 -7.767 -9.758 63 HB THR 7 HB THR 7 -2.051 -6.808 -12.060 64 HG1 THR 7 HG1 THR 7 -2.840 -8.880 -13.080 65 HG21 THR 7 HG21 THR 7 -0.808 -8.410 -9.966 66 HG22 THR 7 HG22 THR 7 -0.268 -6.907 -10.714 67 HG23 THR 7 HG23 THR 7 0.080 -8.454 -11.489 68 H ALA 8 HN ALA 8 -4.264 -6.168 -9.613 69 HA ALA 8 HA ALA 8 -6.520 -5.985 -11.451 70 HB1 ALA 8 HB1 ALA 8 -6.035 -4.372 -8.955 71 HB2 ALA 8 HB2 ALA 8 -6.823 -5.951 -8.961 72 HB3 ALA 8 HB3 ALA 8 -7.556 -4.595 -9.822 73 H VAL 9 HN VAL 9 -7.143 -3.960 -12.409 74 HA VAL 9 HA VAL 9 -4.791 -2.286 -12.991 75 HB VAL 9 HB VAL 9 -7.136 -2.874 -14.792 76 HG11 VAL 9 HG11 VAL 9 -4.766 -1.041 -15.102 77 HG12 VAL 9 HG12 VAL 9 -6.477 -0.674 -15.320 78 HG13 VAL 9 HG13 VAL 9 -5.636 -1.686 -16.496 79 HG21 VAL 9 HG21 VAL 9 -4.363 -3.541 -15.564 80 HG22 VAL 9 HG22 VAL 9 -5.867 -4.409 -15.872 81 HG23 VAL 9 HG23 VAL 9 -5.085 -4.530 -14.296 82 H LEU 10 HN LEU 10 -4.922 -0.213 -12.496 83 HA LEU 10 HA LEU 10 -7.562 0.985 -11.910 84 HB2 LEU 10 HB2 LEU 10 -4.902 1.291 -10.611 85 HB3 LEU 10 HB1 LEU 10 -5.914 2.712 -10.721 86 HG LEU 10 HG LEU 10 -6.796 0.142 -9.405 87 HD11 LEU 10 HD11 LEU 10 -6.450 1.696 -7.329 88 HD12 LEU 10 HD12 LEU 10 -5.268 2.483 -8.374 89 HD13 LEU 10 HD13 LEU 10 -5.105 0.769 -7.991 90 HD21 LEU 10 HD21 LEU 10 -8.585 1.426 -8.503 91 HD22 LEU 10 HD22 LEU 10 -8.543 1.774 -10.231 92 HD23 LEU 10 HD23 LEU 10 -7.882 2.936 -9.082 93 H LYS 11 HN LYS 11 -8.099 2.835 -13.056 94 HA LYS 11 HA LYS 11 -5.993 3.801 -14.873 95 HB2 LYS 11 HB2 LYS 11 -8.967 3.588 -15.355 96 HB3 LYS 11 HB1 LYS 11 -7.900 4.557 -16.362 97 HG2 LYS 11 HG2 LYS 11 -6.617 2.545 -16.926 98 HG3 LYS 11 HG1 LYS 11 -7.723 1.580 -15.945 99 HD2 LYS 11 HD2 LYS 11 -9.583 2.229 -17.384 100 HD3 LYS 11 HD1 LYS 11 -8.499 3.235 -18.347 101 HE2 LYS 11 HE2 LYS 11 -7.215 1.251 -18.976 102 HE3 LYS 11 HE1 LYS 11 -8.293 0.246 -18.009 103 HZ1 LYS 11 HZ1 LYS 11 -8.680 1.354 -20.641 104 HZ2 LYS 11 HZ2 LYS 11 -10.010 1.559 -19.616 105 HZ3 LYS 11 HZ3 LYS 11 -9.405 0.008 -19.916 106 H LEU 12 HN LEU 12 -5.424 5.823 -14.678 107 HA LEU 12 HA LEU 12 -7.053 7.551 -12.956 108 HB2 LEU 12 HB2 LEU 12 -4.288 6.998 -13.024 109 HB3 LEU 12 HB1 LEU 12 -4.465 8.646 -13.593 110 HG LEU 12 HG LEU 12 -5.488 7.578 -10.959 111 HD11 LEU 12 HD11 LEU 12 -3.751 9.215 -10.088 112 HD12 LEU 12 HD12 LEU 12 -3.087 9.215 -11.722 113 HD13 LEU 12 HD13 LEU 12 -3.147 7.717 -10.792 114 HD21 LEU 12 HD21 LEU 12 -6.960 9.298 -11.528 115 HD22 LEU 12 HD22 LEU 12 -5.692 10.257 -12.291 116 HD23 LEU 12 HD23 LEU 12 -5.739 10.096 -10.536 117 H TYR 13 HN TYR 13 -8.175 9.194 -14.010 118 HA TYR 13 HA TYR 13 -7.363 9.803 -16.761 119 HB2 TYR 13 HB2 TYR 13 -9.894 10.446 -15.227 120 HB3 TYR 13 HB1 TYR 13 -9.598 10.833 -16.918 121 HD1 TYR 13 HD1 TYR 13 -10.458 8.204 -14.544 122 HD2 TYR 13 HD2 TYR 13 -9.513 9.042 -18.607 123 HE1 TYR 13 HE1 TYR 13 -11.327 5.998 -15.194 124 HE2 TYR 13 HE2 TYR 13 -10.381 6.836 -19.268 125 HH TYR 13 HH TYR 13 -11.516 5.017 -18.591 126 H VAL 14 HN VAL 14 -6.119 11.563 -17.003 127 HA VAL 14 HA VAL 14 -6.441 13.779 -15.083 128 HB VAL 14 HB VAL 14 -4.027 14.227 -15.281 129 HG11 VAL 14 HG11 VAL 14 -4.634 13.133 -13.303 130 HG12 VAL 14 HG12 VAL 14 -3.312 12.154 -13.943 131 HG13 VAL 14 HG13 VAL 14 -4.981 11.618 -14.143 132 HG21 VAL 14 HG21 VAL 14 -4.102 11.716 -16.915 133 HG22 VAL 14 HG22 VAL 14 -2.644 12.188 -16.043 134 HG23 VAL 14 HG23 VAL 14 -3.320 13.254 -17.275 135 H ALA 15 HN ALA 15 -5.677 15.853 -15.893 136 HA ALA 15 HA ALA 15 -6.019 16.069 -18.808 137 HB1 ALA 15 HB1 ALA 15 -6.659 18.513 -17.397 138 HB2 ALA 15 HB2 ALA 15 -7.667 17.175 -16.846 139 HB3 ALA 15 HB3 ALA 15 -7.627 17.604 -18.557 140 H GLY 16 HN GLY 16 -4.015 16.325 -19.557 141 HA2 GLY 16 HA2 GLY 16 -1.966 17.276 -19.940 142 HA3 GLY 16 HA1 GLY 16 -2.597 18.715 -19.151 143 H ASN 17 HN ASN 17 -1.172 19.344 -17.666 144 HA ASN 17 HA ASN 17 -0.290 17.353 -15.704 145 HB2 ASN 17 HB2 ASN 17 1.407 18.664 -17.619 146 HB3 ASN 17 HB1 ASN 17 1.837 19.203 -15.998 147 HD21 ASN 17 HD21 ASN 17 0.601 16.072 -17.092 148 HD22 ASN 17 HD22 ASN 17 1.970 15.158 -16.562 149 H THR 18 HN THR 18 -2.358 18.856 -15.125 150 HA THR 18 HA THR 18 -1.672 21.367 -13.927 151 HB THR 18 HB THR 18 -3.929 21.313 -12.959 152 HG1 THR 18 HG1 THR 18 -5.264 19.452 -13.495 153 HG21 THR 18 HG21 THR 18 -3.412 21.777 -15.477 154 HG22 THR 18 HG22 THR 18 -5.083 21.630 -14.932 155 HG23 THR 18 HG23 THR 18 -4.295 20.272 -15.736 156 HA PRO 19 HA PRO 19 -0.101 20.183 -10.003 157 HB2 PRO 19 HB2 PRO 19 -2.270 21.847 -8.775 158 HB3 PRO 19 HB1 PRO 19 -0.527 21.873 -8.473 159 HG2 PRO 19 HG2 PRO 19 -1.607 23.769 -9.956 160 HG3 PRO 19 HG1 PRO 19 -0.075 23.028 -10.459 161 HD2 PRO 19 HD2 PRO 19 -2.843 22.544 -11.500 162 HD3 PRO 19 HD1 PRO 19 -1.313 22.689 -12.390 163 H ASN 20 HN ASN 20 -3.636 20.095 -10.256 164 HA ASN 20 HA ASN 20 -4.044 18.322 -8.077 165 HB2 ASN 20 HB2 ASN 20 -5.786 18.739 -10.535 166 HB3 ASN 20 HB1 ASN 20 -6.260 17.855 -9.092 167 HD21 ASN 20 HD21 ASN 20 -5.852 19.181 -7.009 168 HD22 ASN 20 HD22 ASN 20 -6.441 20.804 -7.057 169 H SER 21 HN SER 21 -3.737 17.794 -11.586 170 HA SER 21 HA SER 21 -3.914 14.954 -11.547 171 HB2 SER 21 HB2 SER 21 -2.625 16.835 -13.540 172 HB3 SER 21 HB1 SER 21 -2.921 15.118 -13.815 173 HG SER 21 HG SER 21 -4.683 17.254 -13.830 174 H VAL 22 HN VAL 22 -1.129 17.150 -11.470 175 HA VAL 22 HA VAL 22 0.793 15.075 -11.543 176 HB VAL 22 HB VAL 22 0.962 17.921 -10.520 177 HG11 VAL 22 HG11 VAL 22 3.027 15.768 -10.531 178 HG12 VAL 22 HG12 VAL 22 2.683 17.001 -9.314 179 HG13 VAL 22 HG13 VAL 22 3.509 17.442 -10.811 180 HG21 VAL 22 HG21 VAL 22 2.402 18.157 -12.585 181 HG22 VAL 22 HG22 VAL 22 0.680 17.895 -12.861 182 HG23 VAL 22 HG23 VAL 22 1.817 16.563 -13.062 183 H ARG 23 HN ARG 23 -0.740 16.806 -8.881 184 HA ARG 23 HA ARG 23 0.690 15.660 -6.752 185 HB2 ARG 23 HB2 ARG 23 -1.086 17.605 -6.919 186 HB3 ARG 23 HB1 ARG 23 -2.214 16.310 -6.524 187 HG2 ARG 23 HG2 ARG 23 -1.790 16.876 -4.410 188 HG3 ARG 23 HG1 ARG 23 -0.297 15.957 -4.627 189 HD2 ARG 23 HD2 ARG 23 0.882 17.985 -5.254 190 HD3 ARG 23 HD1 ARG 23 -0.612 18.915 -5.125 191 HE ARG 23 HE ARG 23 1.017 17.897 -2.933 192 HH11 ARG 23 HH11 ARG 23 -1.918 19.472 -3.959 193 HH12 ARG 23 HH12 ARG 23 -2.272 20.121 -2.393 194 HH21 ARG 23 HH21 ARG 23 0.563 18.743 -0.868 195 HH22 ARG 23 HH22 ARG 23 -0.857 19.706 -0.632 196 H ALA 24 HN ALA 24 -2.395 14.785 -8.258 197 HA ALA 24 HA ALA 24 -2.959 12.580 -6.607 198 HB1 ALA 24 HB1 ALA 24 -4.378 13.893 -8.445 199 HB2 ALA 24 HB2 ALA 24 -4.800 12.273 -7.889 200 HB3 ALA 24 HB3 ALA 24 -3.918 12.484 -9.402 201 H LEU 25 HN LEU 25 -1.317 12.835 -9.719 202 HA LEU 25 HA LEU 25 -0.933 10.101 -10.221 203 HB2 LEU 25 HB2 LEU 25 -0.633 11.810 -11.929 204 HB3 LEU 25 HB1 LEU 25 0.723 12.485 -11.050 205 HG LEU 25 HG LEU 25 2.003 10.421 -11.454 206 HD11 LEU 25 HD11 LEU 25 0.458 8.697 -11.665 207 HD12 LEU 25 HD12 LEU 25 1.019 8.935 -13.321 208 HD13 LEU 25 HD13 LEU 25 -0.537 9.596 -12.812 209 HD21 LEU 25 HD21 LEU 25 2.226 12.299 -12.980 210 HD22 LEU 25 HD22 LEU 25 0.868 11.702 -13.934 211 HD23 LEU 25 HD23 LEU 25 2.363 10.771 -13.850 212 H LYS 26 HN LYS 26 1.212 12.438 -8.583 213 HA LYS 26 HA LYS 26 3.295 10.591 -8.091 214 HB2 LYS 26 HB2 LYS 26 2.520 13.146 -6.684 215 HB3 LYS 26 HB1 LYS 26 3.950 12.216 -6.263 216 HG2 LYS 26 HG2 LYS 26 4.713 12.481 -8.634 217 HG3 LYS 26 HG1 LYS 26 3.365 13.598 -8.868 218 HD2 LYS 26 HD2 LYS 26 5.491 13.933 -6.755 219 HD3 LYS 26 HD1 LYS 26 5.548 14.702 -8.342 220 HE2 LYS 26 HE2 LYS 26 3.397 15.805 -7.850 221 HE3 LYS 26 HE1 LYS 26 3.413 15.080 -6.245 222 HZ1 LYS 26 HZ1 LYS 26 5.552 16.251 -5.860 223 HZ2 LYS 26 HZ2 LYS 26 4.234 17.290 -6.071 224 HZ3 LYS 26 HZ3 LYS 26 5.340 17.058 -7.332 225 H THR 27 HN THR 27 0.439 11.518 -6.230 226 HA THR 27 HA THR 27 1.058 10.136 -3.850 227 HB THR 27 HB THR 27 -1.617 10.945 -5.001 228 HG1 THR 27 HG1 THR 27 -0.451 12.781 -4.658 229 HG21 THR 27 HG21 THR 27 -2.364 9.625 -3.317 230 HG22 THR 27 HG22 THR 27 -1.965 11.041 -2.343 231 HG23 THR 27 HG23 THR 27 -0.833 9.690 -2.442 232 H LEU 28 HN LEU 28 -0.883 9.198 -6.696 233 HA LEU 28 HA LEU 28 -1.609 6.683 -5.569 234 HB2 LEU 28 HB2 LEU 28 -2.293 8.192 -7.875 235 HB3 LEU 28 HB1 LEU 28 -1.825 6.584 -8.399 236 HG LEU 28 HG LEU 28 -3.674 6.674 -6.104 237 HD11 LEU 28 HD11 LEU 28 -4.553 7.505 -8.856 238 HD12 LEU 28 HD12 LEU 28 -4.595 8.492 -7.395 239 HD13 LEU 28 HD13 LEU 28 -5.630 7.069 -7.530 240 HD21 LEU 28 HD21 LEU 28 -3.344 5.047 -8.595 241 HD22 LEU 28 HD22 LEU 28 -4.765 4.901 -7.562 242 HD23 LEU 28 HD23 LEU 28 -3.162 4.547 -6.912 243 H ALA 29 HN ALA 29 0.807 7.648 -8.025 244 HA ALA 29 HA ALA 29 1.615 5.058 -8.720 245 HB1 ALA 29 HB1 ALA 29 2.574 6.349 -10.250 246 HB2 ALA 29 HB2 ALA 29 3.861 6.618 -9.074 247 HB3 ALA 29 HB3 ALA 29 2.528 7.765 -9.201 248 H ASN 30 HN ASN 30 2.864 7.242 -6.192 249 HA ASN 30 HA ASN 30 5.079 5.587 -5.481 250 HB2 ASN 30 HB2 ASN 30 4.776 8.037 -4.873 251 HB3 ASN 30 HB1 ASN 30 3.625 7.507 -3.651 252 HD21 ASN 30 HD21 ASN 30 4.706 8.004 -1.834 253 HD22 ASN 30 HD22 ASN 30 6.243 7.346 -1.398 254 H ILE 31 HN ILE 31 1.780 5.815 -4.242 255 HA ILE 31 HA ILE 31 2.132 3.971 -2.169 256 HB ILE 31 HB ILE 31 -0.302 4.937 -3.603 257 HG12 ILE 31 HG12 ILE 31 0.596 5.175 -0.735 258 HG13 ILE 31 HG11 ILE 31 0.997 6.344 -1.993 259 HG21 ILE 31 HG21 ILE 31 -1.512 3.196 -2.963 260 HG22 ILE 31 HG22 ILE 31 -1.180 3.644 -1.288 261 HG23 ILE 31 HG23 ILE 31 -0.138 2.486 -2.114 262 HD11 ILE 31 HD11 ILE 31 -1.835 5.626 -1.391 263 HD12 ILE 31 HD12 ILE 31 -1.193 7.066 -2.183 264 HD13 ILE 31 HD13 ILE 31 -0.969 6.840 -0.449 265 H LEU 32 HN LEU 32 0.988 3.542 -5.489 266 HA LEU 32 HA LEU 32 0.570 0.755 -5.278 267 HB2 LEU 32 HB2 LEU 32 0.964 2.577 -7.636 268 HB3 LEU 32 HB1 LEU 32 0.626 0.863 -7.802 269 HG LEU 32 HG LEU 32 -1.188 2.785 -6.325 270 HD11 LEU 32 HD11 LEU 32 -1.013 3.341 -8.732 271 HD12 LEU 32 HD12 LEU 32 -2.610 2.746 -8.278 272 HD13 LEU 32 HD13 LEU 32 -1.481 1.685 -9.123 273 HD21 LEU 32 HD21 LEU 32 -2.012 0.872 -5.559 274 HD22 LEU 32 HD22 LEU 32 -1.097 -0.094 -6.715 275 HD23 LEU 32 HD23 LEU 32 -2.636 0.626 -7.190 276 H GLU 33 HN GLU 33 3.392 2.652 -6.219 277 HA GLU 33 HA GLU 33 4.910 0.467 -7.204 278 HB2 GLU 33 HB2 GLU 33 5.736 3.203 -6.255 279 HB3 GLU 33 HB1 GLU 33 6.875 2.025 -6.892 280 HG2 GLU 33 HG2 GLU 33 5.669 1.995 -9.012 281 HG3 GLU 33 HG1 GLU 33 4.509 3.156 -8.363 282 H LYS 34 HN LYS 34 4.657 1.886 -3.958 283 HA LYS 34 HA LYS 34 6.695 -0.042 -3.071 284 HB2 LYS 34 HB2 LYS 34 7.046 2.402 -2.608 285 HB3 LYS 34 HB1 LYS 34 5.651 2.340 -1.542 286 HG2 LYS 34 HG2 LYS 34 7.666 2.183 -0.243 287 HG3 LYS 34 HG1 LYS 34 6.802 0.644 -0.174 288 HD2 LYS 34 HD2 LYS 34 8.332 -0.405 -1.616 289 HD3 LYS 34 HD1 LYS 34 8.990 1.135 -2.174 290 HE2 LYS 34 HE2 LYS 34 10.549 0.040 -0.670 291 HE3 LYS 34 HE1 LYS 34 9.936 1.529 0.049 292 HZ1 LYS 34 HZ1 LYS 34 8.457 -0.891 0.682 293 HZ2 LYS 34 HZ2 LYS 34 8.879 0.413 1.674 294 HZ3 LYS 34 HZ3 LYS 34 10.015 -0.792 1.335 295 H GLU 35 HN GLU 35 3.659 1.373 -1.851 296 HA GLU 35 HA GLU 35 3.268 -0.519 0.191 297 HB2 GLU 35 HB2 GLU 35 1.443 1.417 -1.210 298 HB3 GLU 35 HB1 GLU 35 0.819 0.310 0.005 299 HG2 GLU 35 HG2 GLU 35 1.255 2.422 1.037 300 HG3 GLU 35 HG1 GLU 35 2.434 1.258 1.635 301 H PHE 36 HN PHE 36 2.073 -0.461 -3.156 302 HA PHE 36 HA PHE 36 1.091 -3.191 -2.686 303 HB2 PHE 36 HB2 PHE 36 -0.159 -1.065 -4.421 304 HB3 PHE 36 HB1 PHE 36 -0.685 -2.746 -4.369 305 HD1 PHE 36 HD1 PHE 36 -0.610 0.435 -2.598 306 HD2 PHE 36 HD2 PHE 36 -1.792 -3.647 -2.397 307 HE1 PHE 36 HE1 PHE 36 -2.023 0.944 -0.651 308 HE2 PHE 36 HE2 PHE 36 -3.211 -3.143 -0.452 309 HZ PHE 36 HZ PHE 36 -3.325 -0.843 0.425 310 H LYS 37 HN LYS 37 3.701 -2.400 -3.681 311 HA LYS 37 HA LYS 37 4.107 -2.576 -6.385 312 HB2 LYS 37 HB2 LYS 37 5.904 -2.247 -4.734 313 HB3 LYS 37 HB1 LYS 37 5.746 -3.924 -4.228 314 HG2 LYS 37 HG2 LYS 37 6.356 -4.598 -6.561 315 HG3 LYS 37 HG1 LYS 37 6.701 -2.899 -6.893 316 HD2 LYS 37 HD2 LYS 37 8.004 -4.464 -4.668 317 HD3 LYS 37 HD1 LYS 37 8.696 -4.305 -6.283 318 HE2 LYS 37 HE2 LYS 37 8.700 -1.853 -6.007 319 HE3 LYS 37 HE1 LYS 37 8.077 -2.055 -4.371 320 HZ1 LYS 37 HZ1 LYS 37 10.099 -3.389 -3.889 321 HZ2 LYS 37 HZ2 LYS 37 10.417 -1.766 -4.242 322 HZ3 LYS 37 HZ3 LYS 37 10.706 -2.955 -5.408 323 H GLY 38 HN GLY 38 3.628 -4.013 -7.899 324 HA2 GLY 38 HA2 GLY 38 3.532 -6.074 -8.959 325 HA3 GLY 38 HA1 GLY 38 3.943 -6.844 -7.439 326 H VAL 39 HN VAL 39 1.352 -4.852 -6.779 327 HA VAL 39 HA VAL 39 -0.450 -7.133 -7.198 328 HB VAL 39 HB VAL 39 -0.770 -4.881 -5.197 329 HG11 VAL 39 HG11 VAL 39 -2.895 -5.901 -6.013 330 HG12 VAL 39 HG12 VAL 39 -2.612 -6.118 -4.286 331 HG13 VAL 39 HG13 VAL 39 -2.329 -7.455 -5.401 332 HG21 VAL 39 HG21 VAL 39 -0.079 -7.758 -4.632 333 HG22 VAL 39 HG22 VAL 39 -0.097 -6.406 -3.500 334 HG23 VAL 39 HG23 VAL 39 1.126 -6.477 -4.769 335 H TYR 40 HN TYR 40 -0.330 -3.576 -7.477 336 HA TYR 40 HA TYR 40 -2.680 -3.849 -9.204 337 HB2 TYR 40 HB2 TYR 40 -2.021 -1.867 -7.129 338 HB3 TYR 40 HB1 TYR 40 -2.612 -1.157 -8.620 339 HD1 TYR 40 HD1 TYR 40 -3.474 -3.193 -5.704 340 HD2 TYR 40 HD2 TYR 40 -4.892 -1.489 -9.333 341 HE1 TYR 40 HE1 TYR 40 -5.790 -3.554 -4.965 342 HE2 TYR 40 HE2 TYR 40 -7.211 -1.852 -8.607 343 HH TYR 40 HH TYR 40 -8.024 -3.805 -5.965 344 H ALA 41 HN ALA 41 -2.747 -2.813 -11.165 345 HA ALA 41 HA ALA 41 -0.190 -1.716 -12.128 346 HB1 ALA 41 HB1 ALA 41 -1.301 -3.759 -13.229 347 HB2 ALA 41 HB2 ALA 41 -0.749 -2.453 -14.281 348 HB3 ALA 41 HB3 ALA 41 -2.460 -2.602 -13.884 349 H LEU 42 HN LEU 42 -0.110 0.444 -12.549 350 HA LEU 42 HA LEU 42 -2.635 1.922 -12.474 351 HB2 LEU 42 HB2 LEU 42 -0.889 2.623 -10.911 352 HB3 LEU 42 HB1 LEU 42 0.213 2.897 -12.244 353 HG LEU 42 HG LEU 42 -1.268 4.704 -13.071 354 HD11 LEU 42 HD11 LEU 42 -3.035 3.615 -11.057 355 HD12 LEU 42 HD12 LEU 42 -3.382 4.722 -12.383 356 HD13 LEU 42 HD13 LEU 42 -2.794 5.348 -10.843 357 HD21 LEU 42 HD21 LEU 42 0.518 4.765 -10.965 358 HD22 LEU 42 HD22 LEU 42 -0.882 5.649 -10.355 359 HD23 LEU 42 HD23 LEU 42 -0.101 6.156 -11.855 360 H LYS 43 HN LYS 43 -3.527 2.735 -14.215 361 HA LYS 43 HA LYS 43 -1.861 3.199 -16.603 362 HB2 LYS 43 HB2 LYS 43 -4.273 1.600 -16.259 363 HB3 LYS 43 HB1 LYS 43 -4.492 2.845 -17.478 364 HG2 LYS 43 HG2 LYS 43 -3.703 1.191 -18.795 365 HG3 LYS 43 HG1 LYS 43 -2.163 1.910 -18.321 366 HD2 LYS 43 HD2 LYS 43 -1.664 0.185 -16.860 367 HD3 LYS 43 HD1 LYS 43 -3.359 -0.279 -16.672 368 HE2 LYS 43 HE2 LYS 43 -2.334 -1.967 -17.985 369 HE3 LYS 43 HE1 LYS 43 -3.320 -0.996 -19.079 370 HZ1 LYS 43 HZ1 LYS 43 -1.266 0.233 -19.666 371 HZ2 LYS 43 HZ2 LYS 43 -1.225 -1.400 -20.107 372 HZ3 LYS 43 HZ3 LYS 43 -0.373 -0.871 -18.746 373 H VAL 44 HN VAL 44 -1.745 5.266 -17.097 374 HA VAL 44 HA VAL 44 -3.842 7.107 -16.157 375 HB VAL 44 HB VAL 44 -1.811 7.966 -15.443 376 HG11 VAL 44 HG11 VAL 44 -0.156 6.623 -16.312 377 HG12 VAL 44 HG12 VAL 44 0.165 8.156 -17.122 378 HG13 VAL 44 HG13 VAL 44 -0.686 6.870 -17.978 379 HG21 VAL 44 HG21 VAL 44 -3.092 9.632 -16.753 380 HG22 VAL 44 HG22 VAL 44 -2.071 9.263 -18.143 381 HG23 VAL 44 HG23 VAL 44 -1.360 9.963 -16.690 382 H ILE 45 HN ILE 45 -5.178 8.100 -17.383 383 HA ILE 45 HA ILE 45 -4.910 7.798 -20.295 384 HB ILE 45 HB ILE 45 -7.401 8.232 -18.649 385 HG12 ILE 45 HG12 ILE 45 -6.457 6.053 -18.134 386 HG13 ILE 45 HG11 ILE 45 -7.934 5.867 -19.069 387 HG21 ILE 45 HG21 ILE 45 -7.448 9.004 -21.043 388 HG22 ILE 45 HG22 ILE 45 -8.669 7.797 -20.625 389 HG23 ILE 45 HG23 ILE 45 -7.221 7.321 -21.518 390 HD11 ILE 45 HD11 ILE 45 -5.132 5.646 -20.141 391 HD12 ILE 45 HD12 ILE 45 -6.619 5.419 -21.064 392 HD13 ILE 45 HD13 ILE 45 -6.208 4.300 -19.762 393 H ASP 46 HN ASP 46 -3.998 9.712 -20.936 394 HA ASP 46 HA ASP 46 -4.635 12.217 -19.691 395 HB2 ASP 46 HB2 ASP 46 -2.447 11.664 -20.849 396 HB3 ASP 46 HB1 ASP 46 -3.308 11.840 -22.376 397 H VAL 47 HN VAL 47 -6.689 12.918 -19.916 398 HA VAL 47 HA VAL 47 -8.318 12.297 -22.152 399 HB VAL 47 HB VAL 47 -10.004 13.733 -21.150 400 HG11 VAL 47 HG11 VAL 47 -8.604 11.603 -19.747 401 HG12 VAL 47 HG12 VAL 47 -10.335 11.863 -19.974 402 HG13 VAL 47 HG13 VAL 47 -9.488 12.668 -18.652 403 HG21 VAL 47 HG21 VAL 47 -7.900 14.519 -19.133 404 HG22 VAL 47 HG22 VAL 47 -9.591 15.023 -19.149 405 HG23 VAL 47 HG23 VAL 47 -8.499 15.558 -20.426 406 H LEU 48 HN LEU 48 -6.311 15.125 -21.461 407 HA LEU 48 HA LEU 48 -7.557 16.781 -23.416 408 HB2 LEU 48 HB2 LEU 48 -4.878 16.979 -22.068 409 HB3 LEU 48 HB1 LEU 48 -5.435 18.148 -23.251 410 HG LEU 48 HG LEU 48 -6.835 17.531 -20.647 411 HD11 LEU 48 HD11 LEU 48 -4.761 18.627 -20.173 412 HD12 LEU 48 HD12 LEU 48 -6.060 19.809 -20.015 413 HD13 LEU 48 HD13 LEU 48 -5.037 19.809 -21.453 414 HD21 LEU 48 HD21 LEU 48 -7.822 19.887 -21.396 415 HD22 LEU 48 HD22 LEU 48 -8.550 18.358 -21.886 416 HD23 LEU 48 HD23 LEU 48 -7.484 19.220 -22.993 417 H LYS 49 HN LYS 49 -4.743 14.622 -23.546 418 HA LYS 49 HA LYS 49 -4.006 15.416 -26.183 419 HB2 LYS 49 HB2 LYS 49 -3.287 12.980 -24.561 420 HB3 LYS 49 HB1 LYS 49 -2.677 13.260 -26.186 421 HG2 LYS 49 HG2 LYS 49 -1.783 15.463 -25.343 422 HG3 LYS 49 HG1 LYS 49 -2.178 14.901 -23.718 423 HD2 LYS 49 HD2 LYS 49 -0.405 13.403 -25.640 424 HD3 LYS 49 HD1 LYS 49 0.195 14.515 -24.411 425 HE2 LYS 49 HE2 LYS 49 -0.871 13.125 -22.676 426 HE3 LYS 49 HE1 LYS 49 -1.392 11.996 -23.926 427 HZ1 LYS 49 HZ1 LYS 49 1.204 12.331 -22.712 428 HZ2 LYS 49 HZ2 LYS 49 1.248 12.186 -24.396 429 HZ3 LYS 49 HZ3 LYS 49 0.526 10.974 -23.464 430 H ASN 50 HN ASN 50 -6.085 12.877 -24.896 431 HA ASN 50 HA ASN 50 -6.970 12.382 -27.661 432 HB2 ASN 50 HB2 ASN 50 -5.550 10.502 -26.617 433 HB3 ASN 50 HB1 ASN 50 -6.936 10.232 -25.560 434 HD21 ASN 50 HD21 ASN 50 -5.546 8.872 -28.011 435 HD22 ASN 50 HD22 ASN 50 -6.896 8.345 -28.950 436 HA PRO 51 HA PRO 51 -10.538 13.802 -25.190 437 HB2 PRO 51 HB2 PRO 51 -11.393 14.567 -27.930 438 HB3 PRO 51 HB1 PRO 51 -11.372 15.535 -26.452 439 HG2 PRO 51 HG2 PRO 51 -9.561 15.971 -28.347 440 HG3 PRO 51 HG1 PRO 51 -9.088 15.999 -26.638 441 HD2 PRO 51 HD2 PRO 51 -8.750 13.804 -28.652 442 HD3 PRO 51 HD1 PRO 51 -7.574 14.450 -27.483 443 H GLN 52 HN GLN 52 -10.290 11.858 -28.075 444 HA GLN 52 HA GLN 52 -12.952 10.930 -28.231 445 HB2 GLN 52 HB2 GLN 52 -10.342 9.731 -29.168 446 HB3 GLN 52 HB1 GLN 52 -11.908 9.007 -29.503 447 HG2 GLN 52 HG2 GLN 52 -12.589 10.901 -30.792 448 HG3 GLN 52 HG1 GLN 52 -11.152 11.804 -30.312 449 HE21 GLN 52 HE21 GLN 52 -12.115 11.112 -32.975 450 HE22 GLN 52 HE22 GLN 52 -10.839 10.227 -33.730 451 H LEU 53 HN LEU 53 -10.101 9.733 -26.510 452 HA LEU 53 HA LEU 53 -11.446 7.377 -25.647 453 HB2 LEU 53 HB2 LEU 53 -8.913 8.677 -24.641 454 HB3 LEU 53 HB1 LEU 53 -9.535 7.166 -24.004 455 HG LEU 53 HG LEU 53 -8.717 7.627 -26.873 456 HD11 LEU 53 HD11 LEU 53 -6.731 6.457 -26.424 457 HD12 LEU 53 HD12 LEU 53 -7.296 5.936 -24.838 458 HD13 LEU 53 HD13 LEU 53 -6.883 7.627 -25.113 459 HD21 LEU 53 HD21 LEU 53 -10.175 5.909 -27.113 460 HD22 LEU 53 HD22 LEU 53 -10.005 5.380 -25.438 461 HD23 LEU 53 HD23 LEU 53 -8.758 4.980 -26.620 462 H ALA 54 HN ALA 54 -10.990 10.613 -24.376 463 HA ALA 54 HA ALA 54 -11.936 10.137 -21.759 464 HB1 ALA 54 HB1 ALA 54 -12.048 12.478 -21.517 465 HB2 ALA 54 HB2 ALA 54 -12.228 12.725 -23.255 466 HB3 ALA 54 HB3 ALA 54 -10.685 12.180 -22.596 467 H GLU 55 HN GLU 55 -13.485 11.096 -24.781 468 HA GLU 55 HA GLU 55 -16.114 11.389 -23.729 469 HB2 GLU 55 HB2 GLU 55 -15.406 12.376 -25.888 470 HB3 GLU 55 HB1 GLU 55 -15.269 10.758 -26.564 471 HG2 GLU 55 HG2 GLU 55 -17.656 10.399 -26.225 472 HG3 GLU 55 HG1 GLU 55 -17.802 12.005 -25.517 473 H GLU 56 HN GLU 56 -14.351 8.681 -25.124 474 HA GLU 56 HA GLU 56 -16.503 6.895 -25.363 475 HB2 GLU 56 HB2 GLU 56 -13.564 6.393 -24.856 476 HB3 GLU 56 HB1 GLU 56 -14.721 5.107 -25.166 477 HG2 GLU 56 HG2 GLU 56 -14.030 7.365 -27.047 478 HG3 GLU 56 HG1 GLU 56 -13.488 5.690 -27.178 479 H ASP 57 HN ASP 57 -14.355 7.588 -22.611 480 HA ASP 57 HA ASP 57 -16.034 5.842 -20.967 481 HB2 ASP 57 HB2 ASP 57 -13.333 7.131 -20.441 482 HB3 ASP 57 HB1 ASP 57 -14.260 6.333 -19.173 483 H LYS 58 HN LYS 58 -16.422 8.746 -22.015 484 HA LYS 58 HA LYS 58 -17.416 10.668 -21.348 485 HB2 LYS 58 HB2 LYS 58 -18.775 8.604 -19.643 486 HB3 LYS 58 HB1 LYS 58 -19.276 10.290 -19.631 487 HG2 LYS 58 HG2 LYS 58 -19.036 8.841 -22.233 488 HG3 LYS 58 HG1 LYS 58 -20.456 8.589 -21.212 489 HD2 LYS 58 HD2 LYS 58 -20.861 11.016 -21.212 490 HD3 LYS 58 HD1 LYS 58 -19.457 11.240 -22.256 491 HE2 LYS 58 HE2 LYS 58 -21.493 11.271 -23.572 492 HE3 LYS 58 HE1 LYS 58 -20.527 9.852 -23.974 493 HZ1 LYS 58 HZ1 LYS 58 -23.120 9.740 -23.448 494 HZ2 LYS 58 HZ2 LYS 58 -22.518 9.497 -21.887 495 HZ3 LYS 58 HZ3 LYS 58 -22.063 8.455 -23.139 496 H ILE 59 HN ILE 59 -15.018 10.820 -20.373 497 HA ILE 59 HA ILE 59 -15.065 11.265 -17.500 498 HB ILE 59 HB ILE 59 -12.845 11.743 -19.495 499 HG12 ILE 59 HG12 ILE 59 -13.505 9.395 -19.457 500 HG13 ILE 59 HG11 ILE 59 -11.934 9.600 -18.687 501 HG21 ILE 59 HG21 ILE 59 -13.101 12.292 -16.662 502 HG22 ILE 59 HG22 ILE 59 -11.843 12.784 -17.797 503 HG23 ILE 59 HG23 ILE 59 -11.750 11.213 -17.001 504 HD11 ILE 59 HD11 ILE 59 -12.867 8.254 -17.145 505 HD12 ILE 59 HD12 ILE 59 -14.513 8.748 -17.546 506 HD13 ILE 59 HD13 ILE 59 -13.502 9.780 -16.532 507 H LEU 60 HN LEU 60 -16.043 13.080 -16.847 508 HA LEU 60 HA LEU 60 -15.613 15.550 -18.383 509 HB2 LEU 60 HB2 LEU 60 -17.760 14.897 -16.365 510 HB3 LEU 60 HB1 LEU 60 -17.609 16.414 -17.230 511 HG LEU 60 HG LEU 60 -18.156 13.728 -18.505 512 HD11 LEU 60 HD11 LEU 60 -20.054 14.500 -17.207 513 HD12 LEU 60 HD12 LEU 60 -20.391 14.649 -18.933 514 HD13 LEU 60 HD13 LEU 60 -19.972 16.079 -17.988 515 HD21 LEU 60 HD21 LEU 60 -17.047 14.973 -20.135 516 HD22 LEU 60 HD22 LEU 60 -17.778 16.491 -19.610 517 HD23 LEU 60 HD23 LEU 60 -18.753 15.291 -20.458 518 H ALA 61 HN ALA 61 -14.297 14.046 -15.815 519 HA ALA 61 HA ALA 61 -13.495 16.583 -14.610 520 HB1 ALA 61 HB1 ALA 61 -15.455 15.399 -13.352 521 HB2 ALA 61 HB2 ALA 61 -14.106 16.081 -12.444 522 HB3 ALA 61 HB3 ALA 61 -14.174 14.345 -12.752 523 H THR 62 HN THR 62 -11.486 16.536 -13.579 524 HA THR 62 HA THR 62 -9.941 14.076 -13.554 525 HB THR 62 HB THR 62 -8.015 15.215 -14.688 526 HG1 THR 62 HG1 THR 62 -9.234 17.364 -14.388 527 HG21 THR 62 HG21 THR 62 -10.471 14.964 -16.428 528 HG22 THR 62 HG22 THR 62 -9.432 13.628 -15.933 529 HG23 THR 62 HG23 THR 62 -8.792 14.905 -16.972 530 HA PRO 63 HA PRO 63 -8.025 13.448 -13.031 531 HB2 PRO 63 HB2 PRO 63 -6.887 12.347 -10.873 532 HB3 PRO 63 HB1 PRO 63 -6.056 13.558 -11.853 533 HG2 PRO 63 HG2 PRO 63 -7.443 13.869 -9.229 534 HG3 PRO 63 HG1 PRO 63 -5.927 14.594 -9.798 535 HD2 PRO 63 HD2 PRO 63 -8.364 15.888 -9.769 536 HD3 PRO 63 HD1 PRO 63 -7.008 16.320 -10.829 537 H THR 64 HN THR 64 -8.887 11.398 -12.886 538 HA THR 64 HA THR 64 -10.894 10.912 -10.795 539 HB THR 64 HB THR 64 -11.294 10.287 -13.731 540 HG1 THR 64 HG1 THR 64 -12.008 12.306 -13.647 541 HG21 THR 64 HG21 THR 64 -12.232 8.587 -12.156 542 HG22 THR 64 HG22 THR 64 -13.446 9.412 -13.134 543 HG23 THR 64 HG23 THR 64 -13.215 9.867 -11.446 544 H LEU 65 HN LEU 65 -10.758 8.950 -9.885 545 HA LEU 65 HA LEU 65 -8.773 7.051 -10.977 546 HB2 LEU 65 HB2 LEU 65 -8.270 7.931 -8.757 547 HB3 LEU 65 HB1 LEU 65 -9.839 7.405 -8.179 548 HG LEU 65 HG LEU 65 -9.185 5.056 -8.572 549 HD11 LEU 65 HD11 LEU 65 -7.615 5.047 -10.271 550 HD12 LEU 65 HD12 LEU 65 -6.624 4.754 -8.842 551 HD13 LEU 65 HD13 LEU 65 -6.684 6.364 -9.558 552 HD21 LEU 65 HD21 LEU 65 -8.839 5.535 -6.373 553 HD22 LEU 65 HD22 LEU 65 -7.722 6.855 -6.718 554 HD23 LEU 65 HD23 LEU 65 -7.177 5.183 -6.845 555 H ALA 66 HN ALA 66 -9.595 5.285 -11.934 556 HA ALA 66 HA ALA 66 -12.012 4.080 -10.761 557 HB1 ALA 66 HB1 ALA 66 -12.383 5.537 -12.946 558 HB2 ALA 66 HB2 ALA 66 -13.218 4.000 -12.716 559 HB3 ALA 66 HB3 ALA 66 -11.782 4.077 -13.737 560 H LYS 67 HN LYS 67 -11.991 1.972 -10.597 561 HA LYS 67 HA LYS 67 -9.608 0.565 -11.511 562 HB2 LYS 67 HB2 LYS 67 -10.161 0.170 -9.205 563 HB3 LYS 67 HB1 LYS 67 -11.837 -0.157 -9.610 564 HG2 LYS 67 HG2 LYS 67 -11.324 -2.264 -10.523 565 HG3 LYS 67 HG1 LYS 67 -9.601 -1.903 -10.594 566 HD2 LYS 67 HD2 LYS 67 -9.736 -3.312 -8.764 567 HD3 LYS 67 HD1 LYS 67 -9.783 -1.722 -8.011 568 HE2 LYS 67 HE2 LYS 67 -11.423 -3.320 -7.066 569 HE3 LYS 67 HE1 LYS 67 -12.178 -1.875 -7.722 570 HZ1 LYS 67 HZ1 LYS 67 -11.969 -3.945 -9.678 571 HZ2 LYS 67 HZ2 LYS 67 -13.336 -3.097 -9.156 572 HZ3 LYS 67 HZ3 LYS 67 -12.820 -4.468 -8.312 573 H VAL 68 HN VAL 68 -9.805 -0.047 -13.579 574 HA VAL 68 HA VAL 68 -12.379 -0.749 -14.666 575 HB VAL 68 HB VAL 68 -10.317 0.491 -15.775 576 HG11 VAL 68 HG11 VAL 68 -9.566 -1.457 -17.514 577 HG12 VAL 68 HG12 VAL 68 -9.617 -2.342 -15.989 578 HG13 VAL 68 HG13 VAL 68 -8.609 -0.904 -16.139 579 HG21 VAL 68 HG21 VAL 68 -12.403 -1.232 -17.045 580 HG22 VAL 68 HG22 VAL 68 -11.286 -0.276 -18.021 581 HG23 VAL 68 HG23 VAL 68 -12.355 0.523 -16.867 582 H LEU 69 HN LEU 69 -9.641 -2.386 -13.338 583 HA LEU 69 HA LEU 69 -10.998 -4.937 -13.901 584 HB2 LEU 69 HB2 LEU 69 -9.176 -4.606 -15.571 585 HB3 LEU 69 HB1 LEU 69 -8.029 -4.537 -14.253 586 HG LEU 69 HG LEU 69 -8.725 -6.882 -13.646 587 HD11 LEU 69 HD11 LEU 69 -10.347 -7.949 -14.728 588 HD12 LEU 69 HD12 LEU 69 -9.673 -7.519 -16.300 589 HD13 LEU 69 HD13 LEU 69 -10.760 -6.405 -15.473 590 HD21 LEU 69 HD21 LEU 69 -6.655 -6.647 -14.725 591 HD22 LEU 69 HD22 LEU 69 -7.409 -6.242 -16.269 592 HD23 LEU 69 HD23 LEU 69 -7.512 -7.888 -15.642 593 HA PRO 70 HA PRO 70 -11.206 -6.778 -13.296 594 HB2 PRO 70 HB2 PRO 70 -12.519 -7.921 -10.984 595 HB3 PRO 70 HB1 PRO 70 -11.402 -8.700 -12.107 596 HG2 PRO 70 HG2 PRO 70 -10.795 -8.187 -9.492 597 HG3 PRO 70 HG1 PRO 70 -9.580 -8.294 -10.779 598 HD2 PRO 70 HD2 PRO 70 -10.828 -5.855 -9.548 599 HD3 PRO 70 HD1 PRO 70 -9.126 -6.158 -9.969 600 HA PRO 71 HA PRO 71 -14.956 -4.367 -13.181 601 HB2 PRO 71 HB2 PRO 71 -16.596 -5.951 -14.648 602 HB3 PRO 71 HB1 PRO 71 -15.275 -5.025 -15.374 603 HG2 PRO 71 HG2 PRO 71 -15.336 -7.914 -14.567 604 HG3 PRO 71 HG1 PRO 71 -14.733 -7.190 -16.072 605 HD2 PRO 71 HD2 PRO 71 -13.071 -7.897 -14.075 606 HD3 PRO 71 HD1 PRO 71 -12.770 -6.465 -15.083 607 HA PRO 72 HA PRO 72 -17.576 -4.030 -13.449 608 HB2 PRO 72 HB2 PRO 72 -18.557 -2.949 -10.874 609 HB3 PRO 72 HB1 PRO 72 -19.425 -3.205 -12.393 610 HG2 PRO 72 HG2 PRO 72 -19.860 -4.801 -10.313 611 HG3 PRO 72 HG1 PRO 72 -19.781 -5.465 -11.957 612 HD2 PRO 72 HD2 PRO 72 -17.672 -5.462 -9.817 613 HD3 PRO 72 HD1 PRO 72 -18.184 -6.787 -10.885 614 H VAL 73 HN VAL 73 -17.017 -1.852 -13.704 615 HA VAL 73 HA VAL 73 -14.463 -1.110 -12.698 616 HB VAL 73 HB VAL 73 -16.506 0.546 -14.199 617 HG11 VAL 73 HG11 VAL 73 -13.641 1.050 -13.480 618 HG12 VAL 73 HG12 VAL 73 -15.035 2.115 -13.307 619 HG13 VAL 73 HG13 VAL 73 -14.367 1.790 -14.906 620 HG21 VAL 73 HG21 VAL 73 -14.726 -1.588 -15.019 621 HG22 VAL 73 HG22 VAL 73 -14.422 -0.097 -15.908 622 HG23 VAL 73 HG23 VAL 73 -16.035 -0.808 -15.906 623 H ARG 74 HN ARG 74 -13.978 -0.077 -10.871 624 HA ARG 74 HA ARG 74 -16.137 1.204 -9.339 625 HB2 ARG 74 HB2 ARG 74 -15.044 -0.508 -8.076 626 HB3 ARG 74 HB1 ARG 74 -13.457 0.085 -8.528 627 HG2 ARG 74 HG2 ARG 74 -13.919 0.646 -6.235 628 HG3 ARG 74 HG1 ARG 74 -13.858 2.120 -7.205 629 HD2 ARG 74 HD2 ARG 74 -15.715 2.246 -5.668 630 HD3 ARG 74 HD1 ARG 74 -16.328 2.105 -7.314 631 HE ARG 74 HE ARG 74 -16.129 -0.450 -6.118 632 HH11 ARG 74 HH11 ARG 74 -18.038 2.462 -6.047 633 HH12 ARG 74 HH12 ARG 74 -19.486 1.659 -5.535 634 HH21 ARG 74 HH21 ARG 74 -18.024 -1.522 -5.443 635 HH22 ARG 74 HH22 ARG 74 -19.477 -0.613 -5.189 636 H ARG 75 HN ARG 75 -16.295 3.313 -9.488 637 HA ARG 75 HA ARG 75 -13.907 4.845 -10.195 638 HB2 ARG 75 HB2 ARG 75 -16.832 5.571 -10.273 639 HB3 ARG 75 HB1 ARG 75 -15.527 6.695 -10.621 640 HG2 ARG 75 HG2 ARG 75 -14.789 5.207 -12.452 641 HG3 ARG 75 HG1 ARG 75 -16.203 4.196 -12.149 642 HD2 ARG 75 HD2 ARG 75 -16.334 7.126 -12.814 643 HD3 ARG 75 HD1 ARG 75 -16.462 5.844 -14.012 644 HE ARG 75 HE ARG 75 -18.514 5.149 -12.949 645 HH11 ARG 75 HH11 ARG 75 -17.276 8.259 -11.961 646 HH12 ARG 75 HH12 ARG 75 -18.802 8.821 -11.368 647 HH21 ARG 75 HH21 ARG 75 -20.522 5.881 -12.173 648 HH22 ARG 75 HH22 ARG 75 -20.650 7.466 -11.487 649 H ILE 76 HN ILE 76 -12.890 5.992 -8.755 650 HA ILE 76 HA ILE 76 -14.195 6.521 -6.165 651 HB ILE 76 HB ILE 76 -11.247 6.398 -6.804 652 HG12 ILE 76 HG12 ILE 76 -13.001 4.460 -5.276 653 HG13 ILE 76 HG11 ILE 76 -12.414 4.212 -6.919 654 HG21 ILE 76 HG21 ILE 76 -12.758 7.307 -4.457 655 HG22 ILE 76 HG22 ILE 76 -11.100 7.655 -4.943 656 HG23 ILE 76 HG23 ILE 76 -11.474 6.151 -4.100 657 HD11 ILE 76 HD11 ILE 76 -11.202 3.145 -4.878 658 HD12 ILE 76 HD12 ILE 76 -10.455 4.737 -4.763 659 HD13 ILE 76 HD13 ILE 76 -10.287 3.791 -6.240 660 H ILE 77 HN ILE 77 -14.835 8.577 -5.890 661 HA ILE 77 HA ILE 77 -13.307 10.708 -7.228 662 HB ILE 77 HB ILE 77 -16.253 10.784 -6.595 663 HG12 ILE 77 HG12 ILE 77 -15.898 10.909 -9.364 664 HG13 ILE 77 HG11 ILE 77 -14.812 9.627 -8.835 665 HG21 ILE 77 HG21 ILE 77 -14.748 12.627 -8.423 666 HG22 ILE 77 HG22 ILE 77 -14.900 12.948 -6.696 667 HG23 ILE 77 HG23 ILE 77 -16.342 12.847 -7.703 668 HD11 ILE 77 HD11 ILE 77 -16.994 8.756 -9.454 669 HD12 ILE 77 HD12 ILE 77 -17.758 9.787 -8.247 670 HD13 ILE 77 HD13 ILE 77 -16.667 8.498 -7.741 671 H GLY 78 HN GLY 78 -12.417 12.188 -5.930 672 HA2 GLY 78 HA2 GLY 78 -13.524 13.439 -3.747 673 HA3 GLY 78 HA1 GLY 78 -12.730 12.012 -3.094 674 H ASP 79 HN ASP 79 -11.415 13.640 -1.943 675 HA ASP 79 HA ASP 79 -9.547 15.189 -3.522 676 HB2 ASP 79 HB2 ASP 79 -10.413 16.028 -1.346 677 HB3 ASP 79 HB1 ASP 79 -9.612 14.686 -0.533 678 H LEU 80 HN LEU 80 -8.196 13.869 -4.650 679 HA LEU 80 HA LEU 80 -7.038 11.541 -3.379 680 HB2 LEU 80 HB2 LEU 80 -6.661 12.671 -6.155 681 HB3 LEU 80 HB1 LEU 80 -5.978 11.159 -5.590 682 HG LEU 80 HG LEU 80 -8.936 11.746 -5.800 683 HD11 LEU 80 HD11 LEU 80 -6.958 10.566 -7.675 684 HD12 LEU 80 HD12 LEU 80 -8.392 11.541 -8.002 685 HD13 LEU 80 HD13 LEU 80 -8.560 9.834 -7.591 686 HD21 LEU 80 HD21 LEU 80 -9.043 9.221 -5.559 687 HD22 LEU 80 HD22 LEU 80 -8.637 10.133 -4.104 688 HD23 LEU 80 HD23 LEU 80 -7.370 9.303 -5.008 689 H SER 81 HN SER 81 -6.176 14.791 -3.519 690 HA SER 81 HA SER 81 -3.361 14.534 -3.820 691 HB2 SER 81 HB2 SER 81 -3.239 16.811 -2.902 692 HB3 SER 81 HB1 SER 81 -4.518 16.697 -4.110 693 HG SER 81 HG SER 81 -4.763 16.790 -1.292 694 H ASN 82 HN ASN 82 -5.518 13.838 -1.292 695 HA ASN 82 HA ASN 82 -3.542 13.915 0.819 696 HB2 ASN 82 HB2 ASN 82 -5.879 14.471 1.318 697 HB3 ASN 82 HB1 ASN 82 -6.375 12.876 0.774 698 HD21 ASN 82 HD21 ASN 82 -4.562 14.614 3.216 699 HD22 ASN 82 HD22 ASN 82 -4.665 13.388 4.429 700 H ARG 83 HN ARG 83 -2.088 12.350 1.018 701 HA ARG 83 HA ARG 83 -2.135 10.014 -0.487 702 HB2 ARG 83 HB2 ARG 83 -0.505 10.734 1.953 703 HB3 ARG 83 HB1 ARG 83 -0.260 9.237 1.065 704 HG2 ARG 83 HG2 ARG 83 0.152 10.632 -0.981 705 HG3 ARG 83 HG1 ARG 83 0.140 12.046 0.072 706 HD2 ARG 83 HD2 ARG 83 1.979 9.676 0.384 707 HD3 ARG 83 HD1 ARG 83 2.418 11.192 -0.399 708 HE ARG 83 HE ARG 83 2.090 10.718 2.447 709 HH11 ARG 83 HH11 ARG 83 2.467 13.048 -0.117 710 HH12 ARG 83 HH12 ARG 83 3.017 14.312 0.933 711 HH21 ARG 83 HH21 ARG 83 2.810 12.369 3.841 712 HH22 ARG 83 HH22 ARG 83 3.212 13.924 3.190 713 H GLU 84 HN GLU 84 -3.233 10.541 2.830 714 HA GLU 84 HA GLU 84 -3.564 7.840 3.552 715 HB2 GLU 84 HB2 GLU 84 -4.996 10.332 4.432 716 HB3 GLU 84 HB1 GLU 84 -5.371 8.745 5.089 717 HG2 GLU 84 HG2 GLU 84 -3.881 9.451 6.638 718 HG3 GLU 84 HG1 GLU 84 -2.775 8.677 5.508 719 H LYS 85 HN LYS 85 -5.891 10.039 1.897 720 HA LYS 85 HA LYS 85 -7.930 8.071 1.862 721 HB2 LYS 85 HB2 LYS 85 -7.472 10.472 0.075 722 HB3 LYS 85 HB1 LYS 85 -8.871 9.420 -0.097 723 HG2 LYS 85 HG2 LYS 85 -9.562 9.992 2.183 724 HG3 LYS 85 HG1 LYS 85 -8.175 11.074 2.323 725 HD2 LYS 85 HD2 LYS 85 -9.023 12.334 0.352 726 HD3 LYS 85 HD1 LYS 85 -10.442 11.290 0.341 727 HE2 LYS 85 HE2 LYS 85 -9.610 13.070 2.630 728 HE3 LYS 85 HE1 LYS 85 -10.880 13.434 1.463 729 HZ1 LYS 85 HZ1 LYS 85 -11.711 11.075 2.302 730 HZ2 LYS 85 HZ2 LYS 85 -12.142 12.515 3.079 731 HZ3 LYS 85 HZ3 LYS 85 -10.888 11.563 3.698 732 H VAL 86 HN VAL 86 -5.389 8.810 -0.477 733 HA VAL 86 HA VAL 86 -6.262 6.952 -2.421 734 HB VAL 86 HB VAL 86 -3.492 8.048 -1.877 735 HG11 VAL 86 HG11 VAL 86 -4.485 6.396 -4.201 736 HG12 VAL 86 HG12 VAL 86 -3.259 5.929 -3.024 737 HG13 VAL 86 HG13 VAL 86 -2.944 7.249 -4.150 738 HG21 VAL 86 HG21 VAL 86 -4.467 9.876 -2.739 739 HG22 VAL 86 HG22 VAL 86 -5.862 8.970 -3.325 740 HG23 VAL 86 HG23 VAL 86 -4.380 9.018 -4.279 741 H LEU 87 HN LEU 87 -4.010 6.639 0.318 742 HA LEU 87 HA LEU 87 -3.318 3.932 -0.193 743 HB2 LEU 87 HB2 LEU 87 -1.901 5.367 1.164 744 HB3 LEU 87 HB1 LEU 87 -3.200 5.613 2.315 745 HG LEU 87 HG LEU 87 -3.092 3.229 2.920 746 HD11 LEU 87 HD11 LEU 87 -2.258 2.041 1.139 747 HD12 LEU 87 HD12 LEU 87 -0.842 2.128 2.189 748 HD13 LEU 87 HD13 LEU 87 -0.986 3.220 0.811 749 HD21 LEU 87 HD21 LEU 87 -0.344 4.389 3.187 750 HD22 LEU 87 HD22 LEU 87 -1.275 3.457 4.358 751 HD23 LEU 87 HD23 LEU 87 -1.726 5.125 3.999 752 H ILE 88 HN ILE 88 -5.741 5.411 1.954 753 HA ILE 88 HA ILE 88 -6.643 2.998 3.084 754 HB ILE 88 HB ILE 88 -8.004 5.656 2.717 755 HG12 ILE 88 HG12 ILE 88 -7.038 4.276 5.226 756 HG13 ILE 88 HG11 ILE 88 -6.019 5.347 4.270 757 HG21 ILE 88 HG21 ILE 88 -9.788 4.052 2.767 758 HG22 ILE 88 HG22 ILE 88 -9.699 4.828 4.350 759 HG23 ILE 88 HG23 ILE 88 -9.050 3.203 4.127 760 HD11 ILE 88 HD11 ILE 88 -8.291 6.837 4.687 761 HD12 ILE 88 HD12 ILE 88 -6.769 6.974 5.571 762 HD13 ILE 88 HD13 ILE 88 -8.075 5.970 6.207 763 H ALA 89 HN ALA 89 -7.815 4.817 0.254 764 HA ALA 89 HA ALA 89 -9.901 3.036 -0.425 765 HB1 ALA 89 HB1 ALA 89 -10.208 4.320 -2.290 766 HB2 ALA 89 HB2 ALA 89 -8.478 4.517 -2.574 767 HB3 ALA 89 HB3 ALA 89 -9.275 5.450 -1.307 768 H LEU 90 HN LEU 90 -6.492 3.146 -1.317 769 HA LEU 90 HA LEU 90 -6.563 1.066 -3.240 770 HB2 LEU 90 HB2 LEU 90 -4.660 2.849 -2.307 771 HB3 LEU 90 HB1 LEU 90 -4.055 1.302 -1.751 772 HG LEU 90 HG LEU 90 -3.119 1.983 -3.920 773 HD11 LEU 90 HD11 LEU 90 -4.733 -0.507 -3.630 774 HD12 LEU 90 HD12 LEU 90 -2.979 -0.287 -3.642 775 HD13 LEU 90 HD13 LEU 90 -3.897 -0.176 -5.149 776 HD21 LEU 90 HD21 LEU 90 -4.371 2.783 -5.564 777 HD22 LEU 90 HD22 LEU 90 -5.760 2.709 -4.481 778 HD23 LEU 90 HD23 LEU 90 -5.400 1.349 -5.548 779 H ARG 91 HN ARG 91 -5.967 1.092 0.258 780 HA ARG 91 HA ARG 91 -5.251 -1.635 0.533 781 HB2 ARG 91 HB2 ARG 91 -4.838 0.067 2.267 782 HB3 ARG 91 HB1 ARG 91 -6.570 0.223 2.522 783 HG2 ARG 91 HG2 ARG 91 -6.685 -2.075 3.303 784 HG3 ARG 91 HG1 ARG 91 -4.959 -2.278 2.993 785 HD2 ARG 91 HD2 ARG 91 -4.450 -0.554 4.642 786 HD3 ARG 91 HD1 ARG 91 -6.173 -0.309 4.932 787 HE ARG 91 HE ARG 91 -5.589 -3.008 5.368 788 HH11 ARG 91 HH11 ARG 91 -4.876 0.107 6.752 789 HH12 ARG 91 HH12 ARG 91 -4.691 -0.504 8.362 790 HH21 ARG 91 HH21 ARG 91 -5.348 -3.827 7.480 791 HH22 ARG 91 HH22 ARG 91 -4.959 -2.749 8.777 792 H LEU 92 HN LEU 92 -8.386 0.026 0.832 793 HA LEU 92 HA LEU 92 -9.872 -2.270 1.506 794 HB2 LEU 92 HB2 LEU 92 -10.685 0.324 0.199 795 HB3 LEU 92 HB1 LEU 92 -11.837 -0.917 0.656 796 HG LEU 92 HG LEU 92 -9.983 0.456 2.602 797 HD11 LEU 92 HD11 LEU 92 -11.438 2.138 1.790 798 HD12 LEU 92 HD12 LEU 92 -12.094 1.609 3.340 799 HD13 LEU 92 HD13 LEU 92 -12.829 1.055 1.836 800 HD21 LEU 92 HD21 LEU 92 -10.591 -1.558 3.582 801 HD22 LEU 92 HD22 LEU 92 -12.199 -1.543 2.855 802 HD23 LEU 92 HD23 LEU 92 -11.821 -0.445 4.182 803 H LEU 93 HN LEU 93 -9.065 -0.841 -1.623 804 HA LEU 93 HA LEU 93 -10.716 -2.536 -3.184 805 HB2 LEU 93 HB2 LEU 93 -8.213 -1.002 -3.858 806 HB3 LEU 93 HB1 LEU 93 -9.127 -1.905 -5.048 807 HG LEU 93 HG LEU 93 -10.244 0.381 -3.424 808 HD11 LEU 93 HD11 LEU 93 -8.900 1.594 -4.762 809 HD12 LEU 93 HD12 LEU 93 -10.159 1.286 -5.957 810 HD13 LEU 93 HD13 LEU 93 -8.705 0.290 -5.933 811 HD21 LEU 93 HD21 LEU 93 -12.228 -0.182 -4.249 812 HD22 LEU 93 HD22 LEU 93 -11.504 -1.642 -4.928 813 HD23 LEU 93 HD23 LEU 93 -11.587 -0.166 -5.892 814 H ALA 94 HN ALA 94 -7.350 -2.785 -2.111 815 HA ALA 94 HA ALA 94 -6.710 -5.104 -3.577 816 HB1 ALA 94 HB1 ALA 94 -5.427 -4.504 -0.943 817 HB2 ALA 94 HB2 ALA 94 -5.153 -3.450 -2.332 818 HB3 ALA 94 HB3 ALA 94 -4.704 -5.155 -2.415 819 H GLU 95 HN GLU 95 -8.119 -4.669 -0.365 820 HA GLU 95 HA GLU 95 -7.937 -7.340 0.475 821 HB2 GLU 95 HB2 GLU 95 -9.859 -5.124 1.185 822 HB3 GLU 95 HB1 GLU 95 -9.894 -6.699 1.968 823 HG2 GLU 95 HG2 GLU 95 -7.695 -6.378 2.855 824 HG3 GLU 95 HG1 GLU 95 -7.482 -4.902 1.916 825 H GLU 96 HN GLU 96 -10.286 -5.622 -1.476 826 HA GLU 96 HA GLU 96 -12.307 -7.568 -1.589 827 HB2 GLU 96 HB2 GLU 96 -11.436 -5.432 -3.552 828 HB3 GLU 96 HB1 GLU 96 -12.864 -6.434 -3.798 829 HG2 GLU 96 HG2 GLU 96 -13.903 -5.552 -1.826 830 HG3 GLU 96 HG1 GLU 96 -12.431 -4.688 -1.384 831 H ILE 97 HN ILE 97 -9.403 -7.068 -3.505 832 HA ILE 97 HA ILE 97 -9.862 -9.096 -5.428 833 HB ILE 97 HB ILE 97 -7.287 -7.814 -4.497 834 HG12 ILE 97 HG12 ILE 97 -8.900 -7.288 -6.985 835 HG13 ILE 97 HG11 ILE 97 -9.104 -6.373 -5.491 836 HG21 ILE 97 HG21 ILE 97 -6.528 -9.735 -5.558 837 HG22 ILE 97 HG22 ILE 97 -6.573 -8.564 -6.878 838 HG23 ILE 97 HG23 ILE 97 -7.868 -9.751 -6.705 839 HD11 ILE 97 HD11 ILE 97 -6.496 -6.627 -6.933 840 HD12 ILE 97 HD12 ILE 97 -6.907 -5.543 -5.605 841 HD13 ILE 97 HD13 ILE 97 -7.644 -5.313 -7.188 842 H GLY 98 HN GLY 98 -8.080 -8.998 -2.369 843 HA2 GLY 98 HA2 GLY 98 -6.970 -11.578 -2.451 844 HA3 GLY 98 HA1 GLY 98 -7.287 -10.656 -0.990 845 H ASP 99 HN ASP 99 -10.133 -10.471 -1.402 846 HA ASP 99 HA ASP 99 -10.987 -12.792 -0.075 847 HB2 ASP 99 HB2 ASP 99 -12.158 -10.611 0.034 848 HB3 ASP 99 HB1 ASP 99 -12.679 -10.826 -1.635 849 H TYR 100 HN TYR 100 -11.120 -11.906 -3.500 850 HA TYR 100 HA TYR 100 -12.445 -14.428 -4.139 851 HB2 TYR 100 HB2 TYR 100 -11.690 -12.055 -5.857 852 HB3 TYR 100 HB1 TYR 100 -12.459 -13.513 -6.477 853 HD1 TYR 100 HD1 TYR 100 -12.946 -10.427 -4.588 854 HD2 TYR 100 HD2 TYR 100 -14.790 -14.029 -5.906 855 HE1 TYR 100 HE1 TYR 100 -15.154 -9.486 -4.058 856 HE2 TYR 100 HE2 TYR 100 -17.002 -13.095 -5.378 857 HH TYR 100 HH TYR 100 -17.678 -10.927 -3.482 858 H LYS 101 HN LYS 101 -11.119 -16.123 -4.203 859 HA LYS 101 HA LYS 101 -8.496 -15.802 -5.497 860 HB2 LYS 101 HB2 LYS 101 -9.409 -17.845 -3.462 861 HB3 LYS 101 HB1 LYS 101 -7.836 -17.851 -4.246 862 HG2 LYS 101 HG2 LYS 101 -7.260 -15.750 -3.216 863 HG3 LYS 101 HG1 LYS 101 -8.876 -15.607 -2.526 864 HD2 LYS 101 HD2 LYS 101 -7.413 -16.377 -0.802 865 HD3 LYS 101 HD1 LYS 101 -8.441 -17.731 -1.275 866 HE2 LYS 101 HE2 LYS 101 -6.649 -18.643 -2.640 867 HE3 LYS 101 HE1 LYS 101 -5.626 -17.259 -2.255 868 HZ1 LYS 101 HZ1 LYS 101 -6.710 -18.987 -0.120 869 HZ2 LYS 101 HZ2 LYS 101 -5.365 -17.961 -0.072 870 HZ3 LYS 101 HZ3 LYS 101 -5.293 -19.408 -0.944 871 H ASP 102 HN ASP 102 -7.874 -17.187 -7.118 872 HA ASP 102 HA ASP 102 -9.550 -19.429 -7.847 873 HB2 ASP 102 HB2 ASP 102 -9.952 -18.671 -10.148 874 HB3 ASP 102 HB1 ASP 102 -10.694 -17.584 -8.988 875 H ASP 103 HN ASP 103 -8.613 -20.456 -9.961 876 HA ASP 103 HA ASP 103 -5.698 -20.502 -9.613 877 HB2 ASP 103 HB2 ASP 103 -6.925 -22.648 -9.334 878 HB3 ASP 103 HB1 ASP 103 -7.488 -22.517 -10.997 879 H ASP 104 HN ASP 104 -4.843 -18.986 -10.937 880 HA ASP 104 HA ASP 104 -5.775 -18.907 -13.720 881 HB2 ASP 104 HB2 ASP 104 -4.682 -16.720 -13.892 882 HB3 ASP 104 HB1 ASP 104 -5.854 -16.746 -12.584 883 H ASP 105 HN ASP 105 -3.721 -20.717 -12.247 884 HA ASP 105 HA ASP 105 -1.323 -20.183 -13.812 885 HB2 ASP 105 HB2 ASP 105 -1.145 -20.913 -11.439 886 HB3 ASP 105 HB1 ASP 105 -1.896 -22.442 -11.880 887 H LYS 106 HN LYS 106 -1.544 -20.723 -15.906 888 HA LYS 106 HA LYS 106 -2.735 -23.337 -16.545 889 HB2 LYS 106 HB2 LYS 106 -3.532 -21.004 -17.546 890 HB3 LYS 106 HB1 LYS 106 -2.205 -21.303 -18.660 891 HG2 LYS 106 HG2 LYS 106 -4.198 -22.121 -19.664 892 HG3 LYS 106 HG1 LYS 106 -3.235 -23.517 -19.177 893 HD2 LYS 106 HD2 LYS 106 -4.673 -24.072 -17.451 894 HD3 LYS 106 HD1 LYS 106 -5.308 -22.430 -17.317 895 HE2 LYS 106 HE2 LYS 106 -6.975 -23.921 -18.270 896 HE3 LYS 106 HE1 LYS 106 -6.475 -22.711 -19.451 897 HZ1 LYS 106 HZ1 LYS 106 -6.606 -24.861 -20.486 898 HZ2 LYS 106 HZ2 LYS 106 -5.566 -25.536 -19.336 899 HZ3 LYS 106 HZ3 LYS 106 -4.984 -24.380 -20.425 Start of MODEL 19 1 H1 MET 1 HT1 MET 1 -15.190 -9.573 -20.863 2 H2 MET 1 HT2 MET 1 -13.596 -10.129 -20.973 3 H3 MET 1 HT3 MET 1 -13.968 -8.539 -21.411 4 HA MET 1 HA MET 1 -12.879 -8.685 -19.237 5 HB2 MET 1 HB2 MET 1 -14.962 -7.542 -18.008 6 HB3 MET 1 HB1 MET 1 -14.046 -6.724 -19.266 7 HG2 MET 1 HG2 MET 1 -16.198 -6.335 -19.943 8 HG3 MET 1 HG1 MET 1 -15.807 -7.788 -20.859 9 HE1 MET 1 HE1 MET 1 -17.336 -6.200 -17.895 10 HE2 MET 1 HE2 MET 1 -17.187 -7.610 -16.848 11 HE3 MET 1 HE3 MET 1 -18.760 -7.165 -17.508 12 H ALA 2 HN ALA 2 -14.900 -11.132 -19.858 13 HA ALA 2 HA ALA 2 -16.034 -11.812 -17.384 14 HB1 ALA 2 HB1 ALA 2 -15.360 -14.188 -18.815 15 HB2 ALA 2 HB2 ALA 2 -15.910 -12.958 -19.953 16 HB3 ALA 2 HB3 ALA 2 -16.937 -13.426 -18.598 17 HA PRO 3 HA PRO 3 -12.069 -14.604 -16.607 18 HB2 PRO 3 HB2 PRO 3 -10.056 -13.005 -18.104 19 HB3 PRO 3 HB1 PRO 3 -10.186 -14.758 -17.918 20 HG2 PRO 3 HG2 PRO 3 -10.847 -13.625 -20.218 21 HG3 PRO 3 HG1 PRO 3 -11.844 -14.935 -19.551 22 HD2 PRO 3 HD2 PRO 3 -12.328 -11.972 -19.490 23 HD3 PRO 3 HD1 PRO 3 -13.467 -13.287 -19.852 24 H LEU 4 HN LEU 4 -10.942 -14.267 -14.754 25 HA LEU 4 HA LEU 4 -10.559 -11.463 -13.949 26 HB2 LEU 4 HB2 LEU 4 -11.056 -13.851 -12.167 27 HB3 LEU 4 HB1 LEU 4 -10.906 -12.184 -11.646 28 HG LEU 4 HG LEU 4 -13.127 -13.317 -13.350 29 HD11 LEU 4 HD11 LEU 4 -14.523 -12.748 -11.381 30 HD12 LEU 4 HD12 LEU 4 -13.045 -12.404 -10.483 31 HD13 LEU 4 HD13 LEU 4 -13.355 -14.034 -11.080 32 HD21 LEU 4 HD21 LEU 4 -13.044 -11.162 -14.108 33 HD22 LEU 4 HD22 LEU 4 -12.386 -10.535 -12.594 34 HD23 LEU 4 HD23 LEU 4 -14.091 -10.966 -12.702 35 H ARG 5 HN ARG 5 -8.664 -10.884 -12.891 36 HA ARG 5 HA ARG 5 -6.538 -12.917 -12.841 37 HB2 ARG 5 HB2 ARG 5 -6.293 -10.060 -13.757 38 HB3 ARG 5 HB1 ARG 5 -4.943 -11.161 -13.521 39 HG2 ARG 5 HG2 ARG 5 -6.036 -12.685 -15.200 40 HG3 ARG 5 HG1 ARG 5 -7.149 -11.359 -15.548 41 HD2 ARG 5 HD2 ARG 5 -5.225 -9.921 -16.063 42 HD3 ARG 5 HD1 ARG 5 -4.157 -11.294 -15.774 43 HE ARG 5 HE ARG 5 -6.090 -11.977 -17.713 44 HH11 ARG 5 HH11 ARG 5 -3.232 -10.029 -17.300 45 HH12 ARG 5 HH12 ARG 5 -2.772 -10.111 -18.968 46 HH21 ARG 5 HH21 ARG 5 -5.499 -12.096 -19.912 47 HH22 ARG 5 HH22 ARG 5 -4.067 -11.290 -20.458 48 H LYS 6 HN LYS 6 -4.862 -12.571 -11.281 49 HA LYS 6 HA LYS 6 -5.782 -11.676 -8.774 50 HB2 LYS 6 HB2 LYS 6 -2.976 -12.286 -9.708 51 HB3 LYS 6 HB1 LYS 6 -3.424 -12.009 -8.031 52 HG2 LYS 6 HG2 LYS 6 -4.489 -14.232 -9.765 53 HG3 LYS 6 HG1 LYS 6 -3.197 -14.393 -8.575 54 HD2 LYS 6 HD2 LYS 6 -4.807 -13.628 -6.828 55 HD3 LYS 6 HD1 LYS 6 -6.080 -13.672 -8.050 56 HE2 LYS 6 HE2 LYS 6 -4.389 -16.013 -7.174 57 HE3 LYS 6 HE1 LYS 6 -6.058 -15.712 -6.693 58 HZ1 LYS 6 HZ1 LYS 6 -6.592 -15.777 -9.140 59 HZ2 LYS 6 HZ2 LYS 6 -6.149 -17.259 -8.447 60 HZ3 LYS 6 HZ3 LYS 6 -5.036 -16.395 -9.387 61 H THR 7 HN THR 7 -3.729 -10.215 -11.196 62 HA THR 7 HA THR 7 -3.209 -7.880 -9.577 63 HB THR 7 HB THR 7 -2.333 -7.089 -11.965 64 HG1 THR 7 HG1 THR 7 -3.025 -8.844 -13.159 65 HG21 THR 7 HG21 THR 7 -0.506 -7.198 -10.691 66 HG22 THR 7 HG22 THR 7 -0.316 -8.863 -11.248 67 HG23 THR 7 HG23 THR 7 -1.166 -8.530 -9.739 68 H ALA 8 HN ALA 8 -4.512 -6.224 -9.424 69 HA ALA 8 HA ALA 8 -6.767 -5.942 -11.234 70 HB1 ALA 8 HB1 ALA 8 -6.908 -5.727 -8.712 71 HB2 ALA 8 HB2 ALA 8 -7.669 -4.443 -9.655 72 HB3 ALA 8 HB3 ALA 8 -6.099 -4.171 -8.899 73 H VAL 9 HN VAL 9 -7.269 -4.006 -12.347 74 HA VAL 9 HA VAL 9 -4.870 -2.435 -13.018 75 HB VAL 9 HB VAL 9 -7.287 -2.976 -14.745 76 HG11 VAL 9 HG11 VAL 9 -6.644 -0.985 -15.638 77 HG12 VAL 9 HG12 VAL 9 -5.444 -1.996 -16.443 78 HG13 VAL 9 HG13 VAL 9 -5.006 -1.099 -14.990 79 HG21 VAL 9 HG21 VAL 9 -6.117 -4.596 -15.833 80 HG22 VAL 9 HG22 VAL 9 -5.375 -4.758 -14.242 81 HG23 VAL 9 HG23 VAL 9 -4.557 -3.841 -15.507 82 H LEU 10 HN LEU 10 -4.910 -0.378 -12.500 83 HA LEU 10 HA LEU 10 -7.494 0.902 -11.856 84 HB2 LEU 10 HB2 LEU 10 -5.368 0.505 -10.171 85 HB3 LEU 10 HB1 LEU 10 -5.019 2.104 -10.791 86 HG LEU 10 HG LEU 10 -6.173 2.362 -8.719 87 HD11 LEU 10 HD11 LEU 10 -8.225 3.552 -9.371 88 HD12 LEU 10 HD12 LEU 10 -8.076 2.879 -10.996 89 HD13 LEU 10 HD13 LEU 10 -6.839 3.974 -10.378 90 HD21 LEU 10 HD21 LEU 10 -8.596 1.436 -8.607 91 HD22 LEU 10 HD22 LEU 10 -7.231 0.374 -8.245 92 HD23 LEU 10 HD23 LEU 10 -8.019 0.291 -9.821 93 H LYS 11 HN LYS 11 -7.993 2.716 -13.074 94 HA LYS 11 HA LYS 11 -5.808 3.690 -14.792 95 HB2 LYS 11 HB2 LYS 11 -8.754 3.476 -15.421 96 HB3 LYS 11 HB1 LYS 11 -7.639 4.446 -16.372 97 HG2 LYS 11 HG2 LYS 11 -6.335 2.431 -16.874 98 HG3 LYS 11 HG1 LYS 11 -7.493 1.468 -15.956 99 HD2 LYS 11 HD2 LYS 11 -9.273 2.131 -17.483 100 HD3 LYS 11 HD1 LYS 11 -8.138 3.138 -18.385 101 HE2 LYS 11 HE2 LYS 11 -6.834 1.156 -18.962 102 HE3 LYS 11 HE1 LYS 11 -7.955 0.146 -18.050 103 HZ1 LYS 11 HZ1 LYS 11 -8.135 0.847 -20.708 104 HZ2 LYS 11 HZ2 LYS 11 -9.345 1.744 -19.939 105 HZ3 LYS 11 HZ3 LYS 11 -9.314 0.060 -19.783 106 H LEU 12 HN LEU 12 -5.298 5.741 -14.653 107 HA LEU 12 HA LEU 12 -7.006 7.457 -12.998 108 HB2 LEU 12 HB2 LEU 12 -4.225 6.962 -12.976 109 HB3 LEU 12 HB1 LEU 12 -4.425 8.603 -13.558 110 HG LEU 12 HG LEU 12 -5.485 7.513 -10.952 111 HD11 LEU 12 HD11 LEU 12 -3.851 9.138 -9.989 112 HD12 LEU 12 HD12 LEU 12 -3.189 9.344 -11.611 113 HD13 LEU 12 HD13 LEU 12 -3.118 7.767 -10.823 114 HD21 LEU 12 HD21 LEU 12 -5.566 10.268 -10.864 115 HD22 LEU 12 HD22 LEU 12 -6.947 9.189 -11.070 116 HD23 LEU 12 HD23 LEU 12 -6.154 9.886 -12.484 117 H TYR 13 HN TYR 13 -8.072 9.119 -14.052 118 HA TYR 13 HA TYR 13 -7.236 9.715 -16.801 119 HB2 TYR 13 HB2 TYR 13 -9.781 10.347 -15.282 120 HB3 TYR 13 HB1 TYR 13 -9.462 10.789 -16.956 121 HD1 TYR 13 HD1 TYR 13 -10.227 8.024 -14.670 122 HD2 TYR 13 HD2 TYR 13 -9.512 9.117 -18.719 123 HE1 TYR 13 HE1 TYR 13 -11.118 5.856 -15.405 124 HE2 TYR 13 HE2 TYR 13 -10.402 6.948 -19.463 125 HH TYR 13 HH TYR 13 -11.500 5.086 -18.834 126 H VAL 14 HN VAL 14 -5.976 11.470 -17.018 127 HA VAL 14 HA VAL 14 -6.282 13.653 -15.056 128 HB VAL 14 HB VAL 14 -3.864 14.102 -15.276 129 HG11 VAL 14 HG11 VAL 14 -4.801 11.469 -14.169 130 HG12 VAL 14 HG12 VAL 14 -4.492 12.979 -13.308 131 HG13 VAL 14 HG13 VAL 14 -3.146 12.037 -13.951 132 HG21 VAL 14 HG21 VAL 14 -2.434 12.218 -16.119 133 HG22 VAL 14 HG22 VAL 14 -3.328 13.087 -17.365 134 HG23 VAL 14 HG23 VAL 14 -3.892 11.510 -16.813 135 H ALA 15 HN ALA 15 -5.498 15.747 -15.820 136 HA ALA 15 HA ALA 15 -5.897 16.031 -18.722 137 HB1 ALA 15 HB1 ALA 15 -7.497 17.556 -18.395 138 HB2 ALA 15 HB2 ALA 15 -6.476 18.459 -17.274 139 HB3 ALA 15 HB3 ALA 15 -7.470 17.125 -16.683 140 H GLY 16 HN GLY 16 -3.862 16.202 -19.459 141 HA2 GLY 16 HA2 GLY 16 -1.802 17.103 -19.865 142 HA3 GLY 16 HA1 GLY 16 -2.435 18.588 -19.173 143 H ASN 17 HN ASN 17 -0.857 19.280 -17.879 144 HA ASN 17 HA ASN 17 0.106 17.429 -15.802 145 HB2 ASN 17 HB2 ASN 17 1.659 19.504 -17.353 146 HB3 ASN 17 HB1 ASN 17 2.232 18.851 -15.824 147 HD21 ASN 17 HD21 ASN 17 3.569 18.653 -18.299 148 HD22 ASN 17 HD22 ASN 17 3.668 16.980 -18.715 149 H THR 18 HN THR 18 -2.139 18.911 -15.377 150 HA THR 18 HA THR 18 -1.571 21.418 -14.131 151 HB THR 18 HB THR 18 -3.857 21.252 -13.197 152 HG1 THR 18 HG1 THR 18 -4.481 18.956 -14.608 153 HG21 THR 18 HG21 THR 18 -5.055 21.363 -15.275 154 HG22 THR 18 HG22 THR 18 -3.802 20.435 -16.100 155 HG23 THR 18 HG23 THR 18 -3.453 22.062 -15.516 156 HA PRO 19 HA PRO 19 -0.010 20.274 -10.211 157 HB2 PRO 19 HB2 PRO 19 -2.198 21.921 -8.991 158 HB3 PRO 19 HB1 PRO 19 -0.457 21.966 -8.688 159 HG2 PRO 19 HG2 PRO 19 -1.556 23.840 -10.187 160 HG3 PRO 19 HG1 PRO 19 -0.013 23.114 -10.678 161 HD2 PRO 19 HD2 PRO 19 -2.771 22.591 -11.728 162 HD3 PRO 19 HD1 PRO 19 -1.238 22.747 -12.613 163 H ASN 20 HN ASN 20 -3.548 20.158 -10.436 164 HA ASN 20 HA ASN 20 -3.924 18.364 -8.257 165 HB2 ASN 20 HB2 ASN 20 -5.693 18.888 -10.677 166 HB3 ASN 20 HB1 ASN 20 -6.128 17.803 -9.367 167 HD21 ASN 20 HD21 ASN 20 -7.593 20.076 -10.106 168 HD22 ASN 20 HD22 ASN 20 -7.562 21.184 -8.782 169 H SER 21 HN SER 21 -3.540 17.853 -11.765 170 HA SER 21 HA SER 21 -3.747 15.008 -11.686 171 HB2 SER 21 HB2 SER 21 -2.488 16.865 -13.717 172 HB3 SER 21 HB1 SER 21 -2.738 15.136 -13.957 173 HG SER 21 HG SER 21 -4.690 17.165 -13.645 174 H VAL 22 HN VAL 22 -0.968 17.218 -11.632 175 HA VAL 22 HA VAL 22 0.953 15.141 -11.669 176 HB VAL 22 HB VAL 22 1.136 18.000 -10.687 177 HG11 VAL 22 HG11 VAL 22 2.811 16.900 -9.453 178 HG12 VAL 22 HG12 VAL 22 3.639 17.618 -10.837 179 HG13 VAL 22 HG13 VAL 22 3.275 15.891 -10.826 180 HG21 VAL 22 HG21 VAL 22 1.795 16.591 -13.237 181 HG22 VAL 22 HG22 VAL 22 2.681 18.047 -12.782 182 HG23 VAL 22 HG23 VAL 22 0.930 18.107 -12.982 183 H ARG 23 HN ARG 23 -0.544 16.947 -9.020 184 HA ARG 23 HA ARG 23 0.887 15.792 -6.890 185 HB2 ARG 23 HB2 ARG 23 -0.577 17.832 -6.815 186 HB3 ARG 23 HB1 ARG 23 -1.969 16.751 -6.887 187 HG2 ARG 23 HG2 ARG 23 -1.520 15.849 -4.781 188 HG3 ARG 23 HG1 ARG 23 0.085 16.581 -4.711 189 HD2 ARG 23 HD2 ARG 23 -0.938 18.801 -4.643 190 HD3 ARG 23 HD1 ARG 23 -2.540 18.070 -4.729 191 HE ARG 23 HE ARG 23 -1.311 16.934 -2.541 192 HH11 ARG 23 HH11 ARG 23 -2.180 20.147 -3.565 193 HH12 ARG 23 HH12 ARG 23 -2.414 20.741 -1.955 194 HH21 ARG 23 HH21 ARG 23 -1.616 17.695 -0.418 195 HH22 ARG 23 HH22 ARG 23 -2.092 19.341 -0.159 196 H ALA 24 HN ALA 24 -2.227 14.967 -8.365 197 HA ALA 24 HA ALA 24 -2.792 12.809 -6.659 198 HB1 ALA 24 HB1 ALA 24 -4.240 14.103 -8.490 199 HB2 ALA 24 HB2 ALA 24 -4.670 12.500 -7.889 200 HB3 ALA 24 HB3 ALA 24 -3.821 12.669 -9.426 201 H LEU 25 HN LEU 25 -1.193 12.989 -9.796 202 HA LEU 25 HA LEU 25 -0.852 10.242 -10.258 203 HB2 LEU 25 HB2 LEU 25 -0.528 11.929 -11.990 204 HB3 LEU 25 HB1 LEU 25 0.853 12.578 -11.128 205 HG LEU 25 HG LEU 25 2.073 10.474 -11.512 206 HD11 LEU 25 HD11 LEU 25 1.022 9.004 -13.370 207 HD12 LEU 25 HD12 LEU 25 -0.504 9.698 -12.822 208 HD13 LEU 25 HD13 LEU 25 0.501 8.781 -11.700 209 HD21 LEU 25 HD21 LEU 25 2.392 12.288 -13.064 210 HD22 LEU 25 HD22 LEU 25 0.958 11.807 -13.973 211 HD23 LEU 25 HD23 LEU 25 2.376 10.762 -13.949 212 H LYS 26 HN LYS 26 1.288 12.576 -8.626 213 HA LYS 26 HA LYS 26 3.377 10.746 -8.112 214 HB2 LYS 26 HB2 LYS 26 2.552 13.240 -6.610 215 HB3 LYS 26 HB1 LYS 26 4.050 12.365 -6.327 216 HG2 LYS 26 HG2 LYS 26 3.268 13.646 -8.938 217 HG3 LYS 26 HG1 LYS 26 4.341 14.363 -7.735 218 HD2 LYS 26 HD2 LYS 26 5.876 12.456 -7.998 219 HD3 LYS 26 HD1 LYS 26 4.809 11.784 -9.234 220 HE2 LYS 26 HE2 LYS 26 5.137 13.789 -10.602 221 HE3 LYS 26 HE1 LYS 26 6.209 14.452 -9.370 222 HZ1 LYS 26 HZ1 LYS 26 6.676 11.984 -10.956 223 HZ2 LYS 26 HZ2 LYS 26 7.686 12.545 -9.720 224 HZ3 LYS 26 HZ3 LYS 26 7.488 13.457 -11.131 225 H THR 27 HN THR 27 0.488 11.641 -6.284 226 HA THR 27 HA THR 27 1.051 10.184 -3.925 227 HB THR 27 HB THR 27 -1.593 11.050 -5.112 228 HG1 THR 27 HG1 THR 27 -0.410 12.869 -4.710 229 HG21 THR 27 HG21 THR 27 -1.911 11.092 -2.413 230 HG22 THR 27 HG22 THR 27 -0.890 9.666 -2.620 231 HG23 THR 27 HG23 THR 27 -2.435 9.774 -3.461 232 H LEU 28 HN LEU 28 -0.834 9.394 -6.839 233 HA LEU 28 HA LEU 28 -1.669 6.839 -5.900 234 HB2 LEU 28 HB2 LEU 28 -1.918 8.424 -8.338 235 HB3 LEU 28 HB1 LEU 28 -1.769 6.709 -8.660 236 HG LEU 28 HG LEU 28 -4.095 7.293 -8.569 237 HD11 LEU 28 HD11 LEU 28 -2.886 5.384 -6.839 238 HD12 LEU 28 HD12 LEU 28 -4.447 5.311 -7.657 239 HD13 LEU 28 HD13 LEU 28 -4.324 6.034 -6.054 240 HD21 LEU 28 HD21 LEU 28 -4.496 9.156 -7.367 241 HD22 LEU 28 HD22 LEU 28 -3.259 8.784 -6.169 242 HD23 LEU 28 HD23 LEU 28 -4.832 7.993 -6.086 243 H ALA 29 HN ALA 29 0.858 7.814 -8.254 244 HA ALA 29 HA ALA 29 1.642 5.213 -8.933 245 HB1 ALA 29 HB1 ALA 29 3.904 6.731 -9.299 246 HB2 ALA 29 HB2 ALA 29 2.598 7.910 -9.409 247 HB3 ALA 29 HB3 ALA 29 2.602 6.498 -10.466 248 H ASN 30 HN ASN 30 2.935 7.370 -6.393 249 HA ASN 30 HA ASN 30 5.110 5.637 -5.751 250 HB2 ASN 30 HB2 ASN 30 4.924 8.095 -5.122 251 HB3 ASN 30 HB1 ASN 30 3.788 7.604 -3.869 252 HD21 ASN 30 HD21 ASN 30 4.946 8.062 -2.087 253 HD22 ASN 30 HD22 ASN 30 6.465 7.339 -1.697 254 H ILE 31 HN ILE 31 1.849 5.950 -4.435 255 HA ILE 31 HA ILE 31 2.212 4.072 -2.391 256 HB ILE 31 HB ILE 31 -0.248 5.111 -3.746 257 HG12 ILE 31 HG12 ILE 31 0.788 5.392 -0.923 258 HG13 ILE 31 HG11 ILE 31 1.141 6.528 -2.220 259 HG21 ILE 31 HG21 ILE 31 -1.684 3.816 -2.549 260 HG22 ILE 31 HG22 ILE 31 -0.519 3.514 -1.258 261 HG23 ILE 31 HG23 ILE 31 -0.379 2.653 -2.790 262 HD11 ILE 31 HD11 ILE 31 -1.656 5.867 -1.406 263 HD12 ILE 31 HD12 ILE 31 -1.070 7.246 -2.337 264 HD13 ILE 31 HD13 ILE 31 -0.712 7.127 -0.615 265 H LEU 32 HN LEU 32 0.975 3.773 -5.684 266 HA LEU 32 HA LEU 32 0.449 0.998 -5.596 267 HB2 LEU 32 HB2 LEU 32 0.830 2.946 -7.847 268 HB3 LEU 32 HB1 LEU 32 0.506 1.246 -8.136 269 HG LEU 32 HG LEU 32 -1.341 2.949 -6.452 270 HD11 LEU 32 HD11 LEU 32 -2.513 3.654 -8.281 271 HD12 LEU 32 HD12 LEU 32 -1.986 2.301 -9.281 272 HD13 LEU 32 HD13 LEU 32 -0.892 3.649 -8.974 273 HD21 LEU 32 HD21 LEU 32 -1.564 0.307 -7.872 274 HD22 LEU 32 HD22 LEU 32 -2.948 1.182 -7.220 275 HD23 LEU 32 HD23 LEU 32 -1.672 0.619 -6.141 276 H GLU 33 HN GLU 33 3.373 2.801 -6.452 277 HA GLU 33 HA GLU 33 4.681 0.419 -7.474 278 HB2 GLU 33 HB2 GLU 33 5.791 3.187 -6.985 279 HB3 GLU 33 HB1 GLU 33 6.645 1.877 -7.789 280 HG2 GLU 33 HG2 GLU 33 4.884 1.870 -9.533 281 HG3 GLU 33 HG1 GLU 33 4.156 3.268 -8.735 282 H LYS 34 HN LYS 34 4.163 1.574 -4.371 283 HA LYS 34 HA LYS 34 6.551 0.118 -3.449 284 HB2 LYS 34 HB2 LYS 34 5.743 2.863 -2.860 285 HB3 LYS 34 HB1 LYS 34 6.040 1.910 -1.411 286 HG2 LYS 34 HG2 LYS 34 8.130 2.742 -1.789 287 HG3 LYS 34 HG1 LYS 34 8.231 1.231 -2.696 288 HD2 LYS 34 HD2 LYS 34 7.323 2.742 -4.656 289 HD3 LYS 34 HD1 LYS 34 8.028 4.036 -3.683 290 HE2 LYS 34 HE2 LYS 34 9.721 3.372 -5.182 291 HE3 LYS 34 HE1 LYS 34 10.148 2.651 -3.630 292 HZ1 LYS 34 HZ1 LYS 34 9.947 0.606 -4.458 293 HZ2 LYS 34 HZ2 LYS 34 9.967 1.325 -5.989 294 HZ3 LYS 34 HZ3 LYS 34 8.488 0.951 -5.251 295 H GLU 35 HN GLU 35 3.563 1.518 -2.110 296 HA GLU 35 HA GLU 35 3.345 -0.331 0.001 297 HB2 GLU 35 HB2 GLU 35 1.355 1.533 -1.292 298 HB3 GLU 35 HB1 GLU 35 0.958 0.541 0.110 299 HG2 GLU 35 HG2 GLU 35 3.118 2.636 -0.024 300 HG3 GLU 35 HG1 GLU 35 1.551 2.809 0.760 301 H PHE 36 HN PHE 36 1.861 -0.301 -3.233 302 HA PHE 36 HA PHE 36 0.955 -3.054 -2.697 303 HB2 PHE 36 HB2 PHE 36 -0.461 -0.879 -4.231 304 HB3 PHE 36 HB1 PHE 36 -0.909 -2.579 -4.346 305 HD1 PHE 36 HD1 PHE 36 -0.895 0.392 -2.221 306 HD2 PHE 36 HD2 PHE 36 -1.941 -3.724 -2.480 307 HE1 PHE 36 HE1 PHE 36 -2.288 0.623 -0.207 308 HE2 PHE 36 HE2 PHE 36 -3.338 -3.499 -0.467 309 HZ PHE 36 HZ PHE 36 -3.511 -1.323 0.673 310 H LYS 37 HN LYS 37 3.465 -2.156 -3.881 311 HA LYS 37 HA LYS 37 3.497 -2.381 -6.667 312 HB2 LYS 37 HB2 LYS 37 5.385 -1.639 -5.131 313 HB3 LYS 37 HB1 LYS 37 5.696 -3.343 -4.833 314 HG2 LYS 37 HG2 LYS 37 5.576 -2.513 -7.665 315 HG3 LYS 37 HG1 LYS 37 6.945 -1.916 -6.724 316 HD2 LYS 37 HD2 LYS 37 7.440 -4.243 -6.044 317 HD3 LYS 37 HD1 LYS 37 6.126 -4.799 -7.083 318 HE2 LYS 37 HE2 LYS 37 7.259 -3.856 -9.029 319 HE3 LYS 37 HE1 LYS 37 8.563 -3.273 -7.996 320 HZ1 LYS 37 HZ1 LYS 37 8.006 -6.097 -7.752 321 HZ2 LYS 37 HZ2 LYS 37 9.488 -5.293 -7.893 322 HZ3 LYS 37 HZ3 LYS 37 8.574 -5.628 -9.277 323 H GLY 38 HN GLY 38 3.257 -4.030 -8.023 324 HA2 GLY 38 HA2 GLY 38 3.509 -6.231 -8.798 325 HA3 GLY 38 HA1 GLY 38 3.827 -6.751 -7.151 326 H VAL 39 HN VAL 39 1.205 -4.936 -6.704 327 HA VAL 39 HA VAL 39 -0.559 -7.242 -7.144 328 HB VAL 39 HB VAL 39 -0.993 -4.974 -5.185 329 HG11 VAL 39 HG11 VAL 39 -2.440 -7.590 -5.594 330 HG12 VAL 39 HG12 VAL 39 -3.083 -5.966 -5.843 331 HG13 VAL 39 HG13 VAL 39 -2.687 -6.518 -4.215 332 HG21 VAL 39 HG21 VAL 39 -0.196 -6.341 -3.452 333 HG22 VAL 39 HG22 VAL 39 0.987 -6.530 -4.749 334 HG23 VAL 39 HG23 VAL 39 -0.218 -7.786 -4.465 335 H TYR 40 HN TYR 40 -0.419 -3.695 -7.464 336 HA TYR 40 HA TYR 40 -2.752 -3.970 -9.213 337 HB2 TYR 40 HB2 TYR 40 -1.927 -1.726 -7.399 338 HB3 TYR 40 HB1 TYR 40 -2.908 -1.368 -8.810 339 HD1 TYR 40 HD1 TYR 40 -2.841 -3.342 -5.665 340 HD2 TYR 40 HD2 TYR 40 -5.211 -1.659 -8.768 341 HE1 TYR 40 HE1 TYR 40 -4.875 -3.821 -4.368 342 HE2 TYR 40 HE2 TYR 40 -7.248 -2.139 -7.485 343 HH TYR 40 HH TYR 40 -7.204 -2.968 -4.229 344 H ALA 41 HN ALA 41 -2.781 -3.033 -11.214 345 HA ALA 41 HA ALA 41 -0.193 -2.043 -12.204 346 HB1 ALA 41 HB1 ALA 41 -1.412 -4.064 -13.254 347 HB2 ALA 41 HB2 ALA 41 -0.784 -2.817 -14.333 348 HB3 ALA 41 HB3 ALA 41 -2.503 -2.860 -13.944 349 H LEU 42 HN LEU 42 -0.023 0.094 -12.682 350 HA LEU 42 HA LEU 42 -2.471 1.678 -12.569 351 HB2 LEU 42 HB2 LEU 42 -0.730 2.388 -11.065 352 HB3 LEU 42 HB1 LEU 42 0.430 2.477 -12.376 353 HG LEU 42 HG LEU 42 -0.864 4.345 -13.367 354 HD11 LEU 42 HD11 LEU 42 -2.571 3.924 -10.935 355 HD12 LEU 42 HD12 LEU 42 -3.062 4.045 -12.624 356 HD13 LEU 42 HD13 LEU 42 -2.495 5.479 -11.767 357 HD21 LEU 42 HD21 LEU 42 0.887 4.399 -11.249 358 HD22 LEU 42 HD22 LEU 42 -0.443 5.416 -10.698 359 HD23 LEU 42 HD23 LEU 42 0.379 5.785 -12.213 360 H LYS 43 HN LYS 43 -3.378 2.565 -14.233 361 HA LYS 43 HA LYS 43 -1.820 2.996 -16.698 362 HB2 LYS 43 HB2 LYS 43 -4.315 1.539 -16.275 363 HB3 LYS 43 HB1 LYS 43 -4.502 2.839 -17.443 364 HG2 LYS 43 HG2 LYS 43 -3.977 0.872 -18.647 365 HG3 LYS 43 HG1 LYS 43 -2.544 1.900 -18.677 366 HD2 LYS 43 HD2 LYS 43 -1.498 0.578 -16.957 367 HD3 LYS 43 HD1 LYS 43 -2.968 -0.380 -16.752 368 HE2 LYS 43 HE2 LYS 43 -2.754 -1.204 -19.040 369 HE3 LYS 43 HE1 LYS 43 -1.295 -0.239 -19.257 370 HZ1 LYS 43 HZ1 LYS 43 -0.359 -1.534 -17.329 371 HZ2 LYS 43 HZ2 LYS 43 -0.584 -2.408 -18.759 372 HZ3 LYS 43 HZ3 LYS 43 -1.680 -2.579 -17.483 373 H VAL 44 HN VAL 44 -2.015 4.971 -17.634 374 HA VAL 44 HA VAL 44 -3.839 6.909 -16.332 375 HB VAL 44 HB VAL 44 -1.650 7.514 -15.633 376 HG11 VAL 44 HG11 VAL 44 -0.861 6.845 -18.416 377 HG12 VAL 44 HG12 VAL 44 -0.089 6.419 -16.888 378 HG13 VAL 44 HG13 VAL 44 0.076 8.052 -17.534 379 HG21 VAL 44 HG21 VAL 44 -1.357 9.707 -16.541 380 HG22 VAL 44 HG22 VAL 44 -3.084 9.356 -16.457 381 HG23 VAL 44 HG23 VAL 44 -2.238 9.264 -18.003 382 H ILE 45 HN ILE 45 -5.136 8.018 -17.503 383 HA ILE 45 HA ILE 45 -4.894 7.812 -20.422 384 HB ILE 45 HB ILE 45 -7.372 8.232 -18.754 385 HG12 ILE 45 HG12 ILE 45 -6.465 6.026 -18.293 386 HG13 ILE 45 HG11 ILE 45 -7.941 5.882 -19.238 387 HG21 ILE 45 HG21 ILE 45 -8.646 7.862 -20.740 388 HG22 ILE 45 HG22 ILE 45 -7.202 7.395 -21.644 389 HG23 ILE 45 HG23 ILE 45 -7.411 9.066 -21.122 390 HD11 ILE 45 HD11 ILE 45 -5.152 5.684 -20.348 391 HD12 ILE 45 HD12 ILE 45 -6.658 5.414 -21.224 392 HD13 ILE 45 HD13 ILE 45 -6.182 4.317 -19.927 393 H ASP 46 HN ASP 46 -3.931 9.728 -20.975 394 HA ASP 46 HA ASP 46 -4.507 12.209 -19.656 395 HB2 ASP 46 HB2 ASP 46 -2.332 11.672 -20.792 396 HB3 ASP 46 HB1 ASP 46 -3.166 11.799 -22.336 397 H VAL 47 HN VAL 47 -6.572 12.928 -19.850 398 HA VAL 47 HA VAL 47 -8.214 12.418 -22.097 399 HB VAL 47 HB VAL 47 -9.871 13.845 -21.051 400 HG11 VAL 47 HG11 VAL 47 -10.225 11.979 -19.886 401 HG12 VAL 47 HG12 VAL 47 -9.322 12.732 -18.573 402 HG13 VAL 47 HG13 VAL 47 -8.496 11.669 -19.714 403 HG21 VAL 47 HG21 VAL 47 -8.276 15.620 -20.305 404 HG22 VAL 47 HG22 VAL 47 -7.798 14.556 -18.981 405 HG23 VAL 47 HG23 VAL 47 -9.458 15.143 -19.087 406 H LEU 48 HN LEU 48 -6.198 15.213 -21.289 407 HA LEU 48 HA LEU 48 -7.362 16.906 -23.269 408 HB2 LEU 48 HB2 LEU 48 -4.731 17.074 -21.819 409 HB3 LEU 48 HB1 LEU 48 -5.240 18.259 -23.005 410 HG LEU 48 HG LEU 48 -6.728 17.620 -20.455 411 HD11 LEU 48 HD11 LEU 48 -4.653 18.705 -19.925 412 HD12 LEU 48 HD12 LEU 48 -5.963 19.873 -19.759 413 HD13 LEU 48 HD13 LEU 48 -4.915 19.916 -21.179 414 HD21 LEU 48 HD21 LEU 48 -7.292 19.349 -22.799 415 HD22 LEU 48 HD22 LEU 48 -7.691 19.981 -21.202 416 HD23 LEU 48 HD23 LEU 48 -8.398 18.462 -21.751 417 H LYS 49 HN LYS 49 -4.671 14.661 -23.267 418 HA LYS 49 HA LYS 49 -3.648 15.404 -25.819 419 HB2 LYS 49 HB2 LYS 49 -2.339 14.196 -24.087 420 HB3 LYS 49 HB1 LYS 49 -3.347 12.780 -24.354 421 HG2 LYS 49 HG2 LYS 49 -2.515 12.496 -26.558 422 HG3 LYS 49 HG1 LYS 49 -1.703 14.064 -26.519 423 HD2 LYS 49 HD2 LYS 49 -0.019 12.438 -26.162 424 HD3 LYS 49 HD1 LYS 49 -0.342 13.174 -24.591 425 HE2 LYS 49 HE2 LYS 49 -0.159 10.795 -24.306 426 HE3 LYS 49 HE1 LYS 49 -1.838 11.270 -24.059 427 HZ1 LYS 49 HZ1 LYS 49 -2.520 10.135 -25.862 428 HZ2 LYS 49 HZ2 LYS 49 -1.084 9.262 -25.637 429 HZ3 LYS 49 HZ3 LYS 49 -1.139 10.515 -26.770 430 H ASN 50 HN ASN 50 -5.918 12.940 -24.692 431 HA ASN 50 HA ASN 50 -6.729 12.543 -27.495 432 HB2 ASN 50 HB2 ASN 50 -6.576 10.424 -25.341 433 HB3 ASN 50 HB1 ASN 50 -7.255 10.183 -26.946 434 HD21 ASN 50 HD21 ASN 50 -5.654 10.956 -28.731 435 HD22 ASN 50 HD22 ASN 50 -4.042 10.364 -28.559 436 HA PRO 51 HA PRO 51 -10.312 14.183 -25.149 437 HB2 PRO 51 HB2 PRO 51 -10.975 14.962 -27.942 438 HB3 PRO 51 HB1 PRO 51 -11.012 15.935 -26.466 439 HG2 PRO 51 HG2 PRO 51 -9.063 16.297 -28.225 440 HG3 PRO 51 HG1 PRO 51 -8.696 16.282 -26.490 441 HD2 PRO 51 HD2 PRO 51 -8.341 14.100 -28.514 442 HD3 PRO 51 HD1 PRO 51 -7.211 14.669 -27.262 443 H GLN 52 HN GLN 52 -10.121 12.295 -28.099 444 HA GLN 52 HA GLN 52 -12.813 11.473 -28.269 445 HB2 GLN 52 HB2 GLN 52 -10.263 10.145 -29.207 446 HB3 GLN 52 HB1 GLN 52 -11.871 9.559 -29.605 447 HG2 GLN 52 HG2 GLN 52 -11.523 10.791 -31.459 448 HG3 GLN 52 HG1 GLN 52 -12.132 12.085 -30.430 449 HE21 GLN 52 HE21 GLN 52 -10.453 12.420 -32.686 450 HE22 GLN 52 HE22 GLN 52 -8.961 13.092 -32.137 451 H LEU 53 HN LEU 53 -10.022 10.147 -26.583 452 HA LEU 53 HA LEU 53 -11.400 7.789 -25.779 453 HB2 LEU 53 HB2 LEU 53 -8.825 9.034 -24.823 454 HB3 LEU 53 HB1 LEU 53 -9.450 7.523 -24.183 455 HG LEU 53 HG LEU 53 -8.824 7.980 -27.098 456 HD11 LEU 53 HD11 LEU 53 -6.791 8.125 -25.721 457 HD12 LEU 53 HD12 LEU 53 -6.805 6.683 -26.736 458 HD13 LEU 53 HD13 LEU 53 -7.171 6.555 -25.015 459 HD21 LEU 53 HD21 LEU 53 -9.972 5.770 -25.537 460 HD22 LEU 53 HD22 LEU 53 -8.718 5.317 -26.693 461 HD23 LEU 53 HD23 LEU 53 -10.156 6.182 -27.243 462 H ALA 54 HN ALA 54 -10.846 10.974 -24.406 463 HA ALA 54 HA ALA 54 -11.794 10.444 -21.799 464 HB1 ALA 54 HB1 ALA 54 -11.802 12.756 -21.471 465 HB2 ALA 54 HB2 ALA 54 -12.090 13.088 -23.180 466 HB3 ALA 54 HB3 ALA 54 -10.516 12.497 -22.651 467 H GLU 55 HN GLU 55 -13.310 11.518 -24.783 468 HA GLU 55 HA GLU 55 -15.942 11.850 -23.750 469 HB2 GLU 55 HB2 GLU 55 -15.167 12.877 -25.872 470 HB3 GLU 55 HB1 GLU 55 -15.073 11.275 -26.591 471 HG2 GLU 55 HG2 GLU 55 -17.475 10.989 -26.310 472 HG3 GLU 55 HG1 GLU 55 -17.583 12.573 -25.548 473 H GLU 56 HN GLU 56 -14.219 9.136 -25.195 474 HA GLU 56 HA GLU 56 -16.411 7.410 -25.511 475 HB2 GLU 56 HB2 GLU 56 -13.499 6.795 -24.961 476 HB3 GLU 56 HB1 GLU 56 -14.692 5.568 -25.358 477 HG2 GLU 56 HG2 GLU 56 -15.093 6.737 -27.516 478 HG3 GLU 56 HG1 GLU 56 -13.777 7.849 -27.111 479 H ASP 57 HN ASP 57 -14.274 7.963 -22.713 480 HA ASP 57 HA ASP 57 -15.993 6.182 -21.155 481 HB2 ASP 57 HB2 ASP 57 -13.292 7.424 -20.549 482 HB3 ASP 57 HB1 ASP 57 -14.239 6.588 -19.322 483 H LYS 58 HN LYS 58 -16.341 9.133 -22.084 484 HA LYS 58 HA LYS 58 -17.370 11.014 -21.362 485 HB2 LYS 58 HB2 LYS 58 -18.684 9.014 -19.528 486 HB3 LYS 58 HB1 LYS 58 -19.266 10.651 -19.798 487 HG2 LYS 58 HG2 LYS 58 -19.519 10.123 -22.206 488 HG3 LYS 58 HG1 LYS 58 -19.042 8.460 -21.854 489 HD2 LYS 58 HD2 LYS 58 -21.401 9.845 -20.582 490 HD3 LYS 58 HD1 LYS 58 -21.513 8.816 -22.011 491 HE2 LYS 58 HE2 LYS 58 -20.480 7.958 -19.308 492 HE3 LYS 58 HE1 LYS 58 -22.085 7.610 -19.946 493 HZ1 LYS 58 HZ1 LYS 58 -19.600 6.295 -20.464 494 HZ2 LYS 58 HZ2 LYS 58 -20.389 6.739 -21.894 495 HZ3 LYS 58 HZ3 LYS 58 -21.181 5.767 -20.759 496 H ILE 59 HN ILE 59 -14.933 11.113 -20.376 497 HA ILE 59 HA ILE 59 -14.995 11.494 -17.496 498 HB ILE 59 HB ILE 59 -12.773 12.035 -19.475 499 HG12 ILE 59 HG12 ILE 59 -13.401 9.681 -19.474 500 HG13 ILE 59 HG11 ILE 59 -11.838 9.890 -18.694 501 HG21 ILE 59 HG21 ILE 59 -11.291 12.082 -17.567 502 HG22 ILE 59 HG22 ILE 59 -12.631 11.735 -16.474 503 HG23 ILE 59 HG23 ILE 59 -12.572 13.271 -17.340 504 HD11 ILE 59 HD11 ILE 59 -14.428 9.028 -17.564 505 HD12 ILE 59 HD12 ILE 59 -13.375 9.998 -16.533 506 HD13 ILE 59 HD13 ILE 59 -12.789 8.478 -17.209 507 H LEU 60 HN LEU 60 -15.958 13.287 -16.768 508 HA LEU 60 HA LEU 60 -15.613 15.792 -18.265 509 HB2 LEU 60 HB2 LEU 60 -17.645 15.076 -16.151 510 HB3 LEU 60 HB1 LEU 60 -17.557 16.609 -16.996 511 HG LEU 60 HG LEU 60 -18.134 13.939 -18.289 512 HD11 LEU 60 HD11 LEU 60 -19.959 16.260 -17.676 513 HD12 LEU 60 HD12 LEU 60 -19.965 14.694 -16.865 514 HD13 LEU 60 HD13 LEU 60 -20.399 14.804 -18.570 515 HD21 LEU 60 HD21 LEU 60 -17.139 15.209 -19.962 516 HD22 LEU 60 HD22 LEU 60 -17.822 16.719 -19.360 517 HD23 LEU 60 HD23 LEU 60 -18.857 15.546 -20.174 518 H ALA 61 HN ALA 61 -14.351 14.233 -15.600 519 HA ALA 61 HA ALA 61 -13.332 16.764 -14.553 520 HB1 ALA 61 HB1 ALA 61 -14.227 14.739 -12.549 521 HB2 ALA 61 HB2 ALA 61 -15.408 15.847 -13.248 522 HB3 ALA 61 HB3 ALA 61 -14.016 16.481 -12.372 523 H THR 62 HN THR 62 -11.284 16.632 -13.708 524 HA THR 62 HA THR 62 -9.999 14.018 -13.500 525 HB THR 62 HB THR 62 -7.975 14.939 -14.621 526 HG1 THR 62 HG1 THR 62 -8.938 17.214 -14.273 527 HG21 THR 62 HG21 THR 62 -10.438 15.019 -16.367 528 HG22 THR 62 HG22 THR 62 -9.539 13.567 -15.923 529 HG23 THR 62 HG23 THR 62 -8.774 14.808 -16.922 530 HA PRO 63 HA PRO 63 -7.958 13.352 -13.089 531 HB2 PRO 63 HB2 PRO 63 -6.911 12.113 -10.949 532 HB3 PRO 63 HB1 PRO 63 -6.016 13.318 -11.882 533 HG2 PRO 63 HG2 PRO 63 -7.422 13.603 -9.268 534 HG3 PRO 63 HG1 PRO 63 -5.873 14.285 -9.798 535 HD2 PRO 63 HD2 PRO 63 -8.238 15.684 -9.738 536 HD3 PRO 63 HD1 PRO 63 -6.871 16.077 -10.801 537 H THR 64 HN THR 64 -8.831 11.301 -13.050 538 HA THR 64 HA THR 64 -11.052 10.846 -11.157 539 HB THR 64 HB THR 64 -11.327 9.370 -13.646 540 HG1 THR 64 HG1 THR 64 -11.726 12.158 -13.950 541 HG21 THR 64 HG21 THR 64 -13.003 11.049 -11.855 542 HG22 THR 64 HG22 THR 64 -13.276 9.412 -12.459 543 HG23 THR 64 HG23 THR 64 -13.560 10.801 -13.511 544 H LEU 65 HN LEU 65 -10.957 8.980 -10.052 545 HA LEU 65 HA LEU 65 -8.905 7.008 -10.812 546 HB2 LEU 65 HB2 LEU 65 -10.293 7.594 -8.202 547 HB3 LEU 65 HB1 LEU 65 -9.318 6.162 -8.457 548 HG LEU 65 HG LEU 65 -8.240 8.962 -8.745 549 HD11 LEU 65 HD11 LEU 65 -8.041 7.105 -6.374 550 HD12 LEU 65 HD12 LEU 65 -9.052 8.549 -6.450 551 HD13 LEU 65 HD13 LEU 65 -7.296 8.695 -6.530 552 HD21 LEU 65 HD21 LEU 65 -6.582 6.595 -8.094 553 HD22 LEU 65 HD22 LEU 65 -6.199 8.015 -9.064 554 HD23 LEU 65 HD23 LEU 65 -7.192 6.725 -9.742 555 H ALA 66 HN ALA 66 -9.628 5.239 -11.833 556 HA ALA 66 HA ALA 66 -12.126 4.028 -10.888 557 HB1 ALA 66 HB1 ALA 66 -12.260 5.544 -13.117 558 HB2 ALA 66 HB2 ALA 66 -13.255 4.111 -12.851 559 HB3 ALA 66 HB3 ALA 66 -11.789 3.996 -13.824 560 H LYS 67 HN LYS 67 -12.076 1.971 -10.698 561 HA LYS 67 HA LYS 67 -9.697 0.526 -11.578 562 HB2 LYS 67 HB2 LYS 67 -10.262 0.207 -9.255 563 HB3 LYS 67 HB1 LYS 67 -11.938 -0.127 -9.652 564 HG2 LYS 67 HG2 LYS 67 -11.086 -2.174 -10.892 565 HG3 LYS 67 HG1 LYS 67 -9.543 -1.883 -10.086 566 HD2 LYS 67 HD2 LYS 67 -11.883 -1.855 -8.310 567 HD3 LYS 67 HD1 LYS 67 -11.564 -3.407 -9.082 568 HE2 LYS 67 HE2 LYS 67 -9.210 -3.243 -8.274 569 HE3 LYS 67 HE1 LYS 67 -9.666 -1.798 -7.376 570 HZ1 LYS 67 HZ1 LYS 67 -9.698 -3.848 -6.032 571 HZ2 LYS 67 HZ2 LYS 67 -10.936 -4.455 -7.015 572 HZ3 LYS 67 HZ3 LYS 67 -11.202 -3.070 -6.082 573 H VAL 68 HN VAL 68 -9.964 -0.137 -13.664 574 HA VAL 68 HA VAL 68 -12.579 -0.832 -14.644 575 HB VAL 68 HB VAL 68 -11.437 -1.311 -16.778 576 HG11 VAL 68 HG11 VAL 68 -12.180 0.999 -15.979 577 HG12 VAL 68 HG12 VAL 68 -11.064 0.927 -17.343 578 HG13 VAL 68 HG13 VAL 68 -10.465 1.324 -15.732 579 HG21 VAL 68 HG21 VAL 68 -9.206 -1.477 -17.034 580 HG22 VAL 68 HG22 VAL 68 -9.209 -1.782 -15.297 581 HG23 VAL 68 HG23 VAL 68 -8.881 -0.161 -15.906 582 H LEU 69 HN LEU 69 -9.791 -2.497 -13.408 583 HA LEU 69 HA LEU 69 -11.280 -5.023 -13.701 584 HB2 LEU 69 HB2 LEU 69 -8.363 -4.667 -14.405 585 HB3 LEU 69 HB1 LEU 69 -9.172 -6.213 -14.276 586 HG LEU 69 HG LEU 69 -9.938 -4.075 -16.267 587 HD11 LEU 69 HD11 LEU 69 -8.903 -6.086 -17.741 588 HD12 LEU 69 HD12 LEU 69 -7.861 -6.160 -16.321 589 HD13 LEU 69 HD13 LEU 69 -7.994 -4.661 -17.239 590 HD21 LEU 69 HD21 LEU 69 -11.781 -5.519 -15.832 591 HD22 LEU 69 HD22 LEU 69 -10.754 -6.952 -15.901 592 HD23 LEU 69 HD23 LEU 69 -11.072 -6.021 -17.365 593 HA PRO 70 HA PRO 70 -11.168 -7.103 -13.026 594 HB2 PRO 70 HB2 PRO 70 -12.356 -7.971 -10.498 595 HB3 PRO 70 HB1 PRO 70 -11.378 -8.893 -11.642 596 HG2 PRO 70 HG2 PRO 70 -10.450 -8.199 -9.209 597 HG3 PRO 70 HG1 PRO 70 -9.390 -8.295 -10.627 598 HD2 PRO 70 HD2 PRO 70 -10.653 -5.872 -9.373 599 HD3 PRO 70 HD1 PRO 70 -8.977 -6.106 -9.922 600 HA PRO 71 HA PRO 71 -15.033 -4.893 -13.307 601 HB2 PRO 71 HB2 PRO 71 -16.225 -7.527 -13.994 602 HB3 PRO 71 HB1 PRO 71 -16.248 -6.013 -14.906 603 HG2 PRO 71 HG2 PRO 71 -14.694 -8.013 -15.690 604 HG3 PRO 71 HG1 PRO 71 -14.104 -6.340 -15.753 605 HD2 PRO 71 HD2 PRO 71 -13.523 -8.476 -13.729 606 HD3 PRO 71 HD1 PRO 71 -12.416 -7.317 -14.491 607 HA PRO 72 HA PRO 72 -17.276 -4.397 -13.359 608 HB2 PRO 72 HB2 PRO 72 -18.787 -2.789 -11.844 609 HB3 PRO 72 HB1 PRO 72 -19.364 -4.380 -12.361 610 HG2 PRO 72 HG2 PRO 72 -18.170 -3.565 -9.732 611 HG3 PRO 72 HG1 PRO 72 -19.606 -4.558 -10.044 612 HD2 PRO 72 HD2 PRO 72 -17.165 -5.613 -9.449 613 HD3 PRO 72 HD1 PRO 72 -18.362 -6.448 -10.457 614 H VAL 73 HN VAL 73 -17.101 -2.017 -13.586 615 HA VAL 73 HA VAL 73 -14.548 -1.114 -12.684 616 HB VAL 73 HB VAL 73 -16.718 0.379 -14.175 617 HG11 VAL 73 HG11 VAL 73 -14.734 1.794 -14.921 618 HG12 VAL 73 HG12 VAL 73 -13.858 1.079 -13.568 619 HG13 VAL 73 HG13 VAL 73 -15.312 2.032 -13.272 620 HG21 VAL 73 HG21 VAL 73 -14.540 -0.187 -15.851 621 HG22 VAL 73 HG22 VAL 73 -16.160 -0.880 -15.919 622 HG23 VAL 73 HG23 VAL 73 -14.896 -1.684 -14.988 623 H ARG 74 HN ARG 74 -14.060 0.023 -10.935 624 HA ARG 74 HA ARG 74 -16.243 1.261 -9.386 625 HB2 ARG 74 HB2 ARG 74 -15.205 -0.470 -8.106 626 HB3 ARG 74 HB1 ARG 74 -13.597 0.085 -8.540 627 HG2 ARG 74 HG2 ARG 74 -14.062 0.662 -6.257 628 HG3 ARG 74 HG1 ARG 74 -13.971 2.133 -7.227 629 HD2 ARG 74 HD2 ARG 74 -15.834 2.294 -5.704 630 HD3 ARG 74 HD1 ARG 74 -16.440 2.160 -7.353 631 HE ARG 74 HE ARG 74 -16.294 -0.395 -6.153 632 HH11 ARG 74 HH11 ARG 74 -18.149 2.551 -6.085 633 HH12 ARG 74 HH12 ARG 74 -19.612 1.775 -5.578 634 HH21 ARG 74 HH21 ARG 74 -18.209 -1.433 -5.484 635 HH22 ARG 74 HH22 ARG 74 -19.646 -0.498 -5.235 636 H ARG 75 HN ARG 75 -16.335 3.388 -9.416 637 HA ARG 75 HA ARG 75 -13.906 4.874 -10.101 638 HB2 ARG 75 HB2 ARG 75 -16.819 5.573 -10.316 639 HB3 ARG 75 HB1 ARG 75 -15.555 6.788 -10.426 640 HG2 ARG 75 HG2 ARG 75 -14.578 5.591 -12.323 641 HG3 ARG 75 HG1 ARG 75 -15.891 4.411 -12.238 642 HD2 ARG 75 HD2 ARG 75 -16.314 7.365 -12.610 643 HD3 ARG 75 HD1 ARG 75 -16.166 6.233 -13.950 644 HE ARG 75 HE ARG 75 -18.201 5.181 -13.200 645 HH11 ARG 75 HH11 ARG 75 -17.467 8.261 -11.736 646 HH12 ARG 75 HH12 ARG 75 -19.101 8.566 -11.252 647 HH21 ARG 75 HH21 ARG 75 -20.351 5.573 -12.568 648 HH22 ARG 75 HH22 ARG 75 -20.743 7.034 -11.725 649 H ILE 76 HN ILE 76 -12.868 5.887 -8.607 650 HA ILE 76 HA ILE 76 -14.168 6.464 -6.035 651 HB ILE 76 HB ILE 76 -11.229 6.371 -6.720 652 HG12 ILE 76 HG12 ILE 76 -12.905 4.411 -5.137 653 HG13 ILE 76 HG11 ILE 76 -12.429 4.180 -6.817 654 HG21 ILE 76 HG21 ILE 76 -11.164 7.697 -4.876 655 HG22 ILE 76 HG22 ILE 76 -11.301 6.142 -4.053 656 HG23 ILE 76 HG23 ILE 76 -12.733 7.145 -4.289 657 HD11 ILE 76 HD11 ILE 76 -11.077 3.104 -4.863 658 HD12 ILE 76 HD12 ILE 76 -10.321 4.696 -4.806 659 HD13 ILE 76 HD13 ILE 76 -10.265 3.747 -6.290 660 H ILE 77 HN ILE 77 -14.865 8.525 -5.816 661 HA ILE 77 HA ILE 77 -13.303 10.662 -7.108 662 HB ILE 77 HB ILE 77 -16.272 10.758 -6.601 663 HG12 ILE 77 HG12 ILE 77 -15.833 10.763 -9.358 664 HG13 ILE 77 HG11 ILE 77 -14.769 9.501 -8.748 665 HG21 ILE 77 HG21 ILE 77 -14.825 12.890 -6.772 666 HG22 ILE 77 HG22 ILE 77 -16.302 12.788 -7.731 667 HG23 ILE 77 HG23 ILE 77 -14.736 12.502 -8.492 668 HD11 ILE 77 HD11 ILE 77 -17.712 9.681 -8.161 669 HD12 ILE 77 HD12 ILE 77 -16.618 8.369 -7.724 670 HD13 ILE 77 HD13 ILE 77 -16.990 8.678 -9.420 671 H GLY 78 HN GLY 78 -12.511 12.182 -5.787 672 HA2 GLY 78 HA2 GLY 78 -13.711 13.452 -3.681 673 HA3 GLY 78 HA1 GLY 78 -12.980 12.022 -2.962 674 H ASP 79 HN ASP 79 -11.645 13.537 -1.741 675 HA ASP 79 HA ASP 79 -9.716 15.119 -3.204 676 HB2 ASP 79 HB2 ASP 79 -10.590 15.886 -1.015 677 HB3 ASP 79 HB1 ASP 79 -9.857 14.482 -0.244 678 H LEU 80 HN LEU 80 -8.439 13.788 -4.390 679 HA LEU 80 HA LEU 80 -7.246 11.446 -3.157 680 HB2 LEU 80 HB2 LEU 80 -6.153 11.648 -5.684 681 HB3 LEU 80 HB1 LEU 80 -7.540 10.679 -5.228 682 HG LEU 80 HG LEU 80 -8.979 12.703 -5.797 683 HD11 LEU 80 HD11 LEU 80 -8.095 14.445 -7.107 684 HD12 LEU 80 HD12 LEU 80 -6.567 13.598 -7.350 685 HD13 LEU 80 HD13 LEU 80 -6.963 14.259 -5.767 686 HD21 LEU 80 HD21 LEU 80 -7.385 11.387 -7.991 687 HD22 LEU 80 HD22 LEU 80 -8.929 12.216 -8.193 688 HD23 LEU 80 HD23 LEU 80 -8.839 10.743 -7.228 689 H SER 81 HN SER 81 -6.430 14.666 -3.320 690 HA SER 81 HA SER 81 -3.648 14.484 -3.851 691 HB2 SER 81 HB2 SER 81 -3.504 16.741 -2.917 692 HB3 SER 81 HB1 SER 81 -4.895 16.613 -3.992 693 HG SER 81 HG SER 81 -6.092 17.169 -2.361 694 H ASN 82 HN ASN 82 -5.562 13.703 -1.135 695 HA ASN 82 HA ASN 82 -3.364 13.762 0.755 696 HB2 ASN 82 HB2 ASN 82 -5.660 14.342 1.478 697 HB3 ASN 82 HB1 ASN 82 -6.179 12.715 1.068 698 HD21 ASN 82 HD21 ASN 82 -6.822 13.184 3.453 699 HD22 ASN 82 HD22 ASN 82 -5.717 12.572 4.634 700 H ARG 83 HN ARG 83 -1.970 12.160 0.938 701 HA ARG 83 HA ARG 83 -2.102 9.837 -0.587 702 HB2 ARG 83 HB2 ARG 83 -0.407 10.498 1.828 703 HB3 ARG 83 HB1 ARG 83 -0.210 9.010 0.915 704 HG2 ARG 83 HG2 ARG 83 0.190 10.424 -1.121 705 HG3 ARG 83 HG1 ARG 83 0.230 11.823 -0.048 706 HD2 ARG 83 HD2 ARG 83 2.022 9.410 0.191 707 HD3 ARG 83 HD1 ARG 83 2.479 10.931 -0.573 708 HE ARG 83 HE ARG 83 2.196 10.414 2.270 709 HH11 ARG 83 HH11 ARG 83 2.568 12.783 -0.261 710 HH12 ARG 83 HH12 ARG 83 3.162 14.016 0.802 711 HH21 ARG 83 HH21 ARG 83 2.975 12.026 3.676 712 HH22 ARG 83 HH22 ARG 83 3.395 13.583 3.046 713 H GLU 84 HN GLU 84 -3.113 10.387 2.753 714 HA GLU 84 HA GLU 84 -3.487 7.696 3.492 715 HB2 GLU 84 HB2 GLU 84 -4.790 10.241 4.408 716 HB3 GLU 84 HB1 GLU 84 -5.208 8.671 5.085 717 HG2 GLU 84 HG2 GLU 84 -3.012 8.337 5.895 718 HG3 GLU 84 HG1 GLU 84 -2.401 9.739 5.015 719 H LYS 85 HN LYS 85 -5.790 9.949 1.902 720 HA LYS 85 HA LYS 85 -7.885 8.038 1.936 721 HB2 LYS 85 HB2 LYS 85 -7.443 10.477 0.206 722 HB3 LYS 85 HB1 LYS 85 -8.864 9.451 0.042 723 HG2 LYS 85 HG2 LYS 85 -9.482 9.935 2.355 724 HG3 LYS 85 HG1 LYS 85 -8.062 10.967 2.521 725 HD2 LYS 85 HD2 LYS 85 -8.923 12.374 0.665 726 HD3 LYS 85 HD1 LYS 85 -10.365 11.363 0.610 727 HE2 LYS 85 HE2 LYS 85 -9.451 12.962 3.000 728 HE3 LYS 85 HE1 LYS 85 -10.730 13.438 1.883 729 HZ1 LYS 85 HZ1 LYS 85 -11.560 11.009 2.593 730 HZ2 LYS 85 HZ2 LYS 85 -12.022 12.424 3.397 731 HZ3 LYS 85 HZ3 LYS 85 -10.769 11.473 4.016 732 H VAL 86 HN VAL 86 -5.389 8.769 -0.441 733 HA VAL 86 HA VAL 86 -6.296 6.984 -2.422 734 HB VAL 86 HB VAL 86 -3.497 7.982 -1.826 735 HG11 VAL 86 HG11 VAL 86 -4.476 6.005 -3.792 736 HG12 VAL 86 HG12 VAL 86 -2.872 6.213 -3.091 737 HG13 VAL 86 HG13 VAL 86 -3.398 7.254 -4.412 738 HG21 VAL 86 HG21 VAL 86 -4.282 9.047 -4.194 739 HG22 VAL 86 HG22 VAL 86 -4.473 9.843 -2.631 740 HG23 VAL 86 HG23 VAL 86 -5.822 8.955 -3.339 741 H LEU 87 HN LEU 87 -4.100 6.532 0.322 742 HA LEU 87 HA LEU 87 -3.497 3.803 -0.237 743 HB2 LEU 87 HB2 LEU 87 -2.906 5.759 1.816 744 HB3 LEU 87 HB1 LEU 87 -3.263 4.196 2.525 745 HG LEU 87 HG LEU 87 -1.203 4.583 0.365 746 HD11 LEU 87 HD11 LEU 87 -0.166 4.069 3.015 747 HD12 LEU 87 HD12 LEU 87 -1.067 5.586 2.959 748 HD13 LEU 87 HD13 LEU 87 0.283 5.317 1.852 749 HD21 LEU 87 HD21 LEU 87 -1.025 2.388 2.316 750 HD22 LEU 87 HD22 LEU 87 -0.768 2.378 0.572 751 HD23 LEU 87 HD23 LEU 87 -2.407 2.300 1.221 752 H ILE 88 HN ILE 88 -5.796 5.318 2.015 753 HA ILE 88 HA ILE 88 -6.753 2.911 3.108 754 HB ILE 88 HB ILE 88 -7.979 5.650 2.915 755 HG12 ILE 88 HG12 ILE 88 -6.953 4.130 5.315 756 HG13 ILE 88 HG11 ILE 88 -5.915 5.144 4.322 757 HG21 ILE 88 HG21 ILE 88 -9.772 3.942 3.009 758 HG22 ILE 88 HG22 ILE 88 -9.704 4.950 4.456 759 HG23 ILE 88 HG23 ILE 88 -9.053 3.311 4.492 760 HD11 ILE 88 HD11 ILE 88 -7.750 5.871 6.418 761 HD12 ILE 88 HD12 ILE 88 -8.064 6.768 4.934 762 HD13 ILE 88 HD13 ILE 88 -6.457 6.810 5.665 763 H ALA 89 HN ALA 89 -8.037 4.882 0.411 764 HA ALA 89 HA ALA 89 -10.247 3.197 -0.115 765 HB1 ALA 89 HB1 ALA 89 -9.187 5.585 -1.185 766 HB2 ALA 89 HB2 ALA 89 -10.759 4.850 -1.503 767 HB3 ALA 89 HB3 ALA 89 -9.376 4.452 -2.524 768 H LEU 90 HN LEU 90 -6.952 3.237 -1.408 769 HA LEU 90 HA LEU 90 -7.377 1.180 -3.321 770 HB2 LEU 90 HB2 LEU 90 -5.491 2.776 -3.448 771 HB3 LEU 90 HB1 LEU 90 -4.800 2.057 -2.006 772 HG LEU 90 HG LEU 90 -4.528 -0.076 -3.224 773 HD11 LEU 90 HD11 LEU 90 -4.674 0.595 -5.876 774 HD12 LEU 90 HD12 LEU 90 -6.106 1.379 -5.208 775 HD13 LEU 90 HD13 LEU 90 -5.868 -0.357 -4.996 776 HD21 LEU 90 HD21 LEU 90 -3.226 1.921 -4.976 777 HD22 LEU 90 HD22 LEU 90 -2.534 0.561 -4.090 778 HD23 LEU 90 HD23 LEU 90 -2.926 2.057 -3.244 779 H ARG 91 HN ARG 91 -6.331 1.201 0.054 780 HA ARG 91 HA ARG 91 -5.555 -1.519 0.276 781 HB2 ARG 91 HB2 ARG 91 -4.996 0.240 1.933 782 HB3 ARG 91 HB1 ARG 91 -6.690 0.327 2.386 783 HG2 ARG 91 HG2 ARG 91 -6.621 -1.970 3.174 784 HG3 ARG 91 HG1 ARG 91 -4.935 -2.105 2.672 785 HD2 ARG 91 HD2 ARG 91 -5.014 -1.693 5.041 786 HD3 ARG 91 HD1 ARG 91 -4.371 -0.265 4.231 787 HE ARG 91 HE ARG 91 -7.171 -0.033 4.573 788 HH11 ARG 91 HH11 ARG 91 -4.177 0.107 6.344 789 HH12 ARG 91 HH12 ARG 91 -4.790 1.178 7.557 790 HH21 ARG 91 HH21 ARG 91 -7.997 1.375 6.163 791 HH22 ARG 91 HH22 ARG 91 -6.971 1.902 7.454 792 H LEU 92 HN LEU 92 -8.653 0.136 0.859 793 HA LEU 92 HA LEU 92 -10.064 -2.141 1.710 794 HB2 LEU 92 HB2 LEU 92 -11.003 0.404 0.388 795 HB3 LEU 92 HB1 LEU 92 -12.104 -0.826 0.978 796 HG LEU 92 HG LEU 92 -10.110 0.627 2.719 797 HD11 LEU 92 HD11 LEU 92 -11.635 2.276 1.986 798 HD12 LEU 92 HD12 LEU 92 -12.185 1.776 3.586 799 HD13 LEU 92 HD13 LEU 92 -13.009 1.183 2.144 800 HD21 LEU 92 HD21 LEU 92 -12.254 -1.401 3.208 801 HD22 LEU 92 HD22 LEU 92 -11.841 -0.231 4.461 802 HD23 LEU 92 HD23 LEU 92 -10.610 -1.330 3.843 803 H LEU 93 HN LEU 93 -9.478 -0.834 -1.512 804 HA LEU 93 HA LEU 93 -11.234 -2.583 -2.899 805 HB2 LEU 93 HB2 LEU 93 -8.771 -1.094 -3.793 806 HB3 LEU 93 HB1 LEU 93 -9.758 -2.050 -4.880 807 HG LEU 93 HG LEU 93 -10.778 0.317 -3.311 808 HD11 LEU 93 HD11 LEU 93 -9.488 1.452 -4.770 809 HD12 LEU 93 HD12 LEU 93 -10.814 1.107 -5.881 810 HD13 LEU 93 HD13 LEU 93 -9.370 0.095 -5.891 811 HD21 LEU 93 HD21 LEU 93 -12.186 -1.739 -4.474 812 HD22 LEU 93 HD22 LEU 93 -12.164 -0.513 -5.741 813 HD23 LEU 93 HD23 LEU 93 -12.808 -0.121 -4.146 814 H ALA 94 HN ALA 94 -7.830 -2.758 -1.988 815 HA ALA 94 HA ALA 94 -7.191 -5.111 -3.394 816 HB1 ALA 94 HB1 ALA 94 -5.844 -4.360 -0.827 817 HB2 ALA 94 HB2 ALA 94 -5.618 -3.399 -2.289 818 HB3 ALA 94 HB3 ALA 94 -5.152 -5.101 -2.271 819 H GLU 95 HN GLU 95 -8.514 -4.603 -0.160 820 HA GLU 95 HA GLU 95 -8.247 -7.236 0.778 821 HB2 GLU 95 HB2 GLU 95 -10.228 -5.049 1.415 822 HB3 GLU 95 HB1 GLU 95 -10.195 -6.587 2.268 823 HG2 GLU 95 HG2 GLU 95 -7.997 -6.151 3.105 824 HG3 GLU 95 HG1 GLU 95 -7.850 -4.708 2.102 825 H GLU 96 HN GLU 96 -10.688 -5.641 -1.175 826 HA GLU 96 HA GLU 96 -12.621 -7.683 -1.208 827 HB2 GLU 96 HB2 GLU 96 -11.917 -5.514 -3.200 828 HB3 GLU 96 HB1 GLU 96 -13.299 -6.589 -3.403 829 HG2 GLU 96 HG2 GLU 96 -14.331 -5.748 -1.415 830 HG3 GLU 96 HG1 GLU 96 -12.890 -4.822 -1.001 831 H ILE 97 HN ILE 97 -9.814 -7.042 -3.244 832 HA ILE 97 HA ILE 97 -10.264 -9.163 -5.087 833 HB ILE 97 HB ILE 97 -7.726 -7.653 -4.435 834 HG12 ILE 97 HG12 ILE 97 -9.677 -7.293 -6.709 835 HG13 ILE 97 HG11 ILE 97 -9.697 -6.334 -5.231 836 HG21 ILE 97 HG21 ILE 97 -7.331 -9.844 -5.559 837 HG22 ILE 97 HG22 ILE 97 -6.843 -8.454 -6.531 838 HG23 ILE 97 HG23 ILE 97 -8.352 -9.297 -6.887 839 HD11 ILE 97 HD11 ILE 97 -7.158 -6.480 -6.716 840 HD12 ILE 97 HD12 ILE 97 -7.877 -5.154 -5.799 841 HD13 ILE 97 HD13 ILE 97 -8.473 -5.535 -7.414 842 H GLY 98 HN GLY 98 -8.249 -8.794 -2.198 843 HA2 GLY 98 HA2 GLY 98 -6.953 -11.290 -2.290 844 HA3 GLY 98 HA1 GLY 98 -7.198 -10.323 -0.845 845 H ASP 99 HN ASP 99 -10.073 -10.362 -0.970 846 HA ASP 99 HA ASP 99 -10.614 -12.674 0.525 847 HB2 ASP 99 HB2 ASP 99 -11.925 -10.571 0.662 848 HB3 ASP 99 HB1 ASP 99 -12.602 -10.913 -0.927 849 H TYR 100 HN TYR 100 -11.137 -11.967 -2.898 850 HA TYR 100 HA TYR 100 -12.453 -14.505 -3.339 851 HB2 TYR 100 HB2 TYR 100 -13.217 -12.563 -4.609 852 HB3 TYR 100 HB1 TYR 100 -11.601 -12.333 -5.270 853 HD1 TYR 100 HD1 TYR 100 -14.451 -14.723 -5.202 854 HD2 TYR 100 HD2 TYR 100 -10.966 -13.404 -7.258 855 HE1 TYR 100 HE1 TYR 100 -15.026 -16.177 -7.100 856 HE2 TYR 100 HE2 TYR 100 -11.533 -14.855 -9.161 857 HH TYR 100 HH TYR 100 -13.818 -17.304 -8.989 858 H LYS 101 HN LYS 101 -11.347 -16.300 -3.576 859 HA LYS 101 HA LYS 101 -8.611 -16.166 -4.647 860 HB2 LYS 101 HB2 LYS 101 -9.860 -18.308 -2.913 861 HB3 LYS 101 HB1 LYS 101 -8.198 -18.291 -3.485 862 HG2 LYS 101 HG2 LYS 101 -9.414 -16.230 -1.655 863 HG3 LYS 101 HG1 LYS 101 -8.416 -17.588 -1.137 864 HD2 LYS 101 HD2 LYS 101 -7.502 -15.460 -3.070 865 HD3 LYS 101 HD1 LYS 101 -7.195 -15.413 -1.333 866 HE2 LYS 101 HE2 LYS 101 -6.029 -17.590 -1.525 867 HE3 LYS 101 HE1 LYS 101 -6.260 -17.529 -3.272 868 HZ1 LYS 101 HZ1 LYS 101 -5.119 -15.157 -2.798 869 HZ2 LYS 101 HZ2 LYS 101 -4.262 -16.548 -3.233 870 HZ3 LYS 101 HZ3 LYS 101 -4.376 -16.100 -1.607 871 H ASP 102 HN ASP 102 -8.038 -17.395 -6.379 872 HA ASP 102 HA ASP 102 -9.988 -19.301 -7.455 873 HB2 ASP 102 HB2 ASP 102 -10.302 -17.062 -8.565 874 HB3 ASP 102 HB1 ASP 102 -8.655 -17.198 -9.174 875 H ASP 103 HN ASP 103 -8.877 -21.152 -7.444 876 HA ASP 103 HA ASP 103 -6.443 -21.367 -8.979 877 HB2 ASP 103 HB2 ASP 103 -5.914 -20.716 -6.467 878 HB3 ASP 103 HB1 ASP 103 -6.221 -22.427 -6.187 879 H ASP 104 HN ASP 104 -5.787 -23.635 -9.253 880 HA ASP 104 HA ASP 104 -8.023 -25.320 -9.707 881 HB2 ASP 104 HB2 ASP 104 -5.895 -25.351 -11.034 882 HB3 ASP 104 HB1 ASP 104 -5.109 -26.132 -9.664 883 H ASP 105 HN ASP 105 -5.765 -25.022 -7.075 884 HA ASP 105 HA ASP 105 -7.373 -26.792 -5.450 885 HB2 ASP 105 HB2 ASP 105 -5.492 -28.134 -6.718 886 HB3 ASP 105 HB1 ASP 105 -4.439 -27.421 -5.501 887 H LYS 106 HN LYS 106 -6.660 -26.731 -3.157 888 HA LYS 106 HA LYS 106 -5.797 -24.040 -2.489 889 HB2 LYS 106 HB2 LYS 106 -7.021 -26.310 -0.953 890 HB3 LYS 106 HB1 LYS 106 -6.256 -24.978 -0.096 891 HG2 LYS 106 HG2 LYS 106 -7.779 -23.399 -1.067 892 HG3 LYS 106 HG1 LYS 106 -8.469 -24.643 -2.110 893 HD2 LYS 106 HD2 LYS 106 -9.967 -24.297 -0.273 894 HD3 LYS 106 HD1 LYS 106 -9.188 -25.866 -0.055 895 HE2 LYS 106 HE2 LYS 106 -7.641 -24.900 1.551 896 HE3 LYS 106 HE1 LYS 106 -8.343 -23.303 1.295 897 HZ1 LYS 106 HZ1 LYS 106 -9.951 -25.594 2.257 898 HZ2 LYS 106 HZ2 LYS 106 -10.334 -23.948 2.320 899 HZ3 LYS 106 HZ3 LYS 106 -9.117 -24.570 3.316 Start of MODEL 20 1 H1 MET 1 HT1 MET 1 -16.848 -10.941 -21.903 2 H2 MET 1 HT2 MET 1 -16.196 -9.520 -21.260 3 H3 MET 1 HT3 MET 1 -15.891 -11.005 -20.508 4 HA MET 1 HA MET 1 -14.707 -11.761 -22.502 5 HB2 MET 1 HB2 MET 1 -15.219 -8.899 -23.331 6 HB3 MET 1 HB1 MET 1 -13.992 -9.914 -24.078 7 HG2 MET 1 HG2 MET 1 -15.669 -11.457 -24.850 8 HG3 MET 1 HG1 MET 1 -16.926 -10.572 -23.988 9 HE1 MET 1 HE1 MET 1 -14.396 -10.713 -26.748 10 HE2 MET 1 HE2 MET 1 -13.947 -9.038 -26.429 11 HE3 MET 1 HE3 MET 1 -14.845 -9.447 -27.891 12 H ALA 2 HN ALA 2 -14.681 -9.627 -19.996 13 HA ALA 2 HA ALA 2 -11.908 -8.821 -20.163 14 HB1 ALA 2 HB1 ALA 2 -13.945 -8.484 -17.964 15 HB2 ALA 2 HB2 ALA 2 -13.479 -7.281 -19.167 16 HB3 ALA 2 HB3 ALA 2 -12.319 -7.802 -17.946 17 HA PRO 3 HA PRO 3 -10.557 -12.631 -18.244 18 HB2 PRO 3 HB2 PRO 3 -7.922 -12.097 -18.240 19 HB3 PRO 3 HB1 PRO 3 -8.794 -12.540 -19.714 20 HG2 PRO 3 HG2 PRO 3 -8.033 -9.827 -18.712 21 HG3 PRO 3 HG1 PRO 3 -7.863 -10.498 -20.344 22 HD2 PRO 3 HD2 PRO 3 -9.895 -8.852 -19.663 23 HD3 PRO 3 HD1 PRO 3 -10.095 -10.160 -20.849 24 H LEU 4 HN LEU 4 -9.691 -13.318 -16.255 25 HA LEU 4 HA LEU 4 -9.509 -11.180 -14.241 26 HB2 LEU 4 HB2 LEU 4 -10.331 -14.059 -13.837 27 HB3 LEU 4 HB1 LEU 4 -10.302 -12.811 -12.606 28 HG LEU 4 HG LEU 4 -12.122 -12.876 -15.016 29 HD11 LEU 4 HD11 LEU 4 -13.892 -13.332 -13.479 30 HD12 LEU 4 HD12 LEU 4 -12.804 -13.177 -12.100 31 HD13 LEU 4 HD13 LEU 4 -12.621 -14.526 -13.222 32 HD21 LEU 4 HD21 LEU 4 -11.862 -10.620 -14.645 33 HD22 LEU 4 HD22 LEU 4 -11.620 -10.823 -12.908 34 HD23 LEU 4 HD23 LEU 4 -13.233 -10.997 -13.599 35 H ARG 5 HN ARG 5 -7.733 -11.064 -12.977 36 HA ARG 5 HA ARG 5 -5.909 -13.303 -12.796 37 HB2 ARG 5 HB2 ARG 5 -4.006 -11.537 -13.303 38 HB3 ARG 5 HB1 ARG 5 -4.757 -12.480 -14.583 39 HG2 ARG 5 HG2 ARG 5 -6.176 -10.017 -14.019 40 HG3 ARG 5 HG1 ARG 5 -4.502 -9.751 -14.518 41 HD2 ARG 5 HD2 ARG 5 -4.874 -11.139 -16.495 42 HD3 ARG 5 HD1 ARG 5 -6.536 -11.425 -15.985 43 HE ARG 5 HE ARG 5 -7.092 -9.252 -16.620 44 HH11 ARG 5 HH11 ARG 5 -3.681 -9.848 -17.019 45 HH12 ARG 5 HH12 ARG 5 -3.416 -8.451 -18.004 46 HH21 ARG 5 HH21 ARG 5 -6.758 -7.409 -17.917 47 HH22 ARG 5 HH22 ARG 5 -5.171 -7.058 -18.515 48 H LYS 6 HN LYS 6 -4.007 -12.707 -11.317 49 HA LYS 6 HA LYS 6 -5.022 -11.801 -8.856 50 HB2 LYS 6 HB2 LYS 6 -2.185 -12.248 -9.778 51 HB3 LYS 6 HB1 LYS 6 -2.612 -11.851 -8.120 52 HG2 LYS 6 HG2 LYS 6 -3.635 -14.271 -9.595 53 HG3 LYS 6 HG1 LYS 6 -2.229 -14.271 -8.529 54 HD2 LYS 6 HD2 LYS 6 -3.716 -13.430 -6.701 55 HD3 LYS 6 HD1 LYS 6 -5.088 -13.665 -7.784 56 HE2 LYS 6 HE2 LYS 6 -3.165 -15.817 -6.908 57 HE3 LYS 6 HE1 LYS 6 -4.773 -15.555 -6.237 58 HZ1 LYS 6 HZ1 LYS 6 -4.040 -16.498 -8.937 59 HZ2 LYS 6 HZ2 LYS 6 -5.568 -15.844 -8.625 60 HZ3 LYS 6 HZ3 LYS 6 -5.059 -17.230 -7.802 61 H THR 7 HN THR 7 -3.086 -10.226 -11.307 62 HA THR 7 HA THR 7 -2.785 -7.821 -9.740 63 HB THR 7 HB THR 7 -1.948 -6.988 -12.108 64 HG1 THR 7 HG1 THR 7 -2.565 -8.815 -13.281 65 HG21 THR 7 HG21 THR 7 -0.616 -8.675 -10.051 66 HG22 THR 7 HG22 THR 7 -0.306 -7.001 -10.516 67 HG23 THR 7 HG23 THR 7 0.266 -8.322 -11.536 68 H ALA 8 HN ALA 8 -4.202 -6.272 -9.626 69 HA ALA 8 HA ALA 8 -6.425 -6.159 -11.518 70 HB1 ALA 8 HB1 ALA 8 -6.034 -4.580 -8.982 71 HB2 ALA 8 HB2 ALA 8 -6.838 -6.147 -9.060 72 HB3 ALA 8 HB3 ALA 8 -7.522 -4.759 -9.912 73 H VAL 9 HN VAL 9 -7.084 -4.129 -12.472 74 HA VAL 9 HA VAL 9 -4.739 -2.438 -13.013 75 HB VAL 9 HB VAL 9 -7.155 -2.910 -14.760 76 HG11 VAL 9 HG11 VAL 9 -4.872 -0.996 -14.928 77 HG12 VAL 9 HG12 VAL 9 -6.556 -0.788 -15.407 78 HG13 VAL 9 HG13 VAL 9 -5.460 -1.724 -16.423 79 HG21 VAL 9 HG21 VAL 9 -5.954 -4.413 -15.967 80 HG22 VAL 9 HG22 VAL 9 -5.154 -4.647 -14.412 81 HG23 VAL 9 HG23 VAL 9 -4.417 -3.614 -15.637 82 H LEU 10 HN LEU 10 -4.811 -0.464 -12.269 83 HA LEU 10 HA LEU 10 -7.420 0.751 -11.594 84 HB2 LEU 10 HB2 LEU 10 -5.953 0.219 -9.634 85 HB3 LEU 10 HB1 LEU 10 -4.727 1.268 -10.308 86 HG LEU 10 HG LEU 10 -6.234 3.207 -10.018 87 HD11 LEU 10 HD11 LEU 10 -8.257 2.889 -8.575 88 HD12 LEU 10 HD12 LEU 10 -8.080 1.150 -8.809 89 HD13 LEU 10 HD13 LEU 10 -8.401 2.196 -10.192 90 HD21 LEU 10 HD21 LEU 10 -5.192 3.413 -8.079 91 HD22 LEU 10 HD22 LEU 10 -4.959 1.667 -7.999 92 HD23 LEU 10 HD23 LEU 10 -6.418 2.395 -7.323 93 H LYS 11 HN LYS 11 -7.874 2.629 -12.725 94 HA LYS 11 HA LYS 11 -5.629 3.674 -14.322 95 HB2 LYS 11 HB2 LYS 11 -8.553 3.497 -15.061 96 HB3 LYS 11 HB1 LYS 11 -7.382 4.455 -15.955 97 HG2 LYS 11 HG2 LYS 11 -6.102 2.422 -16.434 98 HG3 LYS 11 HG1 LYS 11 -7.308 1.471 -15.569 99 HD2 LYS 11 HD2 LYS 11 -9.020 2.185 -17.153 100 HD3 LYS 11 HD1 LYS 11 -7.834 3.175 -18.005 101 HE2 LYS 11 HE2 LYS 11 -6.549 1.171 -18.551 102 HE3 LYS 11 HE1 LYS 11 -7.725 0.176 -17.692 103 HZ1 LYS 11 HZ1 LYS 11 -8.976 0.104 -19.502 104 HZ2 LYS 11 HZ2 LYS 11 -7.793 0.966 -20.352 105 HZ3 LYS 11 HZ3 LYS 11 -9.052 1.793 -19.583 106 H LEU 12 HN LEU 12 -5.231 5.781 -14.305 107 HA LEU 12 HA LEU 12 -7.012 7.433 -12.653 108 HB2 LEU 12 HB2 LEU 12 -4.339 6.937 -12.255 109 HB3 LEU 12 HB1 LEU 12 -4.296 8.457 -13.125 110 HG LEU 12 HG LEU 12 -5.673 7.916 -10.494 111 HD11 LEU 12 HD11 LEU 12 -3.115 8.310 -10.734 112 HD12 LEU 12 HD12 LEU 12 -4.025 9.169 -9.492 113 HD13 LEU 12 HD13 LEU 12 -3.588 9.988 -10.991 114 HD21 LEU 12 HD21 LEU 12 -7.131 9.441 -11.413 115 HD22 LEU 12 HD22 LEU 12 -5.879 10.211 -12.389 116 HD23 LEU 12 HD23 LEU 12 -5.949 10.506 -10.652 117 H TYR 13 HN TYR 13 -8.034 9.080 -13.751 118 HA TYR 13 HA TYR 13 -7.113 9.685 -16.473 119 HB2 TYR 13 HB2 TYR 13 -9.707 10.286 -15.031 120 HB3 TYR 13 HB1 TYR 13 -9.348 10.720 -16.699 121 HD1 TYR 13 HD1 TYR 13 -10.054 7.929 -14.406 122 HD2 TYR 13 HD2 TYR 13 -9.417 9.066 -18.455 123 HE1 TYR 13 HE1 TYR 13 -10.910 5.748 -15.146 124 HE2 TYR 13 HE2 TYR 13 -10.268 6.884 -19.206 125 HH TYR 13 HH TYR 13 -11.230 4.962 -18.592 126 H VAL 14 HN VAL 14 -5.954 11.517 -16.737 127 HA VAL 14 HA VAL 14 -6.360 13.703 -14.800 128 HB VAL 14 HB VAL 14 -3.953 14.278 -15.066 129 HG11 VAL 14 HG11 VAL 14 -3.128 12.506 -13.532 130 HG12 VAL 14 HG12 VAL 14 -4.609 11.597 -13.846 131 HG13 VAL 14 HG13 VAL 14 -4.694 13.172 -13.052 132 HG21 VAL 14 HG21 VAL 14 -3.195 13.237 -16.995 133 HG22 VAL 14 HG22 VAL 14 -3.960 11.702 -16.587 134 HG23 VAL 14 HG23 VAL 14 -2.517 12.223 -15.719 135 H ALA 15 HN ALA 15 -5.692 15.829 -15.633 136 HA ALA 15 HA ALA 15 -6.117 15.980 -18.542 137 HB1 ALA 15 HB1 ALA 15 -6.813 18.408 -17.093 138 HB2 ALA 15 HB2 ALA 15 -7.787 17.021 -16.602 139 HB3 ALA 15 HB3 ALA 15 -7.739 17.509 -18.295 140 H GLY 16 HN GLY 16 -4.195 16.343 -19.411 141 HA2 GLY 16 HA2 GLY 16 -2.220 17.384 -19.913 142 HA3 GLY 16 HA1 GLY 16 -2.867 18.795 -19.090 143 H ASN 17 HN ASN 17 -1.344 19.497 -17.745 144 HA ASN 17 HA ASN 17 -0.230 17.575 -15.825 145 HB2 ASN 17 HB2 ASN 17 1.327 18.333 -17.837 146 HB3 ASN 17 HB1 ASN 17 1.526 19.773 -16.845 147 HD21 ASN 17 HD21 ASN 17 3.571 19.535 -16.171 148 HD22 ASN 17 HD22 ASN 17 4.149 18.197 -15.244 149 H THR 18 HN THR 18 -2.364 19.078 -15.220 150 HA THR 18 HA THR 18 -1.668 21.604 -14.054 151 HB THR 18 HB THR 18 -3.912 21.554 -13.059 152 HG1 THR 18 HG1 THR 18 -5.244 19.668 -13.588 153 HG21 THR 18 HG21 THR 18 -5.066 21.885 -15.013 154 HG22 THR 18 HG22 THR 18 -4.361 20.471 -15.798 155 HG23 THR 18 HG23 THR 18 -3.408 21.943 -15.612 156 HA PRO 19 HA PRO 19 -0.058 20.485 -10.127 157 HB2 PRO 19 HB2 PRO 19 -2.246 22.120 -8.891 158 HB3 PRO 19 HB1 PRO 19 -0.502 22.178 -8.607 159 HG2 PRO 19 HG2 PRO 19 -1.627 24.043 -10.095 160 HG3 PRO 19 HG1 PRO 19 -0.087 23.324 -10.604 161 HD2 PRO 19 HD2 PRO 19 -2.856 22.785 -11.617 162 HD3 PRO 19 HD1 PRO 19 -1.337 22.951 -12.522 163 H ASN 20 HN ASN 20 -3.595 20.340 -10.336 164 HA ASN 20 HA ASN 20 -3.961 18.555 -8.149 165 HB2 ASN 20 HB2 ASN 20 -5.723 18.977 -10.595 166 HB3 ASN 20 HB1 ASN 20 -6.169 18.029 -9.182 167 HD21 ASN 20 HD21 ASN 20 -5.803 19.285 -7.055 168 HD22 ASN 20 HD22 ASN 20 -6.433 20.893 -7.043 169 H SER 21 HN SER 21 -3.636 18.051 -11.658 170 HA SER 21 HA SER 21 -3.773 15.207 -11.614 171 HB2 SER 21 HB2 SER 21 -2.527 17.112 -13.615 172 HB3 SER 21 HB1 SER 21 -2.772 15.387 -13.884 173 HG SER 21 HG SER 21 -4.568 17.462 -13.993 174 H VAL 22 HN VAL 22 -1.024 17.463 -11.549 175 HA VAL 22 HA VAL 22 0.926 15.434 -11.621 176 HB VAL 22 HB VAL 22 1.053 18.257 -10.529 177 HG11 VAL 22 HG11 VAL 22 3.250 16.224 -10.792 178 HG12 VAL 22 HG12 VAL 22 2.753 17.122 -9.355 179 HG13 VAL 22 HG13 VAL 22 3.552 17.959 -10.689 180 HG21 VAL 22 HG21 VAL 22 1.860 16.992 -13.128 181 HG22 VAL 22 HG22 VAL 22 2.507 18.545 -12.602 182 HG23 VAL 22 HG23 VAL 22 0.772 18.352 -12.852 183 H ARG 23 HN ARG 23 -0.594 17.137 -8.928 184 HA ARG 23 HA ARG 23 0.829 15.914 -6.831 185 HB2 ARG 23 HB2 ARG 23 -0.640 17.955 -6.710 186 HB3 ARG 23 HB1 ARG 23 -2.028 16.869 -6.803 187 HG2 ARG 23 HG2 ARG 23 -1.634 15.969 -4.713 188 HG3 ARG 23 HG1 ARG 23 0.024 16.576 -4.648 189 HD2 ARG 23 HD2 ARG 23 -2.439 18.319 -4.669 190 HD3 ARG 23 HD1 ARG 23 -1.585 17.827 -3.205 191 HE ARG 23 HE ARG 23 0.271 19.001 -4.921 192 HH11 ARG 23 HH11 ARG 23 -2.558 19.901 -3.102 193 HH12 ARG 23 HH12 ARG 23 -2.054 21.544 -2.877 194 HH21 ARG 23 HH21 ARG 23 0.951 21.156 -4.634 195 HH22 ARG 23 HH22 ARG 23 -0.051 22.259 -3.752 196 H ALA 24 HN ALA 24 -2.271 15.120 -8.367 197 HA ALA 24 HA ALA 24 -2.868 12.940 -6.715 198 HB1 ALA 24 HB1 ALA 24 -4.164 14.262 -8.743 199 HB2 ALA 24 HB2 ALA 24 -4.763 12.842 -7.879 200 HB3 ALA 24 HB3 ALA 24 -3.910 12.649 -9.412 201 H LEU 25 HN LEU 25 -1.240 13.059 -9.883 202 HA LEU 25 HA LEU 25 -0.942 10.271 -10.176 203 HB2 LEU 25 HB2 LEU 25 0.559 12.586 -11.360 204 HB3 LEU 25 HB1 LEU 25 0.980 10.927 -11.732 205 HG LEU 25 HG LEU 25 -1.753 12.100 -12.202 206 HD11 LEU 25 HD11 LEU 25 -0.786 13.241 -13.865 207 HD12 LEU 25 HD12 LEU 25 -0.611 11.677 -14.659 208 HD13 LEU 25 HD13 LEU 25 0.725 12.344 -13.721 209 HD21 LEU 25 HD21 LEU 25 -2.359 10.043 -12.803 210 HD22 LEU 25 HD22 LEU 25 -0.831 9.463 -12.136 211 HD23 LEU 25 HD23 LEU 25 -0.951 9.875 -13.849 212 H LYS 26 HN LYS 26 1.231 12.665 -8.681 213 HA LYS 26 HA LYS 26 3.334 10.847 -8.196 214 HB2 LYS 26 HB2 LYS 26 2.535 13.384 -6.772 215 HB3 LYS 26 HB1 LYS 26 3.967 12.460 -6.342 216 HG2 LYS 26 HG2 LYS 26 4.845 12.777 -8.609 217 HG3 LYS 26 HG1 LYS 26 3.414 13.728 -9.018 218 HD2 LYS 26 HD2 LYS 26 3.998 15.354 -7.288 219 HD3 LYS 26 HD1 LYS 26 5.420 14.400 -6.862 220 HE2 LYS 26 HE2 LYS 26 4.902 15.664 -9.552 221 HE3 LYS 26 HE1 LYS 26 5.968 16.316 -8.308 222 HZ1 LYS 26 HZ1 LYS 26 6.941 13.854 -8.551 223 HZ2 LYS 26 HZ2 LYS 26 7.507 15.169 -9.452 224 HZ3 LYS 26 HZ3 LYS 26 6.389 14.097 -10.132 225 H THR 27 HN THR 27 0.466 11.719 -6.341 226 HA THR 27 HA THR 27 1.058 10.262 -3.992 227 HB THR 27 HB THR 27 -1.602 11.118 -5.149 228 HG1 THR 27 HG1 THR 27 -0.445 12.951 -4.766 229 HG21 THR 27 HG21 THR 27 -1.366 10.994 -2.258 230 HG22 THR 27 HG22 THR 27 -1.157 9.414 -3.017 231 HG23 THR 27 HG23 THR 27 -2.621 10.352 -3.315 232 H LEU 28 HN LEU 28 -0.835 9.459 -6.900 233 HA LEU 28 HA LEU 28 -1.642 6.904 -5.930 234 HB2 LEU 28 HB2 LEU 28 -2.043 8.512 -8.297 235 HB3 LEU 28 HB1 LEU 28 -1.761 6.837 -8.725 236 HG LEU 28 HG LEU 28 -4.116 7.161 -8.558 237 HD11 LEU 28 HD11 LEU 28 -4.666 5.383 -7.226 238 HD12 LEU 28 HD12 LEU 28 -3.565 5.863 -5.935 239 HD13 LEU 28 HD13 LEU 28 -2.930 5.136 -7.410 240 HD21 LEU 28 HD21 LEU 28 -4.938 8.763 -7.268 241 HD22 LEU 28 HD22 LEU 28 -3.403 8.919 -6.414 242 HD23 LEU 28 HD23 LEU 28 -4.606 7.756 -5.859 243 H ALA 29 HN ALA 29 0.811 7.884 -8.364 244 HA ALA 29 HA ALA 29 1.607 5.287 -9.047 245 HB1 ALA 29 HB1 ALA 29 2.468 7.985 -9.605 246 HB2 ALA 29 HB2 ALA 29 2.547 6.540 -10.614 247 HB3 ALA 29 HB3 ALA 29 3.834 6.879 -9.456 248 H ASN 30 HN ASN 30 2.957 7.515 -6.610 249 HA ASN 30 HA ASN 30 5.177 5.827 -5.993 250 HB2 ASN 30 HB2 ASN 30 5.196 8.221 -5.419 251 HB3 ASN 30 HB1 ASN 30 3.864 7.971 -4.297 252 HD21 ASN 30 HD21 ASN 30 7.222 7.155 -4.949 253 HD22 ASN 30 HD22 ASN 30 7.655 6.847 -3.305 254 H ILE 31 HN ILE 31 1.976 6.154 -4.554 255 HA ILE 31 HA ILE 31 2.444 4.349 -2.472 256 HB ILE 31 HB ILE 31 -0.091 5.309 -3.742 257 HG12 ILE 31 HG12 ILE 31 1.067 5.660 -0.975 258 HG13 ILE 31 HG11 ILE 31 1.332 6.778 -2.308 259 HG21 ILE 31 HG21 ILE 31 -0.398 3.901 -1.199 260 HG22 ILE 31 HG22 ILE 31 0.002 2.855 -2.560 261 HG23 ILE 31 HG23 ILE 31 -1.420 3.896 -2.636 262 HD11 ILE 31 HD11 ILE 31 -1.378 6.077 -1.249 263 HD12 ILE 31 HD12 ILE 31 -0.953 7.370 -2.368 264 HD13 ILE 31 HD13 ILE 31 -0.426 7.449 -0.687 265 H LEU 32 HN LEU 32 1.096 3.849 -5.721 266 HA LEU 32 HA LEU 32 0.693 1.062 -5.378 267 HB2 LEU 32 HB2 LEU 32 0.868 2.800 -7.820 268 HB3 LEU 32 HB1 LEU 32 0.596 1.069 -7.916 269 HG LEU 32 HG LEU 32 -1.199 2.933 -6.355 270 HD11 LEU 32 HD11 LEU 32 -2.711 2.937 -8.193 271 HD12 LEU 32 HD12 LEU 32 -1.713 1.798 -9.098 272 HD13 LEU 32 HD13 LEU 32 -1.137 3.441 -8.812 273 HD21 LEU 32 HD21 LEU 32 -2.644 0.749 -7.096 274 HD22 LEU 32 HD22 LEU 32 -1.855 0.960 -5.534 275 HD23 LEU 32 HD23 LEU 32 -1.052 0.047 -6.811 276 H GLU 33 HN GLU 33 3.448 2.930 -6.545 277 HA GLU 33 HA GLU 33 4.901 0.693 -7.545 278 HB2 GLU 33 HB2 GLU 33 5.788 3.466 -6.764 279 HB3 GLU 33 HB1 GLU 33 6.878 2.260 -7.431 280 HG2 GLU 33 HG2 GLU 33 5.550 2.164 -9.466 281 HG3 GLU 33 HG1 GLU 33 4.417 3.331 -8.786 282 H LYS 34 HN LYS 34 4.592 2.058 -4.336 283 HA LYS 34 HA LYS 34 6.747 0.247 -3.457 284 HB2 LYS 34 HB2 LYS 34 6.954 2.783 -3.100 285 HB3 LYS 34 HB1 LYS 34 5.759 2.560 -1.830 286 HG2 LYS 34 HG2 LYS 34 7.195 1.390 -0.487 287 HG3 LYS 34 HG1 LYS 34 8.163 0.808 -1.844 288 HD2 LYS 34 HD2 LYS 34 9.473 2.401 -0.655 289 HD3 LYS 34 HD1 LYS 34 8.961 3.146 -2.169 290 HE2 LYS 34 HE2 LYS 34 7.191 4.341 -1.004 291 HE3 LYS 34 HE1 LYS 34 7.636 3.557 0.510 292 HZ1 LYS 34 HZ1 LYS 34 8.522 5.945 -0.184 293 HZ2 LYS 34 HZ2 LYS 34 9.749 5.006 -0.873 294 HZ3 LYS 34 HZ3 LYS 34 9.422 4.887 0.782 295 H GLU 35 HN GLU 35 3.753 1.694 -2.170 296 HA GLU 35 HA GLU 35 3.444 -0.166 -0.077 297 HB2 GLU 35 HB2 GLU 35 1.518 1.738 -1.412 298 HB3 GLU 35 HB1 GLU 35 1.068 0.742 -0.029 299 HG2 GLU 35 HG2 GLU 35 3.268 2.801 -0.084 300 HG3 GLU 35 HG1 GLU 35 1.682 2.996 0.657 301 H PHE 36 HN PHE 36 2.045 -0.111 -3.356 302 HA PHE 36 HA PHE 36 1.022 -2.821 -2.795 303 HB2 PHE 36 HB2 PHE 36 -0.202 -0.726 -4.592 304 HB3 PHE 36 HB1 PHE 36 -0.780 -2.382 -4.442 305 HD1 PHE 36 HD1 PHE 36 -0.728 0.914 -2.968 306 HD2 PHE 36 HD2 PHE 36 -1.740 -3.163 -2.298 307 HE1 PHE 36 HE1 PHE 36 -2.109 1.578 -1.045 308 HE2 PHE 36 HE2 PHE 36 -3.126 -2.505 -0.375 309 HZ PHE 36 HZ PHE 36 -3.311 -0.132 0.254 310 H LYS 37 HN LYS 37 3.630 -2.044 -3.933 311 HA LYS 37 HA LYS 37 3.752 -2.411 -6.691 312 HB2 LYS 37 HB2 LYS 37 5.655 -1.661 -5.314 313 HB3 LYS 37 HB1 LYS 37 5.780 -3.273 -4.620 314 HG2 LYS 37 HG2 LYS 37 6.324 -4.189 -6.812 315 HG3 LYS 37 HG1 LYS 37 6.169 -2.582 -7.527 316 HD2 LYS 37 HD2 LYS 37 8.005 -1.781 -6.117 317 HD3 LYS 37 HD1 LYS 37 8.161 -3.390 -5.409 318 HE2 LYS 37 HE2 LYS 37 8.698 -4.308 -7.612 319 HE3 LYS 37 HE1 LYS 37 8.533 -2.702 -8.322 320 HZ1 LYS 37 HZ1 LYS 37 10.588 -3.627 -6.397 321 HZ2 LYS 37 HZ2 LYS 37 10.343 -1.994 -6.764 322 HZ3 LYS 37 HZ3 LYS 37 10.823 -3.070 -7.977 323 H GLY 38 HN GLY 38 3.444 -4.090 -7.991 324 HA2 GLY 38 HA2 GLY 38 3.623 -6.317 -8.699 325 HA3 GLY 38 HA1 GLY 38 3.910 -6.799 -7.036 326 H VAL 39 HN VAL 39 1.323 -4.908 -6.658 327 HA VAL 39 HA VAL 39 -0.483 -7.185 -7.092 328 HB VAL 39 HB VAL 39 -0.834 -4.922 -5.110 329 HG11 VAL 39 HG11 VAL 39 -2.947 -5.912 -5.940 330 HG12 VAL 39 HG12 VAL 39 -2.682 -6.192 -4.218 331 HG13 VAL 39 HG13 VAL 39 -2.396 -7.490 -5.377 332 HG21 VAL 39 HG21 VAL 39 -0.167 -7.796 -4.504 333 HG22 VAL 39 HG22 VAL 39 -0.192 -6.430 -3.389 334 HG23 VAL 39 HG23 VAL 39 1.051 -6.526 -4.637 335 H TYR 40 HN TYR 40 -0.337 -3.623 -7.350 336 HA TYR 40 HA TYR 40 -2.646 -3.887 -9.128 337 HB2 TYR 40 HB2 TYR 40 -2.006 -1.884 -7.061 338 HB3 TYR 40 HB1 TYR 40 -2.575 -1.191 -8.568 339 HD1 TYR 40 HD1 TYR 40 -3.485 -3.034 -5.578 340 HD2 TYR 40 HD2 TYR 40 -4.839 -1.693 -9.380 341 HE1 TYR 40 HE1 TYR 40 -5.812 -3.403 -4.877 342 HE2 TYR 40 HE2 TYR 40 -7.167 -2.065 -8.691 343 HH TYR 40 HH TYR 40 -8.002 -3.818 -5.919 344 H ALA 41 HN ALA 41 -2.670 -2.908 -11.103 345 HA ALA 41 HA ALA 41 -0.096 -1.833 -12.045 346 HB1 ALA 41 HB1 ALA 41 -1.246 -3.866 -13.148 347 HB2 ALA 41 HB2 ALA 41 -0.640 -2.582 -14.193 348 HB3 ALA 41 HB3 ALA 41 -2.362 -2.680 -13.825 349 H LEU 42 HN LEU 42 0.013 0.321 -12.468 350 HA LEU 42 HA LEU 42 -2.486 1.829 -12.365 351 HB2 LEU 42 HB2 LEU 42 -0.736 2.545 -10.839 352 HB3 LEU 42 HB1 LEU 42 0.378 2.753 -12.175 353 HG LEU 42 HG LEU 42 -1.065 4.565 -13.065 354 HD11 LEU 42 HD11 LEU 42 -2.661 5.503 -11.213 355 HD12 LEU 42 HD12 LEU 42 -2.711 3.818 -10.699 356 HD13 LEU 42 HD13 LEU 42 -3.213 4.257 -12.331 357 HD21 LEU 42 HD21 LEU 42 -0.100 6.164 -11.766 358 HD22 LEU 42 HD22 LEU 42 0.840 4.764 -11.245 359 HD23 LEU 42 HD23 LEU 42 -0.502 5.344 -10.258 360 H LYS 43 HN LYS 43 -3.389 2.715 -14.053 361 HA LYS 43 HA LYS 43 -1.771 3.172 -16.470 362 HB2 LYS 43 HB2 LYS 43 -4.219 1.623 -16.110 363 HB3 LYS 43 HB1 LYS 43 -4.396 2.873 -17.334 364 HG2 LYS 43 HG2 LYS 43 -3.651 1.189 -18.640 365 HG3 LYS 43 HG1 LYS 43 -2.096 1.873 -18.164 366 HD2 LYS 43 HD2 LYS 43 -1.680 0.158 -16.636 367 HD3 LYS 43 HD1 LYS 43 -3.380 -0.309 -16.560 368 HE2 LYS 43 HE2 LYS 43 -2.254 -1.979 -17.824 369 HE3 LYS 43 HE1 LYS 43 -3.201 -1.014 -18.956 370 HZ1 LYS 43 HZ1 LYS 43 -0.547 -0.002 -18.597 371 HZ2 LYS 43 HZ2 LYS 43 -1.371 -0.382 -20.024 372 HZ3 LYS 43 HZ3 LYS 43 -0.550 -1.592 -19.175 373 H VAL 44 HN VAL 44 -1.620 5.245 -16.916 374 HA VAL 44 HA VAL 44 -3.679 7.107 -15.923 375 HB VAL 44 HB VAL 44 -1.585 7.886 -15.228 376 HG11 VAL 44 HG11 VAL 44 0.306 8.163 -16.990 377 HG12 VAL 44 HG12 VAL 44 -0.591 6.925 -17.868 378 HG13 VAL 44 HG13 VAL 44 0.020 6.589 -16.247 379 HG21 VAL 44 HG21 VAL 44 -1.137 9.923 -16.489 380 HG22 VAL 44 HG22 VAL 44 -2.870 9.656 -16.295 381 HG23 VAL 44 HG23 VAL 44 -2.089 9.301 -17.835 382 H ILE 45 HN ILE 45 -5.036 8.092 -17.129 383 HA ILE 45 HA ILE 45 -4.761 7.839 -20.041 384 HB ILE 45 HB ILE 45 -7.261 8.202 -18.393 385 HG12 ILE 45 HG12 ILE 45 -6.270 6.032 -17.905 386 HG13 ILE 45 HG11 ILE 45 -7.747 5.830 -18.838 387 HG21 ILE 45 HG21 ILE 45 -7.029 7.359 -21.279 388 HG22 ILE 45 HG22 ILE 45 -7.354 9.011 -20.753 389 HG23 ILE 45 HG23 ILE 45 -8.508 7.725 -20.388 390 HD11 ILE 45 HD11 ILE 45 -5.966 4.308 -19.534 391 HD12 ILE 45 HD12 ILE 45 -4.954 5.694 -19.949 392 HD13 ILE 45 HD13 ILE 45 -6.453 5.398 -20.834 393 H ASP 46 HN ASP 46 -3.884 9.770 -20.658 394 HA ASP 46 HA ASP 46 -4.556 12.260 -19.393 395 HB2 ASP 46 HB2 ASP 46 -2.350 11.778 -20.496 396 HB3 ASP 46 HB1 ASP 46 -3.173 11.838 -22.050 397 H VAL 47 HN VAL 47 -6.654 12.872 -19.621 398 HA VAL 47 HA VAL 47 -8.253 12.237 -21.861 399 HB VAL 47 HB VAL 47 -9.970 13.641 -20.877 400 HG11 VAL 47 HG11 VAL 47 -10.277 11.798 -19.657 401 HG12 VAL 47 HG12 VAL 47 -9.400 12.612 -18.362 402 HG13 VAL 47 HG13 VAL 47 -8.540 11.545 -19.472 403 HG21 VAL 47 HG21 VAL 47 -7.970 14.464 -18.781 404 HG22 VAL 47 HG22 VAL 47 -9.631 15.027 -18.978 405 HG23 VAL 47 HG23 VAL 47 -8.402 15.474 -20.162 406 H LEU 48 HN LEU 48 -6.358 15.142 -21.154 407 HA LEU 48 HA LEU 48 -7.575 16.694 -23.214 408 HB2 LEU 48 HB2 LEU 48 -4.993 17.057 -21.715 409 HB3 LEU 48 HB1 LEU 48 -5.534 18.169 -22.957 410 HG LEU 48 HG LEU 48 -7.059 17.544 -20.424 411 HD11 LEU 48 HD11 LEU 48 -6.428 19.871 -19.803 412 HD12 LEU 48 HD12 LEU 48 -5.311 19.880 -21.170 413 HD13 LEU 48 HD13 LEU 48 -5.073 18.742 -19.844 414 HD21 LEU 48 HD21 LEU 48 -7.633 19.159 -22.843 415 HD22 LEU 48 HD22 LEU 48 -8.101 19.836 -21.284 416 HD23 LEU 48 HD23 LEU 48 -8.727 18.267 -21.787 417 H LYS 49 HN LYS 49 -4.735 14.629 -23.056 418 HA LYS 49 HA LYS 49 -3.742 15.303 -25.643 419 HB2 LYS 49 HB2 LYS 49 -2.354 14.299 -23.841 420 HB3 LYS 49 HB1 LYS 49 -3.249 12.797 -24.029 421 HG2 LYS 49 HG2 LYS 49 -2.384 12.451 -26.209 422 HG3 LYS 49 HG1 LYS 49 -1.698 14.077 -26.262 423 HD2 LYS 49 HD2 LYS 49 0.105 12.612 -25.814 424 HD3 LYS 49 HD1 LYS 49 -0.280 13.409 -24.287 425 HE2 LYS 49 HE2 LYS 49 0.087 11.075 -23.861 426 HE3 LYS 49 HE1 LYS 49 -1.627 11.425 -23.650 427 HZ1 LYS 49 HZ1 LYS 49 -0.722 9.391 -25.089 428 HZ2 LYS 49 HZ2 LYS 49 -0.818 10.560 -26.304 429 HZ3 LYS 49 HZ3 LYS 49 -2.200 10.156 -25.408 430 H ASN 50 HN ASN 50 -5.818 12.746 -24.374 431 HA ASN 50 HA ASN 50 -6.623 12.133 -27.142 432 HB2 ASN 50 HB2 ASN 50 -6.237 10.141 -24.895 433 HB3 ASN 50 HB1 ASN 50 -6.918 9.764 -26.472 434 HD21 ASN 50 HD21 ASN 50 -5.426 10.592 -28.325 435 HD22 ASN 50 HD22 ASN 50 -3.764 10.157 -28.159 436 HA PRO 51 HA PRO 51 -10.238 13.433 -24.526 437 HB2 PRO 51 HB2 PRO 51 -11.431 14.773 -26.626 438 HB3 PRO 51 HB1 PRO 51 -10.363 15.517 -25.432 439 HG2 PRO 51 HG2 PRO 51 -9.735 14.556 -28.191 440 HG3 PRO 51 HG1 PRO 51 -9.165 16.008 -27.348 441 HD2 PRO 51 HD2 PRO 51 -7.631 13.830 -27.627 442 HD3 PRO 51 HD1 PRO 51 -7.564 14.847 -26.172 443 H GLN 52 HN GLN 52 -9.866 11.854 -27.610 444 HA GLN 52 HA GLN 52 -12.533 11.002 -28.009 445 HB2 GLN 52 HB2 GLN 52 -9.903 9.736 -28.817 446 HB3 GLN 52 HB1 GLN 52 -11.473 9.166 -29.363 447 HG2 GLN 52 HG2 GLN 52 -10.993 10.483 -31.128 448 HG3 GLN 52 HG1 GLN 52 -11.683 11.728 -30.088 449 HE21 GLN 52 HE21 GLN 52 -9.849 12.181 -32.191 450 HE22 GLN 52 HE22 GLN 52 -8.400 12.821 -31.501 451 H LEU 53 HN LEU 53 -9.824 9.680 -26.205 452 HA LEU 53 HA LEU 53 -11.186 7.279 -25.497 453 HB2 LEU 53 HB2 LEU 53 -8.712 8.583 -24.359 454 HB3 LEU 53 HB1 LEU 53 -9.321 7.029 -23.818 455 HG LEU 53 HG LEU 53 -8.457 7.634 -26.645 456 HD11 LEU 53 HD11 LEU 53 -6.996 5.980 -24.600 457 HD12 LEU 53 HD12 LEU 53 -6.626 7.675 -24.919 458 HD13 LEU 53 HD13 LEU 53 -6.439 6.476 -26.198 459 HD21 LEU 53 HD21 LEU 53 -9.812 5.857 -26.980 460 HD22 LEU 53 HD22 LEU 53 -9.687 5.301 -25.310 461 HD23 LEU 53 HD23 LEU 53 -8.380 4.973 -26.450 462 H ALA 54 HN ALA 54 -10.776 10.468 -24.094 463 HA ALA 54 HA ALA 54 -11.799 9.925 -21.515 464 HB1 ALA 54 HB1 ALA 54 -11.971 12.285 -21.260 465 HB2 ALA 54 HB2 ALA 54 -11.979 12.533 -23.008 466 HB3 ALA 54 HB3 ALA 54 -10.514 11.967 -22.204 467 H GLU 55 HN GLU 55 -13.257 10.984 -24.550 468 HA GLU 55 HA GLU 55 -15.911 11.275 -23.560 469 HB2 GLU 55 HB2 GLU 55 -15.130 12.315 -25.672 470 HB3 GLU 55 HB1 GLU 55 -14.994 10.715 -26.390 471 HG2 GLU 55 HG2 GLU 55 -17.392 10.381 -26.141 472 HG3 GLU 55 HG1 GLU 55 -17.543 11.960 -25.376 473 H GLU 56 HN GLU 56 -14.126 8.603 -24.992 474 HA GLU 56 HA GLU 56 -16.276 6.827 -25.314 475 HB2 GLU 56 HB2 GLU 56 -13.339 6.320 -24.795 476 HB3 GLU 56 HB1 GLU 56 -14.489 5.044 -25.173 477 HG2 GLU 56 HG2 GLU 56 -13.779 7.379 -26.953 478 HG3 GLU 56 HG1 GLU 56 -13.231 5.710 -27.145 479 H ASP 57 HN ASP 57 -14.150 7.441 -22.525 480 HA ASP 57 HA ASP 57 -15.805 5.615 -20.951 481 HB2 ASP 57 HB2 ASP 57 -13.157 6.979 -20.347 482 HB3 ASP 57 HB1 ASP 57 -14.073 6.109 -19.117 483 H LYS 58 HN LYS 58 -16.279 8.528 -21.913 484 HA LYS 58 HA LYS 58 -17.396 10.369 -21.229 485 HB2 LYS 58 HB2 LYS 58 -18.622 8.313 -19.400 486 HB3 LYS 58 HB1 LYS 58 -19.263 9.936 -19.624 487 HG2 LYS 58 HG2 LYS 58 -19.575 9.482 -22.014 488 HG3 LYS 58 HG1 LYS 58 -18.948 7.851 -21.776 489 HD2 LYS 58 HD2 LYS 58 -20.789 7.348 -20.256 490 HD3 LYS 58 HD1 LYS 58 -21.407 8.990 -20.448 491 HE2 LYS 58 HE2 LYS 58 -22.663 7.463 -21.848 492 HE3 LYS 58 HE1 LYS 58 -21.724 8.569 -22.850 493 HZ1 LYS 58 HZ1 LYS 58 -20.820 5.831 -22.152 494 HZ2 LYS 58 HZ2 LYS 58 -20.143 6.876 -23.296 495 HZ3 LYS 58 HZ3 LYS 58 -21.669 6.201 -23.568 496 H ILE 59 HN ILE 59 -14.972 10.608 -20.236 497 HA ILE 59 HA ILE 59 -15.095 11.095 -17.368 498 HB ILE 59 HB ILE 59 -12.850 11.595 -19.332 499 HG12 ILE 59 HG12 ILE 59 -13.420 9.223 -19.192 500 HG13 ILE 59 HG11 ILE 59 -11.866 9.531 -18.424 501 HG21 ILE 59 HG21 ILE 59 -12.651 12.975 -17.333 502 HG22 ILE 59 HG22 ILE 59 -11.411 11.723 -17.354 503 HG23 ILE 59 HG23 ILE 59 -12.823 11.547 -16.315 504 HD11 ILE 59 HD11 ILE 59 -12.799 8.163 -16.874 505 HD12 ILE 59 HD12 ILE 59 -14.443 8.692 -17.231 506 HD13 ILE 59 HD13 ILE 59 -13.375 9.715 -16.268 507 H LEU 60 HN LEU 60 -16.152 12.894 -16.770 508 HA LEU 60 HA LEU 60 -15.811 15.330 -18.378 509 HB2 LEU 60 HB2 LEU 60 -17.915 14.663 -16.318 510 HB3 LEU 60 HB1 LEU 60 -17.831 16.154 -17.236 511 HG LEU 60 HG LEU 60 -18.278 13.407 -18.415 512 HD11 LEU 60 HD11 LEU 60 -20.550 14.206 -18.846 513 HD12 LEU 60 HD12 LEU 60 -20.187 15.699 -17.980 514 HD13 LEU 60 HD13 LEU 60 -20.193 14.159 -17.120 515 HD21 LEU 60 HD21 LEU 60 -18.955 14.884 -20.412 516 HD22 LEU 60 HD22 LEU 60 -17.237 14.631 -20.100 517 HD23 LEU 60 HD23 LEU 60 -18.010 16.142 -19.614 518 H ALA 61 HN ALA 61 -14.629 13.942 -15.585 519 HA ALA 61 HA ALA 61 -13.744 16.556 -14.614 520 HB1 ALA 61 HB1 ALA 61 -14.645 14.551 -12.585 521 HB2 ALA 61 HB2 ALA 61 -15.819 15.628 -13.343 522 HB3 ALA 61 HB3 ALA 61 -14.466 16.299 -12.431 523 H THR 62 HN THR 62 -11.703 16.555 -13.769 524 HA THR 62 HA THR 62 -10.322 14.002 -13.407 525 HB THR 62 HB THR 62 -8.301 14.993 -14.488 526 HG1 THR 62 HG1 THR 62 -9.371 17.221 -14.262 527 HG21 THR 62 HG21 THR 62 -9.002 14.700 -16.797 528 HG22 THR 62 HG22 THR 62 -10.695 14.881 -16.327 529 HG23 THR 62 HG23 THR 62 -9.771 13.485 -15.770 530 HA PRO 63 HA PRO 63 -8.223 13.475 -12.962 531 HB2 PRO 63 HB2 PRO 63 -7.185 12.312 -10.767 532 HB3 PRO 63 HB1 PRO 63 -6.321 13.545 -11.691 533 HG2 PRO 63 HG2 PRO 63 -7.827 13.806 -9.128 534 HG3 PRO 63 HG1 PRO 63 -6.294 14.550 -9.618 535 HD2 PRO 63 HD2 PRO 63 -8.712 15.848 -9.667 536 HD3 PRO 63 HD1 PRO 63 -7.339 16.269 -10.709 537 H THR 64 HN THR 64 -9.002 11.399 -12.969 538 HA THR 64 HA THR 64 -11.250 10.811 -11.148 539 HB THR 64 HB THR 64 -11.333 9.317 -13.644 540 HG1 THR 64 HG1 THR 64 -11.897 12.079 -13.950 541 HG21 THR 64 HG21 THR 64 -13.176 10.824 -11.882 542 HG22 THR 64 HG22 THR 64 -13.344 9.215 -12.593 543 HG23 THR 64 HG23 THR 64 -13.658 10.651 -13.570 544 H LEU 65 HN LEU 65 -10.966 9.020 -9.958 545 HA LEU 65 HA LEU 65 -8.829 7.141 -10.740 546 HB2 LEU 65 HB2 LEU 65 -8.581 8.239 -8.548 547 HB3 LEU 65 HB1 LEU 65 -10.143 7.612 -8.060 548 HG LEU 65 HG LEU 65 -9.252 5.310 -8.233 549 HD11 LEU 65 HD11 LEU 65 -6.792 5.032 -8.393 550 HD12 LEU 65 HD12 LEU 65 -6.665 6.735 -8.836 551 HD13 LEU 65 HD13 LEU 65 -7.533 5.612 -9.884 552 HD21 LEU 65 HD21 LEU 65 -7.845 5.413 -6.240 553 HD22 LEU 65 HD22 LEU 65 -9.239 6.483 -6.091 554 HD23 LEU 65 HD23 LEU 65 -7.650 7.152 -6.461 555 H ALA 66 HN ALA 66 -9.515 5.295 -11.663 556 HA ALA 66 HA ALA 66 -11.940 4.029 -10.598 557 HB1 ALA 66 HB1 ALA 66 -13.102 3.937 -12.565 558 HB2 ALA 66 HB2 ALA 66 -11.649 4.039 -13.559 559 HB3 ALA 66 HB3 ALA 66 -12.290 5.489 -12.782 560 H LYS 67 HN LYS 67 -11.948 1.900 -10.581 561 HA LYS 67 HA LYS 67 -9.532 0.547 -11.533 562 HB2 LYS 67 HB2 LYS 67 -9.883 0.165 -9.199 563 HB3 LYS 67 HB1 LYS 67 -11.594 -0.138 -9.437 564 HG2 LYS 67 HG2 LYS 67 -11.152 -2.260 -10.445 565 HG3 LYS 67 HG1 LYS 67 -9.419 -1.934 -10.493 566 HD2 LYS 67 HD2 LYS 67 -9.434 -3.186 -8.605 567 HD3 LYS 67 HD1 LYS 67 -9.850 -1.645 -7.860 568 HE2 LYS 67 HE2 LYS 67 -11.295 -3.469 -7.081 569 HE3 LYS 67 HE1 LYS 67 -12.215 -2.225 -7.917 570 HZ1 LYS 67 HZ1 LYS 67 -11.337 -4.240 -9.720 571 HZ2 LYS 67 HZ2 LYS 67 -12.908 -3.702 -9.403 572 HZ3 LYS 67 HZ3 LYS 67 -12.222 -4.918 -8.449 573 H VAL 68 HN VAL 68 -9.880 -0.126 -13.581 574 HA VAL 68 HA VAL 68 -12.519 -0.816 -14.486 575 HB VAL 68 HB VAL 68 -11.436 -1.254 -16.659 576 HG11 VAL 68 HG11 VAL 68 -10.937 1.022 -17.165 577 HG12 VAL 68 HG12 VAL 68 -10.526 1.362 -15.484 578 HG13 VAL 68 HG13 VAL 68 -12.196 1.015 -15.930 579 HG21 VAL 68 HG21 VAL 68 -9.180 -1.787 -15.276 580 HG22 VAL 68 HG22 VAL 68 -8.857 -0.133 -15.792 581 HG23 VAL 68 HG23 VAL 68 -9.207 -1.376 -16.992 582 H LEU 69 HN LEU 69 -9.699 -2.539 -13.398 583 HA LEU 69 HA LEU 69 -11.195 -5.049 -13.777 584 HB2 LEU 69 HB2 LEU 69 -8.281 -4.655 -14.466 585 HB3 LEU 69 HB1 LEU 69 -9.092 -6.205 -14.417 586 HG LEU 69 HG LEU 69 -9.851 -3.962 -16.290 587 HD11 LEU 69 HD11 LEU 69 -8.839 -5.932 -17.854 588 HD12 LEU 69 HD12 LEU 69 -7.779 -6.035 -16.447 589 HD13 LEU 69 HD13 LEU 69 -7.936 -4.512 -17.324 590 HD21 LEU 69 HD21 LEU 69 -10.713 -6.834 -16.032 591 HD22 LEU 69 HD22 LEU 69 -10.986 -5.871 -17.485 592 HD23 LEU 69 HD23 LEU 69 -11.715 -5.383 -15.954 593 HA PRO 70 HA PRO 70 -11.103 -7.191 -13.175 594 HB2 PRO 70 HB2 PRO 70 -12.387 -7.968 -10.645 595 HB3 PRO 70 HB1 PRO 70 -11.507 -8.968 -11.806 596 HG2 PRO 70 HG2 PRO 70 -10.476 -8.396 -9.401 597 HG3 PRO 70 HG1 PRO 70 -9.450 -8.507 -10.845 598 HD2 PRO 70 HD2 PRO 70 -10.538 -6.058 -9.483 599 HD3 PRO 70 HD1 PRO 70 -8.893 -6.372 -10.078 600 HA PRO 71 HA PRO 71 -14.854 -4.814 -13.450 601 HB2 PRO 71 HB2 PRO 71 -16.489 -6.604 -14.672 602 HB3 PRO 71 HB1 PRO 71 -15.171 -5.780 -15.519 603 HG2 PRO 71 HG2 PRO 71 -15.218 -8.528 -14.311 604 HG3 PRO 71 HG1 PRO 71 -14.608 -8.018 -15.899 605 HD2 PRO 71 HD2 PRO 71 -12.956 -8.428 -13.816 606 HD3 PRO 71 HD1 PRO 71 -12.656 -7.147 -15.008 607 HA PRO 72 HA PRO 72 -17.219 -4.378 -13.747 608 HB2 PRO 72 HB2 PRO 72 -18.760 -2.813 -12.192 609 HB3 PRO 72 HB1 PRO 72 -19.350 -4.338 -12.866 610 HG2 PRO 72 HG2 PRO 72 -18.281 -3.772 -10.120 611 HG3 PRO 72 HG1 PRO 72 -19.728 -4.686 -10.585 612 HD2 PRO 72 HD2 PRO 72 -17.390 -5.893 -9.938 613 HD3 PRO 72 HD1 PRO 72 -18.514 -6.573 -11.130 614 H VAL 73 HN VAL 73 -16.937 -2.033 -13.908 615 HA VAL 73 HA VAL 73 -14.426 -1.216 -12.854 616 HB VAL 73 HB VAL 73 -16.504 0.390 -14.360 617 HG11 VAL 73 HG11 VAL 73 -15.123 1.997 -13.394 618 HG12 VAL 73 HG12 VAL 73 -14.412 1.747 -14.988 619 HG13 VAL 73 HG13 VAL 73 -13.678 1.002 -13.568 620 HG21 VAL 73 HG21 VAL 73 -14.678 -1.677 -15.187 621 HG22 VAL 73 HG22 VAL 73 -14.301 -0.154 -15.996 622 HG23 VAL 73 HG23 VAL 73 -15.921 -0.840 -16.118 623 H ARG 74 HN ARG 74 -13.968 -0.152 -11.063 624 HA ARG 74 HA ARG 74 -16.161 1.025 -9.486 625 HB2 ARG 74 HB2 ARG 74 -15.023 -0.709 -8.279 626 HB3 ARG 74 HB1 ARG 74 -13.452 -0.060 -8.716 627 HG2 ARG 74 HG2 ARG 74 -13.934 0.410 -6.401 628 HG3 ARG 74 HG1 ARG 74 -13.881 1.912 -7.325 629 HD2 ARG 74 HD2 ARG 74 -16.316 1.970 -7.400 630 HD3 ARG 74 HD1 ARG 74 -16.396 0.432 -6.542 631 HE ARG 74 HE ARG 74 -14.938 2.121 -4.928 632 HH11 ARG 74 HH11 ARG 74 -18.135 2.070 -6.305 633 HH12 ARG 74 HH12 ARG 74 -18.855 2.961 -5.005 634 HH21 ARG 74 HH21 ARG 74 -15.867 3.295 -3.208 635 HH22 ARG 74 HH22 ARG 74 -17.560 3.660 -3.239 636 H ARG 75 HN ARG 75 -16.341 3.159 -9.642 637 HA ARG 75 HA ARG 75 -13.913 4.707 -10.188 638 HB2 ARG 75 HB2 ARG 75 -16.818 5.375 -10.573 639 HB3 ARG 75 HB1 ARG 75 -15.538 6.573 -10.675 640 HG2 ARG 75 HG2 ARG 75 -14.515 5.371 -12.507 641 HG3 ARG 75 HG1 ARG 75 -15.757 4.118 -12.397 642 HD2 ARG 75 HD2 ARG 75 -16.322 7.025 -12.922 643 HD3 ARG 75 HD1 ARG 75 -16.121 5.822 -14.193 644 HE ARG 75 HE ARG 75 -18.066 4.867 -12.451 645 HH11 ARG 75 HH11 ARG 75 -17.614 7.536 -14.641 646 HH12 ARG 75 HH12 ARG 75 -19.301 7.706 -14.995 647 HH21 ARG 75 HH21 ARG 75 -20.291 5.075 -12.906 648 HH22 ARG 75 HH22 ARG 75 -20.828 6.301 -14.003 649 H ILE 76 HN ILE 76 -13.002 5.759 -8.627 650 HA ILE 76 HA ILE 76 -14.504 6.308 -6.167 651 HB ILE 76 HB ILE 76 -11.524 6.362 -6.643 652 HG12 ILE 76 HG12 ILE 76 -13.246 4.310 -5.229 653 HG13 ILE 76 HG11 ILE 76 -12.530 4.107 -6.826 654 HG21 ILE 76 HG21 ILE 76 -11.765 7.751 -4.827 655 HG22 ILE 76 HG22 ILE 76 -11.666 6.184 -4.022 656 HG23 ILE 76 HG23 ILE 76 -13.235 6.950 -4.273 657 HD11 ILE 76 HD11 ILE 76 -11.376 3.058 -4.794 658 HD12 ILE 76 HD12 ILE 76 -10.821 4.699 -4.465 659 HD13 ILE 76 HD13 ILE 76 -10.399 3.915 -5.987 660 H ILE 77 HN ILE 77 -15.305 8.331 -6.007 661 HA ILE 77 HA ILE 77 -13.868 10.501 -7.376 662 HB ILE 77 HB ILE 77 -16.771 10.527 -6.571 663 HG12 ILE 77 HG12 ILE 77 -16.615 10.485 -9.356 664 HG13 ILE 77 HG11 ILE 77 -15.449 9.271 -8.838 665 HG21 ILE 77 HG21 ILE 77 -15.442 12.275 -8.616 666 HG22 ILE 77 HG22 ILE 77 -15.448 12.700 -6.904 667 HG23 ILE 77 HG23 ILE 77 -16.972 12.523 -7.773 668 HD11 ILE 77 HD11 ILE 77 -17.822 8.498 -9.285 669 HD12 ILE 77 HD12 ILE 77 -18.253 9.321 -7.786 670 HD13 ILE 77 HD13 ILE 77 -17.086 7.999 -7.762 671 H GLY 78 HN GLY 78 -12.890 11.945 -6.150 672 HA2 GLY 78 HA2 GLY 78 -13.877 13.324 -3.996 673 HA3 GLY 78 HA1 GLY 78 -13.118 11.897 -3.299 674 H ASP 79 HN ASP 79 -11.733 13.622 -2.291 675 HA ASP 79 HA ASP 79 -9.801 14.836 -4.095 676 HB2 ASP 79 HB2 ASP 79 -10.673 16.092 -2.123 677 HB3 ASP 79 HB1 ASP 79 -9.903 14.910 -1.067 678 H LEU 80 HN LEU 80 -8.555 13.207 -4.933 679 HA LEU 80 HA LEU 80 -7.379 11.250 -3.134 680 HB2 LEU 80 HB2 LEU 80 -6.272 10.526 -5.411 681 HB3 LEU 80 HB1 LEU 80 -7.925 10.098 -5.017 682 HG LEU 80 HG LEU 80 -7.661 12.635 -6.478 683 HD11 LEU 80 HD11 LEU 80 -6.942 11.819 -8.524 684 HD12 LEU 80 HD12 LEU 80 -7.185 10.137 -8.053 685 HD13 LEU 80 HD13 LEU 80 -5.834 11.052 -7.386 686 HD21 LEU 80 HD21 LEU 80 -9.823 11.662 -6.076 687 HD22 LEU 80 HD22 LEU 80 -9.316 10.136 -6.803 688 HD23 LEU 80 HD23 LEU 80 -9.478 11.578 -7.804 689 H SER 81 HN SER 81 -6.604 14.281 -3.551 690 HA SER 81 HA SER 81 -3.847 14.157 -4.289 691 HB2 SER 81 HB2 SER 81 -5.341 16.291 -2.735 692 HB3 SER 81 HB1 SER 81 -3.733 16.467 -3.441 693 HG SER 81 HG SER 81 -6.207 16.550 -4.645 694 H ASN 82 HN ASN 82 -5.618 13.512 -1.438 695 HA ASN 82 HA ASN 82 -3.362 13.762 0.365 696 HB2 ASN 82 HB2 ASN 82 -5.660 14.321 1.112 697 HB3 ASN 82 HB1 ASN 82 -6.127 12.647 0.854 698 HD21 ASN 82 HD21 ASN 82 -6.708 13.321 3.216 699 HD22 ASN 82 HD22 ASN 82 -5.549 12.839 4.403 700 H ARG 83 HN ARG 83 -1.942 12.197 0.724 701 HA ARG 83 HA ARG 83 -2.008 9.775 -0.658 702 HB2 ARG 83 HB2 ARG 83 -0.339 10.647 1.707 703 HB3 ARG 83 HB1 ARG 83 -0.106 9.100 0.910 704 HG2 ARG 83 HG2 ARG 83 0.284 10.361 -1.221 705 HG3 ARG 83 HG1 ARG 83 0.276 11.843 -0.262 706 HD2 ARG 83 HD2 ARG 83 2.125 9.500 0.184 707 HD3 ARG 83 HD1 ARG 83 2.552 10.965 -0.700 708 HE ARG 83 HE ARG 83 2.256 10.676 2.175 709 HH11 ARG 83 HH11 ARG 83 2.596 12.838 -0.540 710 HH12 ARG 83 HH12 ARG 83 3.153 14.167 0.420 711 HH21 ARG 83 HH21 ARG 83 2.987 12.418 3.450 712 HH22 ARG 83 HH22 ARG 83 3.376 13.926 2.695 713 H GLU 84 HN GLU 84 -3.025 10.508 2.657 714 HA GLU 84 HA GLU 84 -3.330 7.869 3.551 715 HB2 GLU 84 HB2 GLU 84 -4.390 10.512 4.341 716 HB3 GLU 84 HB1 GLU 84 -5.312 9.113 4.877 717 HG2 GLU 84 HG2 GLU 84 -3.553 8.274 6.136 718 HG3 GLU 84 HG1 GLU 84 -2.353 9.255 5.292 719 H LYS 85 HN LYS 85 -5.728 9.973 1.906 720 HA LYS 85 HA LYS 85 -7.756 8.000 1.980 721 HB2 LYS 85 HB2 LYS 85 -7.385 10.404 0.178 722 HB3 LYS 85 HB1 LYS 85 -8.787 9.346 0.068 723 HG2 LYS 85 HG2 LYS 85 -9.377 9.891 2.377 724 HG3 LYS 85 HG1 LYS 85 -7.978 10.959 2.481 725 HD2 LYS 85 HD2 LYS 85 -8.902 12.301 0.620 726 HD3 LYS 85 HD1 LYS 85 -10.316 11.248 0.594 727 HE2 LYS 85 HE2 LYS 85 -9.429 12.918 2.945 728 HE3 LYS 85 HE1 LYS 85 -10.726 13.338 1.828 729 HZ1 LYS 85 HZ1 LYS 85 -11.491 10.905 2.589 730 HZ2 LYS 85 HZ2 LYS 85 -11.981 12.322 3.372 731 HZ3 LYS 85 HZ3 LYS 85 -10.700 11.411 3.996 732 H VAL 86 HN VAL 86 -5.272 8.729 -0.414 733 HA VAL 86 HA VAL 86 -6.142 6.898 -2.360 734 HB VAL 86 HB VAL 86 -3.357 7.926 -1.761 735 HG11 VAL 86 HG11 VAL 86 -4.343 6.080 -3.915 736 HG12 VAL 86 HG12 VAL 86 -2.918 5.923 -2.888 737 HG13 VAL 86 HG13 VAL 86 -2.951 7.133 -4.169 738 HG21 VAL 86 HG21 VAL 86 -3.989 9.011 -4.079 739 HG22 VAL 86 HG22 VAL 86 -4.514 9.730 -2.557 740 HG23 VAL 86 HG23 VAL 86 -5.631 8.741 -3.497 741 H LEU 87 HN LEU 87 -3.961 6.491 0.414 742 HA LEU 87 HA LEU 87 -3.368 3.760 -0.102 743 HB2 LEU 87 HB2 LEU 87 -2.948 5.678 2.081 744 HB3 LEU 87 HB1 LEU 87 -3.124 4.017 2.614 745 HG LEU 87 HG LEU 87 -1.150 4.821 0.489 746 HD11 LEU 87 HD11 LEU 87 -0.167 4.274 3.207 747 HD12 LEU 87 HD12 LEU 87 -1.025 5.804 3.013 748 HD13 LEU 87 HD13 LEU 87 0.385 5.449 2.012 749 HD21 LEU 87 HD21 LEU 87 -2.077 2.360 1.258 750 HD22 LEU 87 HD22 LEU 87 -0.637 2.545 2.262 751 HD23 LEU 87 HD23 LEU 87 -0.507 2.666 0.509 752 H ILE 88 HN ILE 88 -5.810 5.322 1.949 753 HA ILE 88 HA ILE 88 -6.830 2.951 3.062 754 HB ILE 88 HB ILE 88 -8.095 5.643 2.611 755 HG12 ILE 88 HG12 ILE 88 -7.245 4.276 5.168 756 HG13 ILE 88 HG11 ILE 88 -6.168 5.305 4.229 757 HG21 ILE 88 HG21 ILE 88 -9.596 4.437 4.567 758 HG22 ILE 88 HG22 ILE 88 -9.357 3.131 3.404 759 HG23 ILE 88 HG23 ILE 88 -10.085 4.652 2.886 760 HD11 ILE 88 HD11 ILE 88 -8.405 6.863 4.551 761 HD12 ILE 88 HD12 ILE 88 -6.913 6.965 5.489 762 HD13 ILE 88 HD13 ILE 88 -8.272 6.010 6.088 763 H ALA 89 HN ALA 89 -7.890 4.788 0.192 764 HA ALA 89 HA ALA 89 -9.997 3.029 -0.497 765 HB1 ALA 89 HB1 ALA 89 -10.340 4.381 -2.286 766 HB2 ALA 89 HB2 ALA 89 -8.622 4.493 -2.671 767 HB3 ALA 89 HB3 ALA 89 -9.297 5.459 -1.357 768 H LEU 90 HN LEU 90 -6.599 3.138 -1.497 769 HA LEU 90 HA LEU 90 -6.805 1.010 -3.377 770 HB2 LEU 90 HB2 LEU 90 -4.630 2.579 -2.148 771 HB3 LEU 90 HB1 LEU 90 -4.185 0.965 -2.657 772 HG LEU 90 HG LEU 90 -4.705 1.434 -4.933 773 HD11 LEU 90 HD11 LEU 90 -5.708 3.464 -5.725 774 HD12 LEU 90 HD12 LEU 90 -5.738 4.138 -4.093 775 HD13 LEU 90 HD13 LEU 90 -6.764 2.762 -4.497 776 HD21 LEU 90 HD21 LEU 90 -3.080 3.045 -5.434 777 HD22 LEU 90 HD22 LEU 90 -2.587 2.376 -3.876 778 HD23 LEU 90 HD23 LEU 90 -3.391 3.945 -3.950 779 H ARG 91 HN ARG 91 -6.037 1.147 0.071 780 HA ARG 91 HA ARG 91 -5.170 -1.529 0.411 781 HB2 ARG 91 HB2 ARG 91 -4.859 0.257 2.093 782 HB3 ARG 91 HB1 ARG 91 -6.595 0.276 2.375 783 HG2 ARG 91 HG2 ARG 91 -6.509 -2.011 3.191 784 HG3 ARG 91 HG1 ARG 91 -4.777 -2.078 2.860 785 HD2 ARG 91 HD2 ARG 91 -4.397 -0.277 4.470 786 HD3 ARG 91 HD1 ARG 91 -6.130 -0.194 4.791 787 HE ARG 91 HE ARG 91 -5.278 -2.817 5.252 788 HH11 ARG 91 HH11 ARG 91 -4.856 0.375 6.580 789 HH12 ARG 91 HH12 ARG 91 -4.583 -0.189 8.195 790 HH21 ARG 91 HH21 ARG 91 -4.921 -3.575 7.371 791 HH22 ARG 91 HH22 ARG 91 -4.618 -2.443 8.645 792 H LEU 92 HN LEU 92 -8.386 -0.034 0.722 793 HA LEU 92 HA LEU 92 -9.741 -2.403 1.450 794 HB2 LEU 92 HB2 LEU 92 -10.706 0.152 0.172 795 HB3 LEU 92 HB1 LEU 92 -11.788 -1.142 0.650 796 HG LEU 92 HG LEU 92 -9.954 0.307 2.560 797 HD11 LEU 92 HD11 LEU 92 -11.469 1.951 1.863 798 HD12 LEU 92 HD12 LEU 92 -12.163 1.304 3.349 799 HD13 LEU 92 HD13 LEU 92 -12.810 0.808 1.786 800 HD21 LEU 92 HD21 LEU 92 -11.667 -0.681 4.195 801 HD22 LEU 92 HD22 LEU 92 -10.459 -1.766 3.507 802 HD23 LEU 92 HD23 LEU 92 -12.104 -1.761 2.871 803 H LEU 93 HN LEU 93 -9.065 -0.926 -1.661 804 HA LEU 93 HA LEU 93 -10.656 -2.660 -3.237 805 HB2 LEU 93 HB2 LEU 93 -8.267 -0.958 -3.915 806 HB3 LEU 93 HB1 LEU 93 -9.135 -1.898 -5.113 807 HG LEU 93 HG LEU 93 -10.384 0.272 -3.426 808 HD11 LEU 93 HD11 LEU 93 -9.155 1.614 -4.750 809 HD12 LEU 93 HD12 LEU 93 -10.388 1.227 -5.949 810 HD13 LEU 93 HD13 LEU 93 -8.860 0.347 -5.941 811 HD21 LEU 93 HD21 LEU 93 -12.325 -0.471 -4.210 812 HD22 LEU 93 HD22 LEU 93 -11.495 -1.791 -5.034 813 HD23 LEU 93 HD23 LEU 93 -11.747 -0.254 -5.862 814 H ALA 94 HN ALA 94 -7.310 -2.777 -2.142 815 HA ALA 94 HA ALA 94 -6.538 -5.019 -3.731 816 HB1 ALA 94 HB1 ALA 94 -4.485 -4.846 -2.742 817 HB2 ALA 94 HB2 ALA 94 -5.159 -4.449 -1.161 818 HB3 ALA 94 HB3 ALA 94 -5.091 -3.220 -2.423 819 H GLU 95 HN GLU 95 -7.878 -4.501 -0.563 820 HA GLU 95 HA GLU 95 -7.607 -7.061 0.474 821 HB2 GLU 95 HB2 GLU 95 -8.143 -5.077 1.804 822 HB3 GLU 95 HB1 GLU 95 -9.674 -4.903 0.961 823 HG2 GLU 95 HG2 GLU 95 -10.467 -6.946 1.897 824 HG3 GLU 95 HG1 GLU 95 -8.914 -7.232 2.674 825 H GLU 96 HN GLU 96 -10.076 -5.555 -1.529 826 HA GLU 96 HA GLU 96 -12.021 -7.577 -1.475 827 HB2 GLU 96 HB2 GLU 96 -11.291 -5.537 -3.591 828 HB3 GLU 96 HB1 GLU 96 -12.700 -6.586 -3.710 829 HG2 GLU 96 HG2 GLU 96 -12.183 -4.559 -1.541 830 HG3 GLU 96 HG1 GLU 96 -13.310 -4.384 -2.886 831 H ILE 97 HN ILE 97 -9.204 -7.078 -3.523 832 HA ILE 97 HA ILE 97 -9.662 -9.147 -5.377 833 HB ILE 97 HB ILE 97 -7.094 -7.838 -4.466 834 HG12 ILE 97 HG12 ILE 97 -8.671 -7.416 -6.998 835 HG13 ILE 97 HG11 ILE 97 -8.925 -6.460 -5.538 836 HG21 ILE 97 HG21 ILE 97 -7.603 -9.666 -6.812 837 HG22 ILE 97 HG22 ILE 97 -6.515 -9.958 -5.455 838 HG23 ILE 97 HG23 ILE 97 -6.155 -8.677 -6.614 839 HD11 ILE 97 HD11 ILE 97 -6.321 -6.694 -7.001 840 HD12 ILE 97 HD12 ILE 97 -6.677 -5.662 -5.617 841 HD13 ILE 97 HD13 ILE 97 -7.469 -5.366 -7.161 842 H GLY 98 HN GLY 98 -7.752 -9.033 -2.380 843 HA2 GLY 98 HA2 GLY 98 -6.808 -11.692 -2.469 844 HA3 GLY 98 HA1 GLY 98 -6.919 -10.695 -1.026 845 H ASP 99 HN ASP 99 -9.749 -10.294 -1.144 846 HA ASP 99 HA ASP 99 -10.645 -12.551 0.288 847 HB2 ASP 99 HB2 ASP 99 -11.554 -10.252 0.566 848 HB3 ASP 99 HB1 ASP 99 -12.331 -10.398 -1.007 849 H TYR 100 HN TYR 100 -11.130 -11.551 -3.063 850 HA TYR 100 HA TYR 100 -13.012 -13.567 -3.707 851 HB2 TYR 100 HB2 TYR 100 -12.856 -11.505 -5.014 852 HB3 TYR 100 HB1 TYR 100 -11.209 -11.911 -5.486 853 HD1 TYR 100 HD1 TYR 100 -14.728 -13.089 -5.766 854 HD2 TYR 100 HD2 TYR 100 -10.808 -13.165 -7.423 855 HE1 TYR 100 HE1 TYR 100 -15.591 -14.267 -7.745 856 HE2 TYR 100 HE2 TYR 100 -11.663 -14.343 -9.405 857 HH TYR 100 HH TYR 100 -14.134 -15.983 -9.645 858 H LYS 101 HN LYS 101 -12.696 -15.608 -4.153 859 HA LYS 101 HA LYS 101 -9.953 -16.549 -4.619 860 HB2 LYS 101 HB2 LYS 101 -12.311 -18.075 -3.493 861 HB3 LYS 101 HB1 LYS 101 -10.696 -18.724 -3.730 862 HG2 LYS 101 HG2 LYS 101 -11.385 -16.441 -1.890 863 HG3 LYS 101 HG1 LYS 101 -11.157 -18.119 -1.391 864 HD2 LYS 101 HD2 LYS 101 -8.846 -18.017 -2.303 865 HD3 LYS 101 HD1 LYS 101 -9.095 -16.302 -2.642 866 HE2 LYS 101 HE2 LYS 101 -9.305 -17.574 0.085 867 HE3 LYS 101 HE1 LYS 101 -7.887 -16.716 -0.519 868 HZ1 LYS 101 HZ1 LYS 101 -9.514 -15.425 0.920 869 HZ2 LYS 101 HZ2 LYS 101 -10.549 -15.427 -0.420 870 HZ3 LYS 101 HZ3 LYS 101 -9.025 -14.693 -0.530 871 H ASP 102 HN ASP 102 -9.527 -17.966 -6.290 872 HA ASP 102 HA ASP 102 -11.114 -17.775 -8.608 873 HB2 ASP 102 HB2 ASP 102 -8.672 -18.179 -8.647 874 HB3 ASP 102 HB1 ASP 102 -8.943 -19.796 -8.001 875 H ASP 103 HN ASP 103 -10.752 -20.354 -6.217 876 HA ASP 103 HA ASP 103 -13.339 -21.422 -6.925 877 HB2 ASP 103 HB2 ASP 103 -11.426 -22.495 -8.411 878 HB3 ASP 103 HB1 ASP 103 -11.119 -23.435 -6.955 879 H ASP 104 HN ASP 104 -14.020 -23.116 -5.389 880 HA ASP 104 HA ASP 104 -13.363 -22.409 -2.722 881 HB2 ASP 104 HB2 ASP 104 -15.584 -23.294 -3.477 882 HB3 ASP 104 HB1 ASP 104 -14.840 -24.883 -3.639 883 H ASP 105 HN ASP 105 -12.222 -24.905 -4.867 884 HA ASP 105 HA ASP 105 -10.096 -25.563 -3.024 885 HB2 ASP 105 HB2 ASP 105 -12.210 -27.078 -2.591 886 HB3 ASP 105 HB1 ASP 105 -11.660 -27.912 -4.041 887 H LYS 106 HN LYS 106 -8.492 -27.027 -4.055 888 HA LYS 106 HA LYS 106 -8.207 -26.318 -6.854 889 HB2 LYS 106 HB2 LYS 106 -6.406 -27.537 -4.787 890 HB3 LYS 106 HB1 LYS 106 -5.986 -27.642 -6.492 891 HG2 LYS 106 HG2 LYS 106 -5.932 -25.250 -6.686 892 HG3 LYS 106 HG1 LYS 106 -6.534 -25.062 -5.039 893 HD2 LYS 106 HD2 LYS 106 -4.180 -24.683 -4.984 894 HD3 LYS 106 HD1 LYS 106 -4.475 -26.259 -4.249 895 HE2 LYS 106 HE2 LYS 106 -2.573 -26.423 -5.710 896 HE3 LYS 106 HE1 LYS 106 -3.914 -27.323 -6.416 897 HZ1 LYS 106 HZ1 LYS 106 -3.806 -24.581 -7.269 898 HZ2 LYS 106 HZ2 LYS 106 -3.955 -25.992 -8.187 899 HZ3 LYS 106 HZ3 LYS 106 -2.426 -25.461 -7.697
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