NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
631817 | 6ehz | 34176 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 LYS 1 HT1 LYS 1 25.129 8.435 -5.188 2 H2 LYS 1 HT2 LYS 1 25.506 8.761 -3.572 3 H3 LYS 1 HT3 LYS 1 26.123 9.746 -4.794 4 HA LYS 1 HA LYS 1 23.949 10.544 -5.346 5 HB2 LYS 1 HB2 LYS 1 23.078 8.677 -3.134 6 HB3 LYS 1 HB1 LYS 1 22.052 9.926 -3.821 7 HG2 LYS 1 HG2 LYS 1 22.171 8.844 -5.997 8 HG3 LYS 1 HG1 LYS 1 23.228 7.602 -5.329 9 HD2 LYS 1 HD2 LYS 1 20.932 6.796 -5.472 10 HD3 LYS 1 HD1 LYS 1 21.444 6.922 -3.788 11 HE2 LYS 1 HE2 LYS 1 20.258 9.020 -3.555 12 HE3 LYS 1 HE1 LYS 1 19.817 8.988 -5.259 13 HZ1 LYS 1 HZ1 LYS 1 17.998 8.255 -3.868 14 HZ2 LYS 1 HZ2 LYS 1 18.950 7.024 -3.212 15 HZ3 LYS 1 HZ3 LYS 1 18.531 6.986 -4.848 16 HA PRO 2 HA PRO 2 24.996 13.553 -2.222 17 HB2 PRO 2 HB2 PRO 2 23.208 15.456 -2.926 18 HB3 PRO 2 HB1 PRO 2 24.664 15.132 -3.874 19 HG2 PRO 2 HG2 PRO 2 21.860 14.202 -4.339 20 HG3 PRO 2 HG1 PRO 2 23.028 14.845 -5.505 21 HD2 PRO 2 HD2 PRO 2 22.557 12.193 -5.223 22 HD3 PRO 2 HD1 PRO 2 24.145 12.839 -5.680 23 H VAL 3 HN VAL 3 24.095 14.405 -0.315 24 HA VAL 3 HA VAL 3 21.964 12.797 0.767 25 HB VAL 3 HB VAL 3 23.458 15.082 2.068 26 HG11 VAL 3 HG11 VAL 3 22.743 14.039 4.171 27 HG12 VAL 3 HG12 VAL 3 21.816 12.853 3.257 28 HG13 VAL 3 HG13 VAL 3 21.370 14.556 3.193 29 HG21 VAL 3 HG21 VAL 3 24.022 12.121 2.133 30 HG22 VAL 3 HG22 VAL 3 24.840 13.337 3.112 31 HG23 VAL 3 HG23 VAL 3 25.011 13.357 1.357 32 H SER 4 HN SER 4 19.903 13.292 0.490 33 HA SER 4 HA SER 4 18.991 15.862 -0.326 34 HB2 SER 4 HB2 SER 4 17.423 13.493 0.733 35 HB3 SER 4 HB1 SER 4 16.749 14.874 -0.132 36 HG SER 4 HG SER 4 18.429 14.180 -1.806 37 H LEU 5 HN LEU 5 17.161 16.980 0.935 38 HA LEU 5 HA LEU 5 18.264 17.962 3.315 39 HB2 LEU 5 HB2 LEU 5 15.549 18.232 2.074 40 HB3 LEU 5 HB1 LEU 5 15.879 18.916 3.649 41 HG LEU 5 HG LEU 5 16.097 20.643 2.004 42 HD11 LEU 5 HD11 LEU 5 17.685 20.650 3.880 43 HD12 LEU 5 HD12 LEU 5 18.342 21.412 2.432 44 HD13 LEU 5 HD13 LEU 5 18.849 19.783 2.876 45 HD21 LEU 5 HD21 LEU 5 18.085 18.844 0.631 46 HD22 LEU 5 HD22 LEU 5 17.756 20.521 0.196 47 HD23 LEU 5 HD23 LEU 5 16.491 19.304 0.031 48 H SER 6 HN SER 6 15.078 16.379 3.140 49 HA SER 6 HA SER 6 15.769 14.508 5.187 50 HB2 SER 6 HB2 SER 6 15.411 16.661 6.469 51 HB3 SER 6 HB1 SER 6 13.728 16.606 5.950 52 HG SER 6 HG SER 6 13.726 15.586 7.872 53 H TYR 7 HN TYR 7 14.406 14.868 2.454 54 HA TYR 7 HA TYR 7 11.753 13.945 2.787 55 HB2 TYR 7 HB2 TYR 7 12.484 14.824 0.626 56 HB3 TYR 7 HB1 TYR 7 13.645 13.510 0.473 57 HD1 TYR 7 HD1 TYR 7 10.017 14.252 0.642 58 HD2 TYR 7 HD2 TYR 7 13.008 11.429 -0.443 59 HE1 TYR 7 HE1 TYR 7 8.314 12.897 -0.499 60 HE2 TYR 7 HE2 TYR 7 11.312 10.062 -1.584 61 HH TYR 7 HH TYR 7 8.249 11.203 -2.351 62 H ARG 8 HN ARG 8 11.088 12.109 3.555 63 HA ARG 8 HA ARG 8 12.429 9.633 2.997 64 HB2 ARG 8 HB2 ARG 8 12.967 9.008 5.238 65 HB3 ARG 8 HB1 ARG 8 13.677 10.590 4.968 66 HG2 ARG 8 HG2 ARG 8 11.657 11.568 6.109 67 HG3 ARG 8 HG1 ARG 8 11.217 9.921 6.561 68 HD2 ARG 8 HD2 ARG 8 12.384 10.744 8.414 69 HD3 ARG 8 HD1 ARG 8 13.565 9.757 7.554 70 HE ARG 8 HE ARG 8 13.470 12.673 7.163 71 HH11 ARG 8 HH11 ARG 8 15.223 9.796 8.128 72 HH12 ARG 8 HH12 ARG 8 16.742 10.622 8.266 73 HH21 ARG 8 HH21 ARG 8 15.454 13.759 7.375 74 HH22 ARG 8 HH22 ARG 8 16.881 12.864 7.814 75 H CYS 9 HN CYS 9 10.943 8.082 2.809 76 HA CYS 9 HA CYS 9 8.322 8.510 4.018 77 HB2 CYS 9 HB2 CYS 9 9.246 6.843 1.676 78 HB3 CYS 9 HB1 CYS 9 7.640 6.719 2.361 79 HA PRO 10 HA PRO 10 8.337 5.426 7.129 80 HB2 PRO 10 HB2 PRO 10 6.646 3.832 5.262 81 HB3 PRO 10 HB1 PRO 10 6.433 4.123 6.991 82 HG2 PRO 10 HG2 PRO 10 5.082 5.496 5.091 83 HG3 PRO 10 HG1 PRO 10 5.506 6.172 6.667 84 HD2 PRO 10 HD2 PRO 10 6.527 6.887 4.042 85 HD3 PRO 10 HD1 PRO 10 6.748 7.723 5.586 86 H CYS 11 HN CYS 11 8.390 3.824 3.932 87 HA CYS 11 HA CYS 11 10.553 2.131 4.970 88 HB2 CYS 11 HB2 CYS 11 8.534 1.013 3.988 89 HB3 CYS 11 HB1 CYS 11 8.986 1.716 2.445 90 H ARG 12 HN ARG 12 12.519 2.147 4.128 91 HA ARG 12 HA ARG 12 13.351 4.102 2.230 92 HB2 ARG 12 HB2 ARG 12 14.800 1.700 3.361 93 HB3 ARG 12 HB1 ARG 12 15.539 2.906 2.312 94 HG2 ARG 12 HG2 ARG 12 14.292 3.517 4.979 95 HG3 ARG 12 HG1 ARG 12 16.014 3.241 4.718 96 HD2 ARG 12 HD2 ARG 12 16.073 5.135 3.162 97 HD3 ARG 12 HD1 ARG 12 14.354 5.411 3.438 98 HE ARG 12 HE ARG 12 15.158 5.664 5.892 99 HH11 ARG 12 HH11 ARG 12 16.867 6.746 3.032 100 HH12 ARG 12 HH12 ARG 12 17.644 8.064 3.845 101 HH21 ARG 12 HH21 ARG 12 16.193 7.405 6.958 102 HH22 ARG 12 HH22 ARG 12 17.267 8.437 6.065 103 H PHE 13 HN PHE 13 15.086 2.690 0.525 104 HA PHE 13 HA PHE 13 13.063 2.192 -1.443 105 HB2 PHE 13 HB2 PHE 13 16.078 2.011 -1.676 106 HB3 PHE 13 HB1 PHE 13 14.938 2.065 -3.018 107 HD1 PHE 13 HD1 PHE 13 13.843 4.122 -3.642 108 HD2 PHE 13 HD2 PHE 13 16.538 3.983 -0.354 109 HE1 PHE 13 HE1 PHE 13 13.927 6.573 -3.611 110 HE2 PHE 13 HE2 PHE 13 16.627 6.425 -0.313 111 HZ PHE 13 HZ PHE 13 15.322 7.737 -1.946 112 H PHE 14 HN PHE 14 12.714 0.314 -2.585 113 HA PHE 14 HA PHE 14 12.881 -1.906 -0.714 114 HB2 PHE 14 HB2 PHE 14 11.060 -2.293 -2.923 115 HB3 PHE 14 HB1 PHE 14 10.738 -2.257 -1.206 116 HD1 PHE 14 HD1 PHE 14 10.063 -0.201 -0.095 117 HD2 PHE 14 HD2 PHE 14 10.782 -0.307 -4.289 118 HE1 PHE 14 HE1 PHE 14 8.917 1.959 -0.341 119 HE2 PHE 14 HE2 PHE 14 9.639 1.857 -4.539 120 HZ PHE 14 HZ PHE 14 8.705 2.992 -2.565 121 H GLU 15 HN GLU 15 12.667 -4.143 -1.810 122 HA GLU 15 HA GLU 15 15.128 -4.353 -3.382 123 HB2 GLU 15 HB2 GLU 15 13.636 -6.471 -1.831 124 HB3 GLU 15 HB1 GLU 15 15.246 -6.622 -2.521 125 HG2 GLU 15 HG2 GLU 15 14.553 -4.597 -0.419 126 HG3 GLU 15 HG1 GLU 15 15.117 -6.221 -0.039 127 H SER 16 HN SER 16 15.099 -4.988 -5.431 128 HA SER 16 HA SER 16 12.574 -5.894 -6.598 129 HB2 SER 16 HB2 SER 16 15.157 -5.047 -7.941 130 HB3 SER 16 HB1 SER 16 13.645 -5.422 -8.765 131 HG SER 16 HG SER 16 13.930 -3.380 -6.816 132 H HIS 17 HN HIS 17 14.047 -7.723 -4.953 133 HA HIS 17 HA HIS 17 14.530 -9.781 -6.985 134 HB2 HIS 17 HB2 HIS 17 16.375 -10.714 -5.682 135 HB3 HIS 17 HB1 HIS 17 16.714 -9.073 -6.198 136 HD1 HIS 17 HD1 HIS 17 17.557 -7.546 -4.451 137 HD2 HIS 17 HD2 HIS 17 15.592 -10.830 -2.831 138 HE1 HIS 17 HE1 HIS 17 17.883 -7.373 -1.965 139 HE2 HIS 17 HE2 HIS 17 16.789 -9.430 -1.015 140 H ILE 18 HN ILE 18 12.881 -8.803 -4.309 141 HA ILE 18 HA ILE 18 12.567 -11.212 -2.868 142 HB ILE 18 HB ILE 18 10.759 -8.813 -3.052 143 HG12 ILE 18 HG12 ILE 18 12.767 -9.631 -0.961 144 HG13 ILE 18 HG11 ILE 18 13.016 -8.377 -2.167 145 HG21 ILE 18 HG21 ILE 18 10.698 -11.102 -1.094 146 HG22 ILE 18 HG22 ILE 18 9.477 -10.733 -2.313 147 HG23 ILE 18 HG23 ILE 18 9.742 -9.624 -0.966 148 HD11 ILE 18 HD11 ILE 18 11.111 -7.138 -1.194 149 HD12 ILE 18 HD12 ILE 18 12.455 -7.365 -0.075 150 HD13 ILE 18 HD13 ILE 18 11.009 -8.362 0.073 151 H ALA 19 HN ALA 19 11.170 -12.844 -3.044 152 HA ALA 19 HA ALA 19 9.481 -12.928 -5.452 153 HB1 ALA 19 HB1 ALA 19 9.769 -15.324 -5.441 154 HB2 ALA 19 HB2 ALA 19 10.657 -15.243 -3.921 155 HB3 ALA 19 HB3 ALA 19 11.351 -14.546 -5.387 156 H ARG 20 HN ARG 20 7.490 -14.093 -5.303 157 HA ARG 20 HA ARG 20 5.915 -13.486 -3.048 158 HB2 ARG 20 HB2 ARG 20 5.136 -13.752 -5.438 159 HB3 ARG 20 HB1 ARG 20 5.332 -15.489 -5.217 160 HG2 ARG 20 HG2 ARG 20 3.678 -15.486 -3.464 161 HG3 ARG 20 HG1 ARG 20 3.496 -13.737 -3.608 162 HD2 ARG 20 HD2 ARG 20 2.615 -13.939 -5.814 163 HD3 ARG 20 HD1 ARG 20 3.015 -15.656 -5.872 164 HE ARG 20 HE ARG 20 1.302 -15.272 -3.713 165 HH11 ARG 20 HH11 ARG 20 1.192 -14.905 -7.187 166 HH12 ARG 20 HH12 ARG 20 -0.488 -15.319 -7.303 167 HH21 ARG 20 HH21 ARG 20 -0.915 -15.796 -3.856 168 HH22 ARG 20 HH22 ARG 20 -1.689 -15.814 -5.407 169 H ALA 21 HN ALA 21 7.635 -16.300 -4.165 170 HA ALA 21 HA ALA 21 6.523 -18.039 -2.167 171 HB1 ALA 21 HB1 ALA 21 8.836 -18.473 -4.045 172 HB2 ALA 21 HB2 ALA 21 7.157 -18.920 -4.354 173 HB3 ALA 21 HB3 ALA 21 8.057 -19.713 -3.061 174 H ASN 22 HN ASN 22 8.732 -15.619 -2.082 175 HA ASN 22 HA ASN 22 10.278 -16.897 0.048 176 HB2 ASN 22 HB2 ASN 22 10.910 -14.863 -2.021 177 HB3 ASN 22 HB1 ASN 22 11.639 -14.624 -0.440 178 HD21 ASN 22 HD21 ASN 22 13.227 -15.979 0.257 179 HD22 ASN 22 HD22 ASN 22 13.966 -17.169 -0.750 180 H VAL 23 HN VAL 23 7.694 -14.921 -0.391 181 HA VAL 23 HA VAL 23 8.387 -13.244 1.909 182 HB VAL 23 HB VAL 23 7.832 -11.975 -0.082 183 HG11 VAL 23 HG11 VAL 23 6.361 -13.491 -1.234 184 HG12 VAL 23 HG12 VAL 23 5.499 -11.978 -0.933 185 HG13 VAL 23 HG13 VAL 23 5.180 -13.391 0.076 186 HG21 VAL 23 HG21 VAL 23 6.245 -10.485 0.876 187 HG22 VAL 23 HG22 VAL 23 7.280 -11.140 2.155 188 HG23 VAL 23 HG23 VAL 23 5.641 -11.753 1.940 189 H LYS 24 HN LYS 24 7.047 -12.929 3.544 190 HA LYS 24 HA LYS 24 4.911 -14.859 4.037 191 HB2 LYS 24 HB2 LYS 24 6.280 -12.957 5.952 192 HB3 LYS 24 HB1 LYS 24 5.097 -14.176 6.380 193 HG2 LYS 24 HG2 LYS 24 6.702 -15.903 5.568 194 HG3 LYS 24 HG1 LYS 24 7.869 -14.605 5.357 195 HD2 LYS 24 HD2 LYS 24 8.109 -14.247 7.575 196 HD3 LYS 24 HD1 LYS 24 6.504 -14.831 7.986 197 HE2 LYS 24 HE2 LYS 24 8.838 -16.549 7.148 198 HE3 LYS 24 HE1 LYS 24 8.336 -16.272 8.811 199 HZ1 LYS 24 HZ1 LYS 24 6.646 -17.528 6.720 200 HZ2 LYS 24 HZ2 LYS 24 6.223 -17.304 8.340 201 HZ3 LYS 24 HZ3 LYS 24 7.477 -18.363 7.932 202 H HIS 25 HN HIS 25 3.706 -13.232 6.032 203 HA HIS 25 HA HIS 25 1.583 -12.012 4.977 204 HB2 HIS 25 HB2 HIS 25 2.864 -10.320 7.050 205 HB3 HIS 25 HB1 HIS 25 1.222 -10.921 6.968 206 HD1 HIS 25 HD1 HIS 25 2.347 -10.906 9.628 207 HD2 HIS 25 HD2 HIS 25 3.077 -14.130 7.103 208 HE1 HIS 25 HE1 HIS 25 2.981 -12.817 11.127 209 HE2 HIS 25 HE2 HIS 25 3.432 -14.749 9.581 210 H LEU 26 HN LEU 26 1.304 -10.472 3.468 211 HA LEU 26 HA LEU 26 3.438 -8.474 3.153 212 HB2 LEU 26 HB2 LEU 26 3.357 -10.024 1.295 213 HB3 LEU 26 HB1 LEU 26 1.652 -9.701 1.051 214 HG LEU 26 HG LEU 26 2.114 -7.478 0.265 215 HD11 LEU 26 HD11 LEU 26 3.900 -6.912 1.813 216 HD12 LEU 26 HD12 LEU 26 4.401 -6.612 0.157 217 HD13 LEU 26 HD13 LEU 26 4.976 -8.043 1.007 218 HD21 LEU 26 HD21 LEU 26 2.706 -9.646 -1.153 219 HD22 LEU 26 HD22 LEU 26 4.332 -8.945 -1.073 220 HD23 LEU 26 HD23 LEU 26 2.998 -8.020 -1.767 221 H LYS 27 HN LYS 27 2.948 -6.412 3.197 222 HA LYS 27 HA LYS 27 0.137 -5.535 3.243 223 HB2 LYS 27 HB2 LYS 27 0.666 -5.732 5.541 224 HB3 LYS 27 HB1 LYS 27 2.289 -5.127 5.293 225 HG2 LYS 27 HG2 LYS 27 1.050 -3.463 6.440 226 HG3 LYS 27 HG1 LYS 27 1.342 -2.904 4.787 227 HD2 LYS 27 HD2 LYS 27 -0.923 -3.521 4.158 228 HD3 LYS 27 HD1 LYS 27 -1.215 -4.196 5.761 229 HE2 LYS 27 HE2 LYS 27 -0.923 -1.984 6.751 230 HE3 LYS 27 HE1 LYS 27 -0.601 -1.306 5.156 231 HZ1 LYS 27 HZ1 LYS 27 -3.145 -2.595 5.982 232 HZ2 LYS 27 HZ2 LYS 27 -2.832 -1.885 4.483 233 HZ3 LYS 27 HZ3 LYS 27 -2.886 -0.929 5.873 234 H ILE 28 HN ILE 28 -0.169 -3.379 2.500 235 HA ILE 28 HA ILE 28 2.244 -2.077 1.434 236 HB ILE 28 HB ILE 28 -0.550 -1.327 0.620 237 HG12 ILE 28 HG12 ILE 28 0.317 -2.815 -1.465 238 HG13 ILE 28 HG11 ILE 28 1.013 -3.715 -0.130 239 HG21 ILE 28 HG21 ILE 28 2.175 -1.009 -0.646 240 HG22 ILE 28 HG22 ILE 28 1.149 0.261 0.032 241 HG23 ILE 28 HG23 ILE 28 0.651 -0.585 -1.433 242 HD11 ILE 28 HD11 ILE 28 -1.168 -4.584 -0.777 243 HD12 ILE 28 HD12 ILE 28 -1.895 -3.012 -0.432 244 HD13 ILE 28 HD13 ILE 28 -1.176 -3.960 0.872 245 H LEU 29 HN LEU 29 2.889 -0.248 2.334 246 HA LEU 29 HA LEU 29 1.390 0.870 4.535 247 HB2 LEU 29 HB2 LEU 29 3.990 0.589 4.237 248 HB3 LEU 29 HB1 LEU 29 3.853 2.114 3.391 249 HG LEU 29 HG LEU 29 4.552 2.464 5.689 250 HD11 LEU 29 HD11 LEU 29 1.740 3.432 5.143 251 HD12 LEU 29 HD12 LEU 29 3.253 4.238 4.718 252 HD13 LEU 29 HD13 LEU 29 2.801 4.056 6.412 253 HD21 LEU 29 HD21 LEU 29 3.096 1.926 7.559 254 HD22 LEU 29 HD22 LEU 29 3.540 0.471 6.668 255 HD23 LEU 29 HD23 LEU 29 1.938 1.179 6.462 256 H ASN 30 HN ASN 30 0.006 2.483 4.386 257 HA ASN 30 HA ASN 30 -0.317 3.997 1.967 258 HB2 ASN 30 HB2 ASN 30 -1.626 4.039 4.668 259 HB3 ASN 30 HB1 ASN 30 -1.968 5.271 3.477 260 HD21 ASN 30 HD21 ASN 30 -1.952 3.598 1.163 261 HD22 ASN 30 HD22 ASN 30 -3.326 2.561 1.270 262 H THR 31 HN THR 31 1.560 5.200 1.642 263 HA THR 31 HA THR 31 2.652 6.825 3.700 264 HB THR 31 HB THR 31 3.827 7.679 1.475 265 HG1 THR 31 HG1 THR 31 3.473 5.060 0.653 266 HG21 THR 31 HG21 THR 31 4.340 4.996 2.730 267 HG22 THR 31 HG22 THR 31 4.852 6.547 3.393 268 HG23 THR 31 HG23 THR 31 5.509 5.986 1.856 269 HA PRO 32 HA PRO 32 1.337 11.099 3.225 270 HB2 PRO 32 HB2 PRO 32 3.948 11.235 1.756 271 HB3 PRO 32 HB1 PRO 32 3.249 12.386 2.903 272 HG2 PRO 32 HG2 PRO 32 5.063 10.628 3.710 273 HG3 PRO 32 HG1 PRO 32 3.673 11.025 4.729 274 HD2 PRO 32 HD2 PRO 32 4.260 8.560 3.235 275 HD3 PRO 32 HD1 PRO 32 3.235 8.805 4.656 276 H ASN 33 HN ASN 33 1.244 9.097 0.600 277 HA ASN 33 HA ASN 33 0.835 9.255 -1.634 278 HB2 ASN 33 HB2 ASN 33 0.772 11.262 -2.945 279 HB3 ASN 33 HB1 ASN 33 -0.135 11.547 -1.476 280 HD21 ASN 33 HD21 ASN 33 0.022 13.762 -1.890 281 HD22 ASN 33 HD22 ASN 33 1.465 14.650 -1.553 282 H CYS 34 HN CYS 34 2.919 8.250 -0.560 283 HA CYS 34 HA CYS 34 5.264 9.055 -2.118 284 HB2 CYS 34 HB2 CYS 34 5.203 8.293 0.442 285 HB3 CYS 34 HB1 CYS 34 5.276 6.728 -0.306 286 H ALA 35 HN ALA 35 6.455 7.055 -2.991 287 HA ALA 35 HA ALA 35 4.834 5.480 -4.676 288 HB1 ALA 35 HB1 ALA 35 7.597 4.879 -3.603 289 HB2 ALA 35 HB2 ALA 35 7.233 5.773 -5.079 290 HB3 ALA 35 HB3 ALA 35 6.822 4.062 -4.960 291 H LEU 36 HN LEU 36 3.314 4.108 -3.963 292 HA LEU 36 HA LEU 36 2.875 3.269 -1.480 293 HB2 LEU 36 HB2 LEU 36 1.546 1.354 -2.450 294 HB3 LEU 36 HB1 LEU 36 1.134 2.981 -2.928 295 HG LEU 36 HG LEU 36 0.902 1.436 -4.774 296 HD11 LEU 36 HD11 LEU 36 3.274 3.164 -5.358 297 HD12 LEU 36 HD12 LEU 36 1.659 3.814 -5.099 298 HD13 LEU 36 HD13 LEU 36 1.958 2.702 -6.438 299 HD21 LEU 36 HD21 LEU 36 3.821 0.890 -4.363 300 HD22 LEU 36 HD22 LEU 36 2.915 0.427 -5.806 301 HD23 LEU 36 HD23 LEU 36 2.482 -0.251 -4.235 302 H GLN 37 HN GLN 37 3.616 1.918 -0.044 303 HA GLN 37 HA GLN 37 6.135 0.642 -0.790 304 HB2 GLN 37 HB2 GLN 37 5.407 0.793 2.058 305 HB3 GLN 37 HB1 GLN 37 6.919 1.203 1.262 306 HG2 GLN 37 HG2 GLN 37 5.045 3.126 0.455 307 HG3 GLN 37 HG1 GLN 37 4.832 2.921 2.185 308 HE21 GLN 37 HE21 GLN 37 6.793 4.125 -0.296 309 HE22 GLN 37 HE22 GLN 37 8.040 4.805 0.690 310 H ILE 38 HN ILE 38 6.070 -1.439 -1.161 311 HA ILE 38 HA ILE 38 4.008 -3.135 -0.043 312 HB ILE 38 HB ILE 38 6.368 -4.096 -1.643 313 HG12 ILE 38 HG12 ILE 38 5.461 -2.138 -2.848 314 HG13 ILE 38 HG11 ILE 38 5.192 -3.638 -3.726 315 HG21 ILE 38 HG21 ILE 38 3.746 -5.133 -0.859 316 HG22 ILE 38 HG22 ILE 38 5.243 -5.989 -1.280 317 HG23 ILE 38 HG23 ILE 38 4.166 -5.405 -2.550 318 HD11 ILE 38 HD11 ILE 38 3.157 -2.134 -2.102 319 HD12 ILE 38 HD12 ILE 38 2.874 -3.662 -2.935 320 HD13 ILE 38 HD13 ILE 38 3.259 -2.210 -3.863 321 H VAL 39 HN VAL 39 4.410 -3.435 2.144 322 HA VAL 39 HA VAL 39 7.162 -4.000 2.953 323 HB VAL 39 HB VAL 39 5.750 -2.294 4.218 324 HG11 VAL 39 HG11 VAL 39 4.440 -4.751 5.333 325 HG12 VAL 39 HG12 VAL 39 3.668 -3.499 4.362 326 HG13 VAL 39 HG13 VAL 39 4.282 -3.114 5.970 327 HG21 VAL 39 HG21 VAL 39 6.680 -2.996 6.404 328 HG22 VAL 39 HG22 VAL 39 7.845 -3.134 5.087 329 HG23 VAL 39 HG23 VAL 39 7.049 -4.580 5.712 330 H ALA 40 HN ALA 40 7.825 -5.925 3.391 331 HA ALA 40 HA ALA 40 5.862 -8.100 3.608 332 HB1 ALA 40 HB1 ALA 40 8.417 -8.214 2.022 333 HB2 ALA 40 HB2 ALA 40 6.857 -7.798 1.320 334 HB3 ALA 40 HB3 ALA 40 7.100 -9.388 2.038 335 H ARG 41 HN ARG 41 6.493 -9.838 4.874 336 HA ARG 41 HA ARG 41 9.079 -9.567 6.241 337 HB2 ARG 41 HB2 ARG 41 6.502 -10.922 6.955 338 HB3 ARG 41 HB1 ARG 41 8.014 -11.474 7.674 339 HG2 ARG 41 HG2 ARG 41 7.600 -8.572 7.751 340 HG3 ARG 41 HG1 ARG 41 6.464 -9.513 8.697 341 HD2 ARG 41 HD2 ARG 41 8.273 -10.598 9.869 342 HD3 ARG 41 HD1 ARG 41 9.451 -9.752 8.871 343 HE ARG 41 HE ARG 41 7.697 -7.962 10.245 344 HH11 ARG 41 HH11 ARG 41 10.542 -9.960 10.645 345 HH12 ARG 41 HH12 ARG 41 11.200 -8.986 11.925 346 HH21 ARG 41 HH21 ARG 41 8.558 -6.682 11.935 347 HH22 ARG 41 HH22 ARG 41 10.068 -7.129 12.663 348 H LEU 42 HN LEU 42 10.665 -10.963 5.759 349 HA LEU 42 HA LEU 42 10.275 -12.648 3.499 350 HB2 LEU 42 HB2 LEU 42 12.592 -12.063 5.309 351 HB3 LEU 42 HB1 LEU 42 12.701 -13.352 4.129 352 HG LEU 42 HG LEU 42 12.029 -10.507 3.391 353 HD11 LEU 42 HD11 LEU 42 14.714 -11.880 3.363 354 HD12 LEU 42 HD12 LEU 42 14.235 -10.552 4.420 355 HD13 LEU 42 HD13 LEU 42 14.361 -10.293 2.681 356 HD21 LEU 42 HD21 LEU 42 11.355 -12.210 1.771 357 HD22 LEU 42 HD22 LEU 42 12.995 -12.855 1.761 358 HD23 LEU 42 HD23 LEU 42 12.684 -11.231 1.152 359 H LYS 43 HN LYS 43 10.099 -14.720 3.293 360 HA LYS 43 HA LYS 43 8.821 -16.127 5.368 361 HB2 LYS 43 HB2 LYS 43 8.348 -16.351 2.957 362 HB3 LYS 43 HB1 LYS 43 9.905 -17.118 2.749 363 HG2 LYS 43 HG2 LYS 43 9.178 -18.970 4.178 364 HG3 LYS 43 HG1 LYS 43 7.597 -18.198 4.337 365 HD2 LYS 43 HD2 LYS 43 8.847 -18.993 1.709 366 HD3 LYS 43 HD1 LYS 43 7.680 -19.984 2.593 367 HE2 LYS 43 HE2 LYS 43 7.158 -17.170 1.630 368 HE3 LYS 43 HE1 LYS 43 6.693 -18.622 0.749 369 HZ1 LYS 43 HZ1 LYS 43 5.275 -19.257 2.576 370 HZ2 LYS 43 HZ2 LYS 43 4.865 -17.703 2.049 371 HZ3 LYS 43 HZ3 LYS 43 5.751 -17.905 3.472 372 H ASN 44 HN ASN 44 12.010 -16.477 3.881 373 HA ASN 44 HA ASN 44 12.738 -18.524 5.784 374 HB2 ASN 44 HB2 ASN 44 14.333 -17.128 3.650 375 HB3 ASN 44 HB1 ASN 44 14.968 -18.405 4.671 376 HD21 ASN 44 HD21 ASN 44 12.432 -19.886 4.655 377 HD22 ASN 44 HD22 ASN 44 12.328 -20.615 3.091 378 H ASN 45 HN ASN 45 13.474 -15.144 5.161 379 HA ASN 45 HA ASN 45 15.570 -15.067 7.106 380 HB2 ASN 45 HB2 ASN 45 14.394 -13.182 5.175 381 HB3 ASN 45 HB1 ASN 45 15.173 -12.470 6.578 382 HD21 ASN 45 HD21 ASN 45 17.353 -12.658 6.829 383 HD22 ASN 45 HD22 ASN 45 18.395 -13.198 5.570 384 H ASN 46 HN ASN 46 12.186 -14.285 7.106 385 HA ASN 46 HA ASN 46 10.742 -13.722 8.769 386 HB2 ASN 46 HB2 ASN 46 12.012 -15.160 10.287 387 HB3 ASN 46 HB1 ASN 46 13.157 -13.860 10.576 388 HD21 ASN 46 HD21 ASN 46 9.995 -15.091 11.254 389 HD22 ASN 46 HD22 ASN 46 9.622 -14.004 12.544 390 H ARG 47 HN ARG 47 13.481 -11.886 7.973 391 HA ARG 47 HA ARG 47 12.934 -9.583 9.530 392 HB2 ARG 47 HB2 ARG 47 14.535 -9.754 6.987 393 HB3 ARG 47 HB1 ARG 47 14.699 -8.565 8.275 394 HG2 ARG 47 HG2 ARG 47 15.340 -10.498 9.772 395 HG3 ARG 47 HG1 ARG 47 15.459 -11.467 8.309 396 HD2 ARG 47 HD2 ARG 47 17.026 -9.728 7.415 397 HD3 ARG 47 HD1 ARG 47 17.020 -9.008 9.021 398 HE ARG 47 HE ARG 47 17.665 -11.699 9.322 399 HH11 ARG 47 HH11 ARG 47 19.016 -8.821 7.871 400 HH12 ARG 47 HH12 ARG 47 20.660 -9.337 8.060 401 HH21 ARG 47 HH21 ARG 47 19.832 -12.384 9.595 402 HH22 ARG 47 HH22 ARG 47 21.127 -11.368 9.050 403 H GLN 48 HN GLN 48 11.939 -7.760 9.035 404 HA GLN 48 HA GLN 48 9.951 -7.741 6.978 405 HB2 GLN 48 HB2 GLN 48 9.924 -6.607 9.306 406 HB3 GLN 48 HB1 GLN 48 10.822 -5.319 8.524 407 HG2 GLN 48 HG2 GLN 48 9.005 -5.050 6.912 408 HG3 GLN 48 HG1 GLN 48 8.097 -6.310 7.750 409 HE21 GLN 48 HE21 GLN 48 6.423 -4.991 8.331 410 HE22 GLN 48 HE22 GLN 48 6.571 -3.727 9.501 411 H VAL 49 HN VAL 49 10.011 -6.670 5.069 412 HA VAL 49 HA VAL 49 12.224 -4.933 4.332 413 HB VAL 49 HB VAL 49 13.061 -7.261 3.936 414 HG11 VAL 49 HG11 VAL 49 10.969 -8.359 3.432 415 HG12 VAL 49 HG12 VAL 49 12.101 -8.576 2.098 416 HG13 VAL 49 HG13 VAL 49 10.791 -7.403 1.962 417 HG21 VAL 49 HG21 VAL 49 13.930 -5.422 2.593 418 HG22 VAL 49 HG22 VAL 49 12.622 -5.639 1.428 419 HG23 VAL 49 HG23 VAL 49 13.835 -6.903 1.640 420 H CYS 50 HN CYS 50 11.788 -4.060 2.043 421 HA CYS 50 HA CYS 50 8.926 -4.187 1.472 422 HB2 CYS 50 HB2 CYS 50 10.922 -1.976 1.039 423 HB3 CYS 50 HB1 CYS 50 9.342 -1.996 0.279 424 H ILE 51 HN ILE 51 8.233 -4.662 -0.496 425 HA ILE 51 HA ILE 51 10.151 -5.778 -2.394 426 HB ILE 51 HB ILE 51 7.238 -5.778 -2.989 427 HG12 ILE 51 HG12 ILE 51 8.442 -7.444 -0.763 428 HG13 ILE 51 HG11 ILE 51 7.195 -6.210 -0.585 429 HG21 ILE 51 HG21 ILE 51 9.013 -8.170 -2.987 430 HG22 ILE 51 HG22 ILE 51 9.242 -6.932 -4.223 431 HG23 ILE 51 HG23 ILE 51 7.686 -7.750 -4.071 432 HD11 ILE 51 HD11 ILE 51 5.704 -7.599 -2.002 433 HD12 ILE 51 HD12 ILE 51 6.180 -8.373 -0.493 434 HD13 ILE 51 HD13 ILE 51 6.944 -8.849 -2.005 435 H ASP 52 HN ASP 52 10.327 -5.065 -4.527 436 HA ASP 52 HA ASP 52 9.807 -2.305 -4.998 437 HB2 ASP 52 HB2 ASP 52 11.748 -3.388 -5.997 438 HB3 ASP 52 HB1 ASP 52 10.706 -4.489 -6.884 439 HA PRO 53 HA PRO 53 5.584 -2.719 -6.230 440 HB2 PRO 53 HB2 PRO 53 5.332 -0.274 -7.412 441 HB3 PRO 53 HB1 PRO 53 5.308 -0.531 -5.664 442 HG2 PRO 53 HG2 PRO 53 7.566 0.350 -7.417 443 HG3 PRO 53 HG1 PRO 53 7.064 0.979 -5.835 444 HD2 PRO 53 HD2 PRO 53 9.129 -0.701 -6.080 445 HD3 PRO 53 HD1 PRO 53 8.034 -0.781 -4.690 446 H LYS 54 HN LYS 54 8.205 -2.333 -8.401 447 HA LYS 54 HA LYS 54 6.467 -2.406 -10.751 448 HB2 LYS 54 HB2 LYS 54 9.452 -1.982 -10.563 449 HB3 LYS 54 HB1 LYS 54 8.498 -1.922 -12.039 450 HG2 LYS 54 HG2 LYS 54 7.347 -0.172 -10.104 451 HG3 LYS 54 HG1 LYS 54 9.068 0.173 -10.267 452 HD2 LYS 54 HD2 LYS 54 7.556 1.442 -11.826 453 HD3 LYS 54 HD1 LYS 54 8.859 0.548 -12.610 454 HE2 LYS 54 HE2 LYS 54 7.326 -1.195 -13.237 455 HE3 LYS 54 HE1 LYS 54 6.049 -0.450 -12.293 456 HZ1 LYS 54 HZ1 LYS 54 7.321 0.677 -14.722 457 HZ2 LYS 54 HZ2 LYS 54 6.144 1.466 -13.800 458 HZ3 LYS 54 HZ3 LYS 54 5.758 0.039 -14.619 459 H LEU 55 HN LEU 55 8.087 -4.534 -8.763 460 HA LEU 55 HA LEU 55 9.086 -6.510 -10.418 461 HB2 LEU 55 HB2 LEU 55 7.814 -6.386 -7.738 462 HB3 LEU 55 HB1 LEU 55 8.036 -7.974 -8.441 463 HG LEU 55 HG LEU 55 10.288 -5.991 -8.132 464 HD11 LEU 55 HD11 LEU 55 9.438 -6.388 -5.937 465 HD12 LEU 55 HD12 LEU 55 10.928 -7.313 -6.137 466 HD13 LEU 55 HD13 LEU 55 9.364 -8.127 -6.223 467 HD21 LEU 55 HD21 LEU 55 11.632 -8.094 -8.242 468 HD22 LEU 55 HD22 LEU 55 10.766 -7.686 -9.723 469 HD23 LEU 55 HD23 LEU 55 10.144 -8.948 -8.660 470 H LYS 56 HN LYS 56 8.202 -8.147 -11.601 471 HA LYS 56 HA LYS 56 5.757 -7.535 -12.842 472 HB2 LYS 56 HB2 LYS 56 7.630 -9.859 -13.041 473 HB3 LYS 56 HB1 LYS 56 6.085 -9.895 -13.875 474 HG2 LYS 56 HG2 LYS 56 7.680 -9.140 -15.438 475 HG3 LYS 56 HG1 LYS 56 6.741 -7.727 -14.966 476 HD2 LYS 56 HD2 LYS 56 8.527 -7.068 -13.421 477 HD3 LYS 56 HD1 LYS 56 9.466 -8.479 -13.911 478 HE2 LYS 56 HE2 LYS 56 8.626 -6.172 -15.666 479 HE3 LYS 56 HE1 LYS 56 10.254 -6.509 -15.079 480 HZ1 LYS 56 HZ1 LYS 56 10.063 -7.264 -17.322 481 HZ2 LYS 56 HZ2 LYS 56 8.673 -8.157 -16.973 482 HZ3 LYS 56 HZ3 LYS 56 10.162 -8.626 -16.324 483 H TRP 57 HN TRP 57 6.489 -9.741 -10.212 484 HA TRP 57 HA TRP 57 3.796 -10.841 -10.346 485 HB2 TRP 57 HB2 TRP 57 4.422 -12.258 -8.541 486 HB3 TRP 57 HB1 TRP 57 5.803 -12.196 -9.611 487 HD1 TRP 57 HD1 TRP 57 8.013 -11.102 -8.667 488 HE1 TRP 57 HE1 TRP 57 8.795 -10.532 -6.274 489 HE3 TRP 57 HE3 TRP 57 3.513 -11.350 -6.302 490 HZ2 TRP 57 HZ2 TRP 57 7.623 -10.233 -3.718 491 HZ3 TRP 57 HZ3 TRP 57 3.409 -10.891 -3.894 492 HH2 TRP 57 HH2 TRP 57 5.425 -10.354 -2.622 493 H ILE 58 HN ILE 58 5.515 -8.293 -8.866 494 HA ILE 58 HA ILE 58 3.717 -7.826 -6.700 495 HB ILE 58 HB ILE 58 5.948 -6.278 -7.959 496 HG12 ILE 58 HG12 ILE 58 6.451 -8.126 -6.400 497 HG13 ILE 58 HG11 ILE 58 6.991 -6.566 -5.788 498 HG21 ILE 58 HG21 ILE 58 4.088 -5.288 -5.822 499 HG22 ILE 58 HG22 ILE 58 4.337 -4.603 -7.431 500 HG23 ILE 58 HG23 ILE 58 5.637 -4.554 -6.233 501 HD11 ILE 58 HD11 ILE 58 4.416 -7.876 -4.991 502 HD12 ILE 58 HD12 ILE 58 5.170 -6.456 -4.268 503 HD13 ILE 58 HD13 ILE 58 5.923 -8.041 -4.105 504 H GLN 59 HN GLN 59 4.070 -6.592 -9.976 505 HA GLN 59 HA GLN 59 2.275 -4.484 -9.996 506 HB2 GLN 59 HB2 GLN 59 2.929 -6.587 -12.011 507 HB3 GLN 59 HB1 GLN 59 1.856 -5.256 -12.404 508 HG2 GLN 59 HG2 GLN 59 4.655 -4.894 -11.403 509 HG3 GLN 59 HG1 GLN 59 4.261 -5.033 -13.113 510 HE21 GLN 59 HE21 GLN 59 4.097 -3.025 -10.291 511 HE22 GLN 59 HE22 GLN 59 3.571 -1.591 -11.105 512 H GLU 60 HN GLU 60 1.695 -7.890 -9.983 513 HA GLU 60 HA GLU 60 -1.109 -7.748 -10.543 514 HB2 GLU 60 HB2 GLU 60 0.561 -9.961 -9.328 515 HB3 GLU 60 HB1 GLU 60 -1.107 -10.130 -9.858 516 HG2 GLU 60 HG2 GLU 60 1.263 -9.482 -11.589 517 HG3 GLU 60 HG1 GLU 60 0.420 -11.027 -11.510 518 H TYR 61 HN TYR 61 0.920 -7.837 -7.713 519 HA TYR 61 HA TYR 61 -1.245 -8.147 -5.836 520 HB2 TYR 61 HB2 TYR 61 0.994 -8.965 -5.255 521 HB3 TYR 61 HB1 TYR 61 1.654 -7.352 -5.442 522 HD1 TYR 61 HD1 TYR 61 -0.341 -9.531 -3.319 523 HD2 TYR 61 HD2 TYR 61 1.335 -5.653 -3.782 524 HE1 TYR 61 HE1 TYR 61 -0.752 -9.068 -0.961 525 HE2 TYR 61 HE2 TYR 61 0.920 -5.186 -1.405 526 HH TYR 61 HH TYR 61 0.157 -7.576 0.831 527 H LEU 62 HN LEU 62 0.588 -5.625 -7.312 528 HA LEU 62 HA LEU 62 -0.131 -3.438 -5.793 529 HB2 LEU 62 HB2 LEU 62 1.036 -3.980 -8.311 530 HB3 LEU 62 HB1 LEU 62 -0.164 -2.700 -8.528 531 HG LEU 62 HG LEU 62 0.948 -1.437 -6.687 532 HD11 LEU 62 HD11 LEU 62 2.024 -3.072 -5.434 533 HD12 LEU 62 HD12 LEU 62 3.343 -2.230 -6.254 534 HD13 LEU 62 HD13 LEU 62 2.775 -3.793 -6.856 535 HD21 LEU 62 HD21 LEU 62 2.678 -2.160 -9.049 536 HD22 LEU 62 HD22 LEU 62 2.884 -0.742 -8.023 537 HD23 LEU 62 HD23 LEU 62 1.432 -0.912 -9.010 538 H GLU 63 HN GLU 63 -1.776 -4.956 -8.510 539 HA GLU 63 HA GLU 63 -3.968 -3.320 -8.755 540 HB2 GLU 63 HB2 GLU 63 -3.787 -6.307 -8.942 541 HB3 GLU 63 HB1 GLU 63 -5.159 -5.366 -9.483 542 HG2 GLU 63 HG2 GLU 63 -3.640 -4.120 -10.967 543 HG3 GLU 63 HG1 GLU 63 -2.364 -5.236 -10.521 544 H LYS 64 HN LYS 64 -3.271 -5.754 -6.397 545 HA LYS 64 HA LYS 64 -5.804 -5.783 -5.084 546 HB2 LYS 64 HB2 LYS 64 -3.165 -6.429 -3.806 547 HB3 LYS 64 HB1 LYS 64 -4.747 -7.079 -3.395 548 HG2 LYS 64 HG2 LYS 64 -3.223 -7.634 -5.927 549 HG3 LYS 64 HG1 LYS 64 -3.342 -8.721 -4.544 550 HD2 LYS 64 HD2 LYS 64 -5.817 -8.740 -4.887 551 HD3 LYS 64 HD1 LYS 64 -5.554 -7.803 -6.357 552 HE2 LYS 64 HE2 LYS 64 -4.331 -10.501 -5.825 553 HE3 LYS 64 HE1 LYS 64 -5.808 -10.246 -6.750 554 HZ1 LYS 64 HZ1 LYS 64 -3.849 -10.472 -8.167 555 HZ2 LYS 64 HZ2 LYS 64 -3.148 -9.118 -7.443 556 HZ3 LYS 64 HZ3 LYS 64 -4.569 -8.955 -8.347 557 H ALA 65 HN ALA 65 -2.707 -4.212 -4.548 558 HA ALA 65 HA ALA 65 -3.301 -2.754 -2.231 559 HB1 ALA 65 HB1 ALA 65 -1.361 -1.371 -2.860 560 HB2 ALA 65 HB2 ALA 65 -1.382 -2.105 -4.466 561 HB3 ALA 65 HB3 ALA 65 -1.027 -3.094 -3.053 562 H LEU 66 HN LEU 66 -3.894 -2.145 -5.594 563 HA LEU 66 HA LEU 66 -4.612 0.605 -5.341 564 HB2 LEU 66 HB2 LEU 66 -4.817 -1.469 -7.446 565 HB3 LEU 66 HB1 LEU 66 -5.956 -0.140 -7.554 566 HG LEU 66 HG LEU 66 -4.096 1.445 -7.588 567 HD11 LEU 66 HD11 LEU 66 -2.490 0.101 -6.320 568 HD12 LEU 66 HD12 LEU 66 -1.810 0.668 -7.849 569 HD13 LEU 66 HD13 LEU 66 -2.352 -1.008 -7.685 570 HD21 LEU 66 HD21 LEU 66 -3.928 -0.739 -9.654 571 HD22 LEU 66 HD22 LEU 66 -3.275 0.889 -9.834 572 HD23 LEU 66 HD23 LEU 66 -5.015 0.650 -9.685 573 H ASN 67 HN ASN 67 -6.277 -2.409 -5.078 574 HA ASN 67 HA ASN 67 -8.896 -1.303 -4.913 575 HB2 ASN 67 HB2 ASN 67 -7.757 -3.986 -4.314 576 HB3 ASN 67 HB1 ASN 67 -9.408 -3.614 -3.915 577 HD21 ASN 67 HD21 ASN 67 -7.764 -2.351 -6.719 578 HD22 ASN 67 HD22 ASN 67 -8.699 -3.222 -7.881 579 H LYS 68 HN LYS 68 -6.295 -1.696 -2.755 580 HA LYS 68 HA LYS 68 -7.899 -1.446 -0.352 581 HB2 LYS 68 HB2 LYS 68 -4.897 -1.279 -0.698 582 HB3 LYS 68 HB1 LYS 68 -5.755 -1.396 0.832 583 HG2 LYS 68 HG2 LYS 68 -5.643 -3.503 -1.317 584 HG3 LYS 68 HG1 LYS 68 -4.810 -3.535 0.239 585 HD2 LYS 68 HD2 LYS 68 -6.995 -3.521 1.379 586 HD3 LYS 68 HD1 LYS 68 -7.797 -3.562 -0.191 587 HE2 LYS 68 HE2 LYS 68 -5.994 -5.666 0.983 588 HE3 LYS 68 HE1 LYS 68 -7.733 -5.778 0.717 589 HZ1 LYS 68 HZ1 LYS 68 -6.550 -6.935 -1.009 590 HZ2 LYS 68 HZ2 LYS 68 -5.651 -5.555 -1.384 591 HZ3 LYS 68 HZ3 LYS 68 -7.316 -5.582 -1.671 592 H GLY 69 HN GLY 69 -5.397 0.468 -1.994 593 HA2 GLY 69 HA2 GLY 69 -5.937 2.785 -0.362 594 HA3 GLY 69 HA1 GLY 69 -4.784 2.672 -1.683 595 H ARG 70 HN ARG 70 -8.297 2.323 -1.375 596 HA ARG 70 HA ARG 70 -8.632 3.917 -3.811 597 HB2 ARG 70 HB2 ARG 70 -9.668 1.748 -3.905 598 HB3 ARG 70 HB1 ARG 70 -10.454 2.000 -2.354 599 HG2 ARG 70 HG2 ARG 70 -11.845 3.747 -3.325 600 HG3 ARG 70 HG1 ARG 70 -11.040 3.528 -4.882 601 HD2 ARG 70 HD2 ARG 70 -12.551 1.371 -3.420 602 HD3 ARG 70 HD1 ARG 70 -13.228 2.363 -4.708 603 HE ARG 70 HE ARG 70 -11.022 1.344 -5.861 604 HH11 ARG 70 HH11 ARG 70 -13.635 -0.144 -4.067 605 HH12 ARG 70 HH12 ARG 70 -13.553 -1.640 -4.943 606 HH21 ARG 70 HH21 ARG 70 -10.919 -0.615 -7.022 607 HH22 ARG 70 HH22 ARG 70 -12.014 -1.901 -6.634 608 H ARG 71 HN ARG 71 -9.548 5.883 -3.755 609 HA ARG 71 HA ARG 71 -10.646 6.797 -1.186 610 HB2 ARG 71 HB2 ARG 71 -9.478 8.424 -3.454 611 HB3 ARG 71 HB1 ARG 71 -10.199 9.105 -2.005 612 HG2 ARG 71 HG2 ARG 71 -7.947 9.207 -1.535 613 HG3 ARG 71 HG1 ARG 71 -8.420 7.696 -0.757 614 HD2 ARG 71 HD2 ARG 71 -6.332 7.448 -2.008 615 HD3 ARG 71 HD1 ARG 71 -7.612 6.436 -2.679 616 HE ARG 71 HE ARG 71 -7.292 9.039 -3.913 617 HH11 ARG 71 HH11 ARG 71 -6.435 5.641 -3.997 618 HH12 ARG 71 HH12 ARG 71 -6.027 5.664 -5.683 619 HH21 ARG 71 HH21 ARG 71 -6.756 9.064 -6.126 620 HH22 ARG 71 HH22 ARG 71 -6.201 7.608 -6.893 621 H GLU 72 HN GLU 72 -11.942 9.087 -2.176 622 HA GLU 72 HA GLU 72 -14.393 7.956 -3.112 623 HB2 GLU 72 HB2 GLU 72 -14.224 9.873 -1.530 624 HB3 GLU 72 HB1 GLU 72 -13.585 10.858 -2.836 625 HG2 GLU 72 HG2 GLU 72 -15.707 10.500 -4.069 626 HG3 GLU 72 HG1 GLU 72 -16.336 9.656 -2.652 627 H GLU 73 HN GLU 73 -13.057 7.086 -5.064 628 HA GLU 73 HA GLU 73 -12.814 9.030 -7.219 629 HB2 GLU 73 HB2 GLU 73 -11.997 7.060 -8.536 630 HB3 GLU 73 HB1 GLU 73 -11.042 7.428 -7.109 631 HG2 GLU 73 HG2 GLU 73 -12.151 5.628 -5.896 632 HG3 GLU 73 HG1 GLU 73 -13.117 5.260 -7.324 633 H LYS 74 HN LYS 74 -14.752 6.215 -6.363 634 HA LYS 74 HA LYS 74 -16.860 7.249 -8.110 635 HB2 LYS 74 HB2 LYS 74 -15.688 4.501 -8.155 636 HB3 LYS 74 HB1 LYS 74 -17.417 4.668 -8.405 637 HG2 LYS 74 HG2 LYS 74 -15.291 6.035 -10.037 638 HG3 LYS 74 HG1 LYS 74 -16.143 4.564 -10.502 639 HD2 LYS 74 HD2 LYS 74 -17.389 7.273 -10.025 640 HD3 LYS 74 HD1 LYS 74 -17.111 6.520 -11.593 641 HE2 LYS 74 HE2 LYS 74 -18.928 5.475 -9.420 642 HE3 LYS 74 HE1 LYS 74 -19.442 6.292 -10.893 643 HZ1 LYS 74 HZ1 LYS 74 -19.664 3.917 -11.125 644 HZ2 LYS 74 HZ2 LYS 74 -18.036 3.680 -10.744 645 HZ3 LYS 74 HZ3 LYS 74 -18.461 4.472 -12.175 646 H VAL 75 HN VAL 75 -16.382 4.462 -5.956 647 HA VAL 75 HA VAL 75 -17.591 3.646 -4.219 648 HB VAL 75 HB VAL 75 -18.425 6.481 -3.595 649 HG11 VAL 75 HG11 VAL 75 -18.391 5.727 -1.300 650 HG12 VAL 75 HG12 VAL 75 -17.767 4.155 -1.792 651 HG13 VAL 75 HG13 VAL 75 -19.394 4.641 -2.261 652 HG21 VAL 75 HG21 VAL 75 -16.342 6.753 -2.345 653 HG22 VAL 75 HG22 VAL 75 -16.022 6.499 -4.062 654 HG23 VAL 75 HG23 VAL 75 -15.785 5.179 -2.916 655 H GLY 76 HN GLY 76 -18.783 3.615 -6.685 656 HA2 GLY 76 HA2 GLY 76 -20.782 3.307 -7.751 657 HA3 GLY 76 HA1 GLY 76 -21.455 3.067 -6.150 658 H LYS 77 HN LYS 77 -23.246 4.231 -6.028 659 HA LYS 77 HA LYS 77 -23.032 7.086 -6.074 660 HB2 LYS 77 HB2 LYS 77 -24.784 7.495 -7.748 661 HB3 LYS 77 HB1 LYS 77 -23.370 6.731 -8.452 662 HG2 LYS 77 HG2 LYS 77 -24.569 4.555 -8.334 663 HG3 LYS 77 HG1 LYS 77 -26.005 5.438 -7.808 664 HD2 LYS 77 HD2 LYS 77 -25.842 6.804 -9.887 665 HD3 LYS 77 HD1 LYS 77 -24.531 5.752 -10.420 666 HE2 LYS 77 HE2 LYS 77 -26.530 4.981 -11.454 667 HE3 LYS 77 HE1 LYS 77 -26.104 3.823 -10.195 668 HZ1 LYS 77 HZ1 LYS 77 -28.192 5.923 -10.049 669 HZ2 LYS 77 HZ2 LYS 77 -27.722 4.971 -8.737 670 HZ3 LYS 77 HZ3 LYS 77 -28.434 4.250 -10.088 671 H LYS 78 HN LYS 78 -24.073 4.446 -4.669 672 HA LYS 78 HA LYS 78 -26.560 5.667 -3.668 673 HB2 LYS 78 HB2 LYS 78 -25.653 2.784 -3.480 674 HB3 LYS 78 HB1 LYS 78 -27.138 3.420 -2.798 675 HG2 LYS 78 HG2 LYS 78 -27.903 2.460 -4.730 676 HG3 LYS 78 HG1 LYS 78 -27.636 4.119 -5.265 677 HD2 LYS 78 HD2 LYS 78 -25.473 3.484 -6.192 678 HD3 LYS 78 HD1 LYS 78 -25.700 1.832 -5.621 679 HE2 LYS 78 HE2 LYS 78 -27.433 3.255 -7.632 680 HE3 LYS 78 HE1 LYS 78 -26.198 2.060 -8.009 681 HZ1 LYS 78 HZ1 LYS 78 -28.405 1.085 -7.996 682 HZ2 LYS 78 HZ2 LYS 78 -28.639 1.566 -6.393 683 HZ3 LYS 78 HZ3 LYS 78 -27.456 0.416 -6.766 684 H GLU 79 HN GLU 79 -23.339 5.123 -2.960 685 HA GLU 79 HA GLU 79 -23.769 4.849 -0.078 686 HB2 GLU 79 HB2 GLU 79 -21.199 4.638 -1.648 687 HB3 GLU 79 HB1 GLU 79 -21.417 4.243 0.049 688 HG2 GLU 79 HG2 GLU 79 -22.639 2.806 -2.294 689 HG3 GLU 79 HG1 GLU 79 -21.304 2.239 -1.292 690 H LYS 80 HN LYS 80 -24.054 6.825 0.826 691 HA LYS 80 HA LYS 80 -22.166 8.943 0.124 692 HB2 LYS 80 HB2 LYS 80 -23.531 10.336 1.735 693 HB3 LYS 80 HB1 LYS 80 -24.370 9.806 0.287 694 HG2 LYS 80 HG2 LYS 80 -25.719 8.333 1.450 695 HG3 LYS 80 HG1 LYS 80 -24.602 8.224 2.810 696 HD2 LYS 80 HD2 LYS 80 -26.585 9.512 3.414 697 HD3 LYS 80 HD1 LYS 80 -25.142 10.521 3.449 698 HE2 LYS 80 HE2 LYS 80 -26.923 11.764 2.430 699 HE3 LYS 80 HE1 LYS 80 -25.739 11.360 1.190 700 HZ1 LYS 80 HZ1 LYS 80 -28.231 9.823 1.660 701 HZ2 LYS 80 HZ2 LYS 80 -27.150 9.642 0.369 702 HZ3 LYS 80 HZ3 LYS 80 -28.081 11.048 0.504 703 H ILE 81 HN ILE 81 -20.281 8.242 0.965 704 HA ILE 81 HA ILE 81 -19.824 6.912 3.346 705 HB ILE 81 HB ILE 81 -17.978 8.887 1.994 706 HG12 ILE 81 HG12 ILE 81 -18.208 5.885 1.688 707 HG13 ILE 81 HG11 ILE 81 -18.734 7.076 0.503 708 HG21 ILE 81 HG21 ILE 81 -17.371 6.682 3.961 709 HG22 ILE 81 HG22 ILE 81 -17.266 8.415 4.269 710 HG23 ILE 81 HG23 ILE 81 -16.172 7.656 3.112 711 HD11 ILE 81 HD11 ILE 81 -16.437 7.811 0.206 712 HD12 ILE 81 HD12 ILE 81 -16.593 6.080 -0.095 713 HD13 ILE 81 HD13 ILE 81 -15.900 6.654 1.422 714 H GLY 82 HN GLY 82 -19.882 10.391 2.733 715 HA2 GLY 82 HA2 GLY 82 -20.696 11.964 4.301 716 HA3 GLY 82 HA1 GLY 82 -20.365 10.811 5.585 717 H LYS 83 HN LYS 83 -19.514 13.691 4.665 718 HA LYS 83 HA LYS 83 -16.689 13.333 5.430 719 HB2 LYS 83 HB2 LYS 83 -17.833 15.578 3.750 720 HB3 LYS 83 HB1 LYS 83 -16.141 15.317 4.137 721 HG2 LYS 83 HG2 LYS 83 -17.825 13.429 2.504 722 HG3 LYS 83 HG1 LYS 83 -16.758 14.659 1.830 723 HD2 LYS 83 HD2 LYS 83 -15.636 12.698 3.776 724 HD3 LYS 83 HD1 LYS 83 -15.961 12.162 2.129 725 HE2 LYS 83 HE2 LYS 83 -13.666 12.891 2.308 726 HE3 LYS 83 HE1 LYS 83 -14.560 14.005 1.280 727 HZ1 LYS 83 HZ1 LYS 83 -13.902 14.466 4.136 728 HZ2 LYS 83 HZ2 LYS 83 -14.706 15.545 3.117 729 HZ3 LYS 83 HZ3 LYS 83 -13.092 15.153 2.823 730 H LYS 84 HN LYS 84 -15.948 15.744 6.235 731 HA LYS 84 HA LYS 84 -17.990 16.525 8.216 732 HB2 LYS 84 HB2 LYS 84 -14.994 16.456 8.623 733 HB3 LYS 84 HB1 LYS 84 -16.186 16.943 9.819 734 HG2 LYS 84 HG2 LYS 84 -15.914 14.195 8.619 735 HG3 LYS 84 HG1 LYS 84 -15.374 14.682 10.226 736 HD2 LYS 84 HD2 LYS 84 -18.238 14.891 9.314 737 HD3 LYS 84 HD1 LYS 84 -17.586 13.467 10.122 738 HE2 LYS 84 HE2 LYS 84 -17.500 16.249 11.274 739 HE3 LYS 84 HE1 LYS 84 -18.761 15.070 11.631 740 HZ1 LYS 84 HZ1 LYS 84 -17.089 15.031 13.337 741 HZ2 LYS 84 HZ2 LYS 84 -15.864 14.770 12.203 742 HZ3 LYS 84 HZ3 LYS 84 -17.031 13.576 12.474 743 H LYS 85 HN LYS 85 -17.225 17.614 5.536 744 HA LYS 85 HA LYS 85 -17.284 20.380 6.257 745 HB2 LYS 85 HB2 LYS 85 -14.886 20.007 6.450 746 HB3 LYS 85 HB1 LYS 85 -14.842 19.280 4.853 747 HG2 LYS 85 HG2 LYS 85 -15.410 21.401 3.835 748 HG3 LYS 85 HG1 LYS 85 -15.564 22.147 5.426 749 HD2 LYS 85 HD2 LYS 85 -13.003 20.804 4.677 750 HD3 LYS 85 HD1 LYS 85 -13.354 22.406 4.033 751 HE2 LYS 85 HE2 LYS 85 -12.032 22.556 6.072 752 HE3 LYS 85 HE1 LYS 85 -13.625 23.268 6.302 753 HZ1 LYS 85 HZ1 LYS 85 -14.326 21.340 7.498 754 HZ2 LYS 85 HZ2 LYS 85 -12.877 21.879 8.175 755 HZ3 LYS 85 HZ3 LYS 85 -12.883 20.528 7.162 756 H ARG 86 HN ARG 86 -18.355 21.500 4.766 757 HA ARG 86 HA ARG 86 -19.320 22.165 2.841 758 HB2 ARG 86 HB2 ARG 86 -17.089 22.020 1.871 759 HB3 ARG 86 HB1 ARG 86 -17.325 20.313 1.533 760 HG2 ARG 86 HG2 ARG 86 -19.116 20.863 -0.029 761 HG3 ARG 86 HG1 ARG 86 -18.894 22.578 0.320 762 HD2 ARG 86 HD2 ARG 86 -16.779 20.759 -0.820 763 HD3 ARG 86 HD1 ARG 86 -17.780 21.857 -1.769 764 HE ARG 86 HE ARG 86 -16.746 23.635 -0.227 765 HH11 ARG 86 HH11 ARG 86 -15.088 20.756 -1.333 766 HH12 ARG 86 HH12 ARG 86 -13.519 21.491 -1.288 767 HH21 ARG 86 HH21 ARG 86 -14.685 24.603 -0.174 768 HH22 ARG 86 HH22 ARG 86 -13.291 23.676 -0.628 769 H GLN 87 HN GLN 87 -18.618 18.878 1.717 770 HA GLN 87 HA GLN 87 -19.955 17.339 0.725 771 HB2 GLN 87 HB2 GLN 87 -21.712 18.009 3.086 772 HB3 GLN 87 HB1 GLN 87 -21.914 16.603 2.050 773 HG2 GLN 87 HG2 GLN 87 -19.539 15.985 2.691 774 HG3 GLN 87 HG1 GLN 87 -19.680 17.211 3.950 775 HE21 GLN 87 HE21 GLN 87 -21.178 16.895 5.629 776 HE22 GLN 87 HE22 GLN 87 -21.789 15.320 6.001 777 H LYS 88 HN LYS 88 -20.209 19.111 -0.970 778 HA LYS 88 HA LYS 88 -22.963 20.054 -1.175 779 HB2 LYS 88 HB2 LYS 88 -22.203 21.282 -3.163 780 HB3 LYS 88 HB1 LYS 88 -21.223 21.657 -1.754 781 HG2 LYS 88 HG2 LYS 88 -19.449 20.233 -2.566 782 HG3 LYS 88 HG1 LYS 88 -20.442 19.736 -3.937 783 HD2 LYS 88 HD2 LYS 88 -20.479 22.031 -4.757 784 HD3 LYS 88 HD1 LYS 88 -19.529 22.555 -3.365 785 HE2 LYS 88 HE2 LYS 88 -18.120 22.308 -5.332 786 HE3 LYS 88 HE1 LYS 88 -17.678 21.138 -4.093 787 HZ1 LYS 88 HZ1 LYS 88 -17.750 20.200 -6.349 788 HZ2 LYS 88 HZ2 LYS 88 -19.405 20.535 -6.429 789 HZ3 LYS 88 HZ3 LYS 88 -18.821 19.429 -5.295 790 H LYS 89 HN LYS 89 -21.427 17.272 -1.769 791 HA LYS 89 HA LYS 89 -22.886 16.689 -4.244 792 HB2 LYS 89 HB2 LYS 89 -21.514 14.638 -4.350 793 HB3 LYS 89 HB1 LYS 89 -20.542 16.100 -4.332 794 HG2 LYS 89 HG2 LYS 89 -20.059 15.759 -1.964 795 HG3 LYS 89 HG1 LYS 89 -21.046 14.296 -1.973 796 HD2 LYS 89 HD2 LYS 89 -18.702 13.710 -2.159 797 HD3 LYS 89 HD1 LYS 89 -19.539 13.319 -3.663 798 HE2 LYS 89 HE2 LYS 89 -18.717 15.422 -4.641 799 HE3 LYS 89 HE1 LYS 89 -17.850 15.765 -3.146 800 HZ1 LYS 89 HZ1 LYS 89 -16.554 13.740 -3.492 801 HZ2 LYS 89 HZ2 LYS 89 -16.385 14.812 -4.791 802 HZ3 LYS 89 HZ3 LYS 89 -17.374 13.454 -4.945 803 H ARG 90 HN ARG 90 -24.366 15.019 -4.366 804 HA ARG 90 HA ARG 90 -25.291 13.981 -1.774 805 HB2 ARG 90 HB2 ARG 90 -26.970 15.128 -4.006 806 HB3 ARG 90 HB1 ARG 90 -27.617 14.292 -2.603 807 HG2 ARG 90 HG2 ARG 90 -26.748 15.995 -1.133 808 HG3 ARG 90 HG1 ARG 90 -25.970 16.807 -2.493 809 HD2 ARG 90 HD2 ARG 90 -28.942 16.383 -2.206 810 HD3 ARG 90 HD1 ARG 90 -28.093 17.872 -1.793 811 HE ARG 90 HE ARG 90 -27.608 17.020 -4.490 812 HH11 ARG 90 HH11 ARG 90 -29.803 18.780 -2.409 813 HH12 ARG 90 HH12 ARG 90 -30.467 19.731 -3.699 814 HH21 ARG 90 HH21 ARG 90 -28.475 18.266 -6.188 815 HH22 ARG 90 HH22 ARG 90 -29.704 19.445 -5.850 816 H LYS 91 HN LYS 91 -25.006 11.856 -1.822 817 HA LYS 91 HA LYS 91 -25.868 10.389 -4.228 818 HB2 LYS 91 HB2 LYS 91 -23.905 9.634 -2.061 819 HB3 LYS 91 HB1 LYS 91 -24.555 8.465 -3.203 820 HG2 LYS 91 HG2 LYS 91 -23.626 9.782 -5.053 821 HG3 LYS 91 HG1 LYS 91 -22.939 10.910 -3.883 822 HD2 LYS 91 HD2 LYS 91 -21.534 9.188 -2.967 823 HD3 LYS 91 HD1 LYS 91 -22.310 7.963 -3.973 824 HE2 LYS 91 HE2 LYS 91 -20.127 8.653 -4.865 825 HE3 LYS 91 HE1 LYS 91 -21.446 9.016 -5.975 826 HZ1 LYS 91 HZ1 LYS 91 -21.400 11.314 -5.197 827 HZ2 LYS 91 HZ2 LYS 91 -19.908 10.856 -5.843 828 HZ3 LYS 91 HZ3 LYS 91 -20.107 10.954 -4.166 829 H ALA 92 HN ALA 92 -27.973 9.985 -3.920 830 HA ALA 92 HA ALA 92 -28.805 8.958 -1.291 831 HB1 ALA 92 HB1 ALA 92 -31.026 9.845 -1.770 832 HB2 ALA 92 HB2 ALA 92 -30.458 10.434 -3.333 833 HB3 ALA 92 HB3 ALA 92 -29.805 11.116 -1.845 834 H ALA 93 HN ALA 93 -29.947 7.112 -1.159 835 HA ALA 93 HA ALA 93 -30.865 5.834 -3.642 836 HB1 ALA 93 HB1 ALA 93 -30.241 3.652 -2.742 837 HB2 ALA 93 HB2 ALA 93 -29.574 4.426 -1.304 838 HB3 ALA 93 HB3 ALA 93 -28.831 4.702 -2.880 839 H GLN 94 HN GLN 94 -32.814 7.002 -2.969 840 HA GLN 94 HA GLN 94 -34.067 6.267 -0.485 841 HB2 GLN 94 HB2 GLN 94 -35.795 7.829 -1.069 842 HB3 GLN 94 HB1 GLN 94 -34.239 8.551 -1.440 843 HG2 GLN 94 HG2 GLN 94 -35.754 7.149 -3.589 844 HG3 GLN 94 HG1 GLN 94 -36.242 8.764 -3.092 845 HE21 GLN 94 HE21 GLN 94 -35.737 9.673 -5.045 846 HE22 GLN 94 HE22 GLN 94 -34.110 9.897 -5.586 847 H LYS 95 HN LYS 95 -33.774 4.595 -3.235 848 HA LYS 95 HA LYS 95 -36.520 3.580 -3.222 849 HB2 LYS 95 HB2 LYS 95 -35.825 2.380 -5.313 850 HB3 LYS 95 HB1 LYS 95 -35.798 4.132 -5.426 851 HG2 LYS 95 HG2 LYS 95 -33.382 4.136 -5.166 852 HG3 LYS 95 HG1 LYS 95 -33.387 2.382 -4.975 853 HD2 LYS 95 HD2 LYS 95 -34.325 3.870 -7.430 854 HD3 LYS 95 HD1 LYS 95 -32.753 3.088 -7.253 855 HE2 LYS 95 HE2 LYS 95 -33.865 0.928 -6.944 856 HE3 LYS 95 HE1 LYS 95 -35.434 1.709 -7.117 857 HZ1 LYS 95 HZ1 LYS 95 -33.329 1.605 -9.207 858 HZ2 LYS 95 HZ2 LYS 95 -34.851 2.325 -9.370 859 HZ3 LYS 95 HZ3 LYS 95 -34.725 0.651 -9.167 860 H ARG 96 HN ARG 96 -35.619 2.796 -0.995 861 HA ARG 96 HA ARG 96 -34.030 0.388 -1.116 862 HB2 ARG 96 HB2 ARG 96 -35.510 1.715 1.163 863 HB3 ARG 96 HB1 ARG 96 -34.506 0.283 1.340 864 HG2 ARG 96 HG2 ARG 96 -33.537 2.961 0.358 865 HG3 ARG 96 HG1 ARG 96 -33.349 2.348 2.003 866 HD2 ARG 96 HD2 ARG 96 -32.043 0.473 1.166 867 HD3 ARG 96 HD1 ARG 96 -32.264 1.040 -0.487 868 HE ARG 96 HE ARG 96 -31.085 3.077 1.062 869 HH11 ARG 96 HH11 ARG 96 -30.356 -0.041 -0.342 870 HH12 ARG 96 HH12 ARG 96 -28.666 0.299 -0.537 871 HH21 ARG 96 HH21 ARG 96 -28.851 3.525 0.820 872 HH22 ARG 96 HH22 ARG 96 -27.810 2.322 0.125 873 H LYS 97 HN LYS 97 -35.013 -1.299 -2.083 874 HA LYS 97 HA LYS 97 -37.452 -2.314 -0.864 875 HB2 LYS 97 HB2 LYS 97 -38.165 -0.857 -2.759 876 HB3 LYS 97 HB1 LYS 97 -37.253 -1.889 -3.851 877 HG2 LYS 97 HG2 LYS 97 -38.683 -3.772 -3.304 878 HG3 LYS 97 HG1 LYS 97 -39.570 -2.780 -2.145 879 HD2 LYS 97 HD2 LYS 97 -40.270 -1.293 -3.959 880 HD3 LYS 97 HD1 LYS 97 -39.387 -2.286 -5.117 881 HE2 LYS 97 HE2 LYS 97 -41.712 -2.872 -5.212 882 HE3 LYS 97 HE1 LYS 97 -40.820 -4.207 -4.486 883 HZ1 LYS 97 HZ1 LYS 97 -42.403 -2.169 -3.015 884 HZ2 LYS 97 HZ2 LYS 97 -41.528 -3.427 -2.301 885 HZ3 LYS 97 HZ3 LYS 97 -42.856 -3.777 -3.282 886 H ASN 98 HN ASN 98 -35.017 -2.798 -3.402 887 HA ASN 98 HA ASN 98 -33.813 -4.588 -4.075 888 HB2 ASN 98 HB2 ASN 98 -34.445 -5.411 -1.263 889 HB3 ASN 98 HB1 ASN 98 -33.628 -6.531 -2.348 890 HD21 ASN 98 HD21 ASN 98 -32.662 -5.296 0.081 891 HD22 ASN 98 HD22 ASN 98 -31.239 -4.419 -0.358 Start of MODEL 2 1 H1 LYS 1 HT1 LYS 1 2.848 10.772 -13.197 2 H2 LYS 1 HT2 LYS 1 2.535 9.133 -12.934 3 H3 LYS 1 HT3 LYS 1 3.946 9.830 -12.320 4 HA LYS 1 HA LYS 1 1.185 10.491 -11.489 5 HB2 LYS 1 HB2 LYS 1 2.178 8.247 -10.785 6 HB3 LYS 1 HB1 LYS 1 3.367 9.167 -9.877 7 HG2 LYS 1 HG2 LYS 1 1.568 8.390 -8.449 8 HG3 LYS 1 HG1 LYS 1 1.595 10.152 -8.531 9 HD2 LYS 1 HD2 LYS 1 -0.305 10.233 -9.894 10 HD3 LYS 1 HD1 LYS 1 -0.160 8.533 -10.348 11 HE2 LYS 1 HE2 LYS 1 -2.008 8.936 -8.776 12 HE3 LYS 1 HE1 LYS 1 -0.789 7.845 -8.123 13 HZ1 LYS 1 HZ1 LYS 1 -1.464 9.415 -6.457 14 HZ2 LYS 1 HZ2 LYS 1 -1.101 10.723 -7.470 15 HZ3 LYS 1 HZ3 LYS 1 0.142 9.735 -6.893 16 HA PRO 2 HA PRO 2 3.549 14.319 -10.939 17 HB2 PRO 2 HB2 PRO 2 0.882 15.279 -10.079 18 HB3 PRO 2 HB1 PRO 2 1.978 15.934 -11.300 19 HG2 PRO 2 HG2 PRO 2 -0.231 14.648 -12.023 20 HG3 PRO 2 HG1 PRO 2 1.284 14.428 -12.918 21 HD2 PRO 2 HD2 PRO 2 0.021 12.636 -10.878 22 HD3 PRO 2 HD1 PRO 2 0.790 12.214 -12.422 23 H VAL 3 HN VAL 3 4.771 13.958 -9.167 24 HA VAL 3 HA VAL 3 3.487 14.024 -6.545 25 HB VAL 3 HB VAL 3 5.752 13.310 -5.711 26 HG11 VAL 3 HG11 VAL 3 3.942 11.710 -5.988 27 HG12 VAL 3 HG12 VAL 3 5.487 10.974 -6.410 28 HG13 VAL 3 HG13 VAL 3 4.379 11.489 -7.682 29 HG21 VAL 3 HG21 VAL 3 7.317 12.344 -7.323 30 HG22 VAL 3 HG22 VAL 3 7.090 14.070 -7.599 31 HG23 VAL 3 HG23 VAL 3 6.292 12.898 -8.646 32 H SER 4 HN SER 4 4.063 15.536 -5.000 33 HA SER 4 HA SER 4 5.970 17.620 -5.794 34 HB2 SER 4 HB2 SER 4 3.184 18.146 -4.725 35 HB3 SER 4 HB1 SER 4 4.415 19.374 -5.020 36 HG SER 4 HG SER 4 2.811 17.992 -6.809 37 H LEU 5 HN LEU 5 6.012 15.360 -3.914 38 HA LEU 5 HA LEU 5 5.870 16.608 -1.289 39 HB2 LEU 5 HB2 LEU 5 6.606 13.795 -2.096 40 HB3 LEU 5 HB1 LEU 5 6.436 14.358 -0.447 41 HG LEU 5 HG LEU 5 4.263 14.055 -2.509 42 HD11 LEU 5 HD11 LEU 5 3.322 12.503 -0.884 43 HD12 LEU 5 HD12 LEU 5 4.698 12.779 0.183 44 HD13 LEU 5 HD13 LEU 5 4.939 12.007 -1.384 45 HD21 LEU 5 HD21 LEU 5 2.724 14.849 -0.738 46 HD22 LEU 5 HD22 LEU 5 3.816 16.102 -1.328 47 HD23 LEU 5 HD23 LEU 5 4.127 15.320 0.223 48 H SER 6 HN SER 6 8.319 14.732 -3.090 49 HA SER 6 HA SER 6 10.583 14.662 -2.949 50 HB2 SER 6 HB2 SER 6 10.218 17.055 -3.736 51 HB3 SER 6 HB1 SER 6 10.429 17.549 -2.059 52 HG SER 6 HG SER 6 12.302 16.370 -3.813 53 H TYR 7 HN TYR 7 9.246 13.657 -0.812 54 HA TYR 7 HA TYR 7 10.947 14.388 1.469 55 HB2 TYR 7 HB2 TYR 7 8.140 13.257 1.491 56 HB3 TYR 7 HB1 TYR 7 9.132 13.519 2.916 57 HD1 TYR 7 HD1 TYR 7 6.371 14.741 1.540 58 HD2 TYR 7 HD2 TYR 7 10.255 16.142 2.556 59 HE1 TYR 7 HE1 TYR 7 5.494 17.030 1.707 60 HE2 TYR 7 HE2 TYR 7 9.387 18.434 2.737 61 HH TYR 7 HH TYR 7 6.039 19.139 2.764 62 H ARG 8 HN ARG 8 11.796 12.670 2.693 63 HA ARG 8 HA ARG 8 12.169 10.221 1.246 64 HB2 ARG 8 HB2 ARG 8 13.000 10.992 4.050 65 HB3 ARG 8 HB1 ARG 8 13.496 9.522 3.220 66 HG2 ARG 8 HG2 ARG 8 14.514 10.955 1.450 67 HG3 ARG 8 HG1 ARG 8 14.155 12.357 2.459 68 HD2 ARG 8 HD2 ARG 8 16.454 11.639 2.763 69 HD3 ARG 8 HD1 ARG 8 15.532 11.416 4.247 70 HE ARG 8 HE ARG 8 15.337 9.007 3.447 71 HH11 ARG 8 HH11 ARG 8 18.091 11.050 2.747 72 HH12 ARG 8 HH12 ARG 8 19.204 9.724 2.635 73 HH21 ARG 8 HH21 ARG 8 16.793 7.265 3.282 74 HH22 ARG 8 HH22 ARG 8 18.464 7.570 2.922 75 H CYS 9 HN CYS 9 10.384 9.059 1.039 76 HA CYS 9 HA CYS 9 8.255 8.882 2.806 77 HB2 CYS 9 HB2 CYS 9 9.129 6.840 0.758 78 HB3 CYS 9 HB1 CYS 9 7.505 7.080 1.381 79 HA PRO 10 HA PRO 10 8.869 6.393 6.299 80 HB2 PRO 10 HB2 PRO 10 7.194 4.331 4.958 81 HB3 PRO 10 HB1 PRO 10 7.092 4.960 6.603 82 HG2 PRO 10 HG2 PRO 10 5.467 5.782 4.598 83 HG3 PRO 10 HG1 PRO 10 5.923 6.785 5.975 84 HD2 PRO 10 HD2 PRO 10 6.656 7.081 3.188 85 HD3 PRO 10 HD1 PRO 10 6.907 8.211 4.527 86 H CYS 11 HN CYS 11 8.642 4.107 3.600 87 HA CYS 11 HA CYS 11 10.779 2.540 4.767 88 HB2 CYS 11 HB2 CYS 11 8.796 1.400 3.881 89 HB3 CYS 11 HB1 CYS 11 9.162 2.037 2.287 90 H ARG 12 HN ARG 12 12.709 2.106 3.879 91 HA ARG 12 HA ARG 12 13.905 4.003 2.126 92 HB2 ARG 12 HB2 ARG 12 14.914 1.360 3.198 93 HB3 ARG 12 HB1 ARG 12 15.858 2.415 2.175 94 HG2 ARG 12 HG2 ARG 12 16.561 2.820 4.379 95 HG3 ARG 12 HG1 ARG 12 15.577 4.206 3.901 96 HD2 ARG 12 HD2 ARG 12 13.645 3.045 4.977 97 HD3 ARG 12 HD1 ARG 12 14.793 1.898 5.656 98 HE ARG 12 HE ARG 12 15.686 4.452 6.308 99 HH11 ARG 12 HH11 ARG 12 12.950 2.380 7.011 100 HH12 ARG 12 HH12 ARG 12 12.648 3.089 8.565 101 HH21 ARG 12 HH21 ARG 12 15.306 5.375 8.353 102 HH22 ARG 12 HH22 ARG 12 14.003 4.789 9.336 103 H PHE 13 HN PHE 13 15.463 2.513 0.374 104 HA PHE 13 HA PHE 13 13.470 2.166 -1.661 105 HB2 PHE 13 HB2 PHE 13 16.433 1.577 -1.857 106 HB3 PHE 13 HB1 PHE 13 15.326 1.914 -3.182 107 HD1 PHE 13 HD1 PHE 13 14.721 4.145 -3.757 108 HD2 PHE 13 HD2 PHE 13 17.169 3.387 -0.363 109 HE1 PHE 13 HE1 PHE 13 15.281 6.522 -3.639 110 HE2 PHE 13 HE2 PHE 13 17.731 5.769 -0.232 111 HZ PHE 13 HZ PHE 13 16.788 7.348 -1.820 112 H PHE 14 HN PHE 14 12.919 0.271 -2.691 113 HA PHE 14 HA PHE 14 12.949 -1.902 -0.771 114 HB2 PHE 14 HB2 PHE 14 11.211 -2.308 -3.043 115 HB3 PHE 14 HB1 PHE 14 10.815 -2.188 -1.346 116 HD1 PHE 14 HD1 PHE 14 10.358 0.025 -0.329 117 HD2 PHE 14 HD2 PHE 14 10.889 -0.461 -4.522 118 HE1 PHE 14 HE1 PHE 14 9.306 2.213 -0.710 119 HE2 PHE 14 HE2 PHE 14 9.842 1.732 -4.910 120 HZ PHE 14 HZ PHE 14 9.050 3.072 -3.003 121 H GLU 15 HN GLU 15 12.881 -4.171 -1.625 122 HA GLU 15 HA GLU 15 15.308 -4.473 -3.216 123 HB2 GLU 15 HB2 GLU 15 13.766 -6.473 -1.564 124 HB3 GLU 15 HB1 GLU 15 15.300 -6.786 -2.356 125 HG2 GLU 15 HG2 GLU 15 14.899 -4.698 -0.233 126 HG3 GLU 15 HG1 GLU 15 15.449 -6.341 0.086 127 H SER 16 HN SER 16 15.136 -4.852 -5.303 128 HA SER 16 HA SER 16 12.678 -5.878 -6.445 129 HB2 SER 16 HB2 SER 16 15.193 -5.320 -7.997 130 HB3 SER 16 HB1 SER 16 13.518 -5.163 -8.517 131 HG SER 16 HG SER 16 13.319 -3.295 -7.370 132 H HIS 17 HN HIS 17 14.066 -7.691 -4.771 133 HA HIS 17 HA HIS 17 14.697 -9.800 -6.720 134 HB2 HIS 17 HB2 HIS 17 16.189 -9.189 -4.165 135 HB3 HIS 17 HB1 HIS 17 16.347 -10.708 -5.035 136 HD1 HIS 17 HD1 HIS 17 17.583 -10.633 -7.334 137 HD2 HIS 17 HD2 HIS 17 17.568 -7.037 -5.249 138 HE1 HIS 17 HE1 HIS 17 19.342 -9.208 -8.429 139 HE2 HIS 17 HE2 HIS 17 19.192 -6.985 -7.261 140 H ILE 18 HN ILE 18 12.772 -8.742 -4.243 141 HA ILE 18 HA ILE 18 12.443 -11.171 -2.773 142 HB ILE 18 HB ILE 18 10.617 -8.782 -2.939 143 HG12 ILE 18 HG12 ILE 18 12.746 -9.440 -0.913 144 HG13 ILE 18 HG11 ILE 18 12.914 -8.244 -2.191 145 HG21 ILE 18 HG21 ILE 18 9.722 -9.559 -0.801 146 HG22 ILE 18 HG22 ILE 18 10.766 -10.979 -0.883 147 HG23 ILE 18 HG23 ILE 18 9.484 -10.759 -2.073 148 HD11 ILE 18 HD11 ILE 18 11.013 -8.167 0.139 149 HD12 ILE 18 HD12 ILE 18 11.002 -7.016 -1.200 150 HD13 ILE 18 HD13 ILE 18 12.410 -7.128 -0.144 151 H ALA 19 HN ALA 19 11.104 -12.812 -3.125 152 HA ALA 19 HA ALA 19 9.413 -12.706 -5.527 153 HB1 ALA 19 HB1 ALA 19 9.688 -15.088 -5.705 154 HB2 ALA 19 HB2 ALA 19 10.533 -15.148 -4.161 155 HB3 ALA 19 HB3 ALA 19 11.280 -14.346 -5.545 156 H ARG 20 HN ARG 20 7.401 -13.849 -5.462 157 HA ARG 20 HA ARG 20 5.807 -13.357 -3.212 158 HB2 ARG 20 HB2 ARG 20 5.065 -13.582 -5.607 159 HB3 ARG 20 HB1 ARG 20 5.292 -15.318 -5.438 160 HG2 ARG 20 HG2 ARG 20 3.562 -15.464 -3.817 161 HG3 ARG 20 HG1 ARG 20 3.408 -13.705 -3.746 162 HD2 ARG 20 HD2 ARG 20 1.662 -14.771 -5.143 163 HD3 ARG 20 HD1 ARG 20 2.674 -13.627 -6.025 164 HE ARG 20 HE ARG 20 3.394 -16.450 -6.160 165 HH11 ARG 20 HH11 ARG 20 1.931 -13.671 -7.708 166 HH12 ARG 20 HH12 ARG 20 2.080 -14.327 -9.308 167 HH21 ARG 20 HH21 ARG 20 3.612 -17.304 -8.283 168 HH22 ARG 20 HH22 ARG 20 3.045 -16.375 -9.635 169 H ALA 21 HN ALA 21 7.489 -16.192 -4.393 170 HA ALA 21 HA ALA 21 6.382 -17.908 -2.372 171 HB1 ALA 21 HB1 ALA 21 7.813 -19.631 -3.337 172 HB2 ALA 21 HB2 ALA 21 8.593 -18.414 -4.347 173 HB3 ALA 21 HB3 ALA 21 6.889 -18.796 -4.585 174 H ASN 22 HN ASN 22 8.639 -15.564 -2.321 175 HA ASN 22 HA ASN 22 10.284 -16.922 -0.331 176 HB2 ASN 22 HB2 ASN 22 10.767 -14.637 -2.205 177 HB3 ASN 22 HB1 ASN 22 11.706 -14.762 -0.728 178 HD21 ASN 22 HD21 ASN 22 13.635 -15.154 -1.699 179 HD22 ASN 22 HD22 ASN 22 13.988 -16.609 -2.560 180 H VAL 23 HN VAL 23 7.688 -14.921 -0.590 181 HA VAL 23 HA VAL 23 8.436 -13.397 1.801 182 HB VAL 23 HB VAL 23 7.960 -11.959 -0.084 183 HG11 VAL 23 HG11 VAL 23 5.280 -13.323 -0.133 184 HG12 VAL 23 HG12 VAL 23 6.496 -13.306 -1.419 185 HG13 VAL 23 HG13 VAL 23 5.646 -11.818 -0.981 186 HG21 VAL 23 HG21 VAL 23 5.798 -11.910 1.983 187 HG22 VAL 23 HG22 VAL 23 6.223 -10.576 0.910 188 HG23 VAL 23 HG23 VAL 23 7.392 -11.167 2.102 189 H LYS 24 HN LYS 24 7.065 -13.133 3.444 190 HA LYS 24 HA LYS 24 4.845 -15.012 3.710 191 HB2 LYS 24 HB2 LYS 24 6.288 -13.474 5.876 192 HB3 LYS 24 HB1 LYS 24 5.074 -14.716 6.100 193 HG2 LYS 24 HG2 LYS 24 6.856 -16.070 4.654 194 HG3 LYS 24 HG1 LYS 24 7.912 -14.946 5.513 195 HD2 LYS 24 HD2 LYS 24 5.791 -16.447 6.993 196 HD3 LYS 24 HD1 LYS 24 7.311 -17.236 6.608 197 HE2 LYS 24 HE2 LYS 24 8.540 -15.523 7.789 198 HE3 LYS 24 HE1 LYS 24 7.047 -14.637 8.100 199 HZ1 LYS 24 HZ1 LYS 24 6.273 -16.602 9.376 200 HZ2 LYS 24 HZ2 LYS 24 7.630 -15.858 10.049 201 HZ3 LYS 24 HZ3 LYS 24 7.803 -17.300 9.183 202 H HIS 25 HN HIS 25 3.753 -13.634 5.915 203 HA HIS 25 HA HIS 25 1.645 -12.268 5.077 204 HB2 HIS 25 HB2 HIS 25 2.940 -10.809 7.276 205 HB3 HIS 25 HB1 HIS 25 1.338 -11.525 7.207 206 HD1 HIS 25 HD1 HIS 25 3.130 -11.615 9.704 207 HD2 HIS 25 HD2 HIS 25 2.924 -14.709 6.921 208 HE1 HIS 25 HE1 HIS 25 3.860 -13.681 10.926 209 HE2 HIS 25 HE2 HIS 25 3.542 -15.562 9.281 210 H LEU 26 HN LEU 26 1.372 -10.618 3.722 211 HA LEU 26 HA LEU 26 3.533 -8.659 3.448 212 HB2 LEU 26 HB2 LEU 26 2.157 -10.125 1.566 213 HB3 LEU 26 HB1 LEU 26 1.399 -8.555 1.461 214 HG LEU 26 HG LEU 26 4.351 -9.098 1.169 215 HD11 LEU 26 HD11 LEU 26 4.064 -8.554 -1.181 216 HD12 LEU 26 HD12 LEU 26 2.321 -8.351 -0.938 217 HD13 LEU 26 HD13 LEU 26 3.059 -9.942 -0.744 218 HD21 LEU 26 HD21 LEU 26 4.196 -6.704 0.233 219 HD22 LEU 26 HD22 LEU 26 4.261 -6.957 1.971 220 HD23 LEU 26 HD23 LEU 26 2.718 -6.611 1.185 221 H LYS 27 HN LYS 27 3.104 -6.492 3.336 222 HA LYS 27 HA LYS 27 0.477 -5.523 4.239 223 HB2 LYS 27 HB2 LYS 27 1.983 -5.695 6.209 224 HB3 LYS 27 HB1 LYS 27 3.133 -4.660 5.406 225 HG2 LYS 27 HG2 LYS 27 1.882 -3.389 7.016 226 HG3 LYS 27 HG1 LYS 27 1.459 -2.863 5.385 227 HD2 LYS 27 HD2 LYS 27 -0.568 -4.240 5.476 228 HD3 LYS 27 HD1 LYS 27 -0.147 -4.742 7.114 229 HE2 LYS 27 HE2 LYS 27 -0.317 -2.454 7.890 230 HE3 LYS 27 HE1 LYS 27 -0.642 -1.897 6.249 231 HZ1 LYS 27 HZ1 LYS 27 -2.685 -3.177 6.252 232 HZ2 LYS 27 HZ2 LYS 27 -2.671 -2.085 7.543 233 HZ3 LYS 27 HZ3 LYS 27 -2.373 -3.726 7.821 234 H ILE 28 HN ILE 28 0.004 -3.426 3.485 235 HA ILE 28 HA ILE 28 2.079 -2.235 1.782 236 HB ILE 28 HB ILE 28 -0.909 -1.882 1.562 237 HG12 ILE 28 HG12 ILE 28 -0.248 -4.111 0.897 238 HG13 ILE 28 HG11 ILE 28 -0.605 -3.181 -0.537 239 HG21 ILE 28 HG21 ILE 28 1.342 -0.860 -0.171 240 HG22 ILE 28 HG22 ILE 28 0.283 0.110 0.855 241 HG23 ILE 28 HG23 ILE 28 -0.376 -0.729 -0.550 242 HD11 ILE 28 HD11 ILE 28 2.126 -3.782 0.513 243 HD12 ILE 28 HD12 ILE 28 1.765 -2.843 -0.935 244 HD13 ILE 28 HD13 ILE 28 1.345 -4.558 -0.862 245 H LEU 29 HN LEU 29 3.000 -0.539 2.604 246 HA LEU 29 HA LEU 29 2.011 0.715 4.971 247 HB2 LEU 29 HB2 LEU 29 4.471 0.337 4.136 248 HB3 LEU 29 HB1 LEU 29 4.202 1.852 3.256 249 HG LEU 29 HG LEU 29 5.376 2.259 5.349 250 HD11 LEU 29 HD11 LEU 29 2.538 3.288 5.417 251 HD12 LEU 29 HD12 LEU 29 3.897 4.005 4.545 252 HD13 LEU 29 HD13 LEU 29 3.906 3.965 6.310 253 HD21 LEU 29 HD21 LEU 29 2.948 1.109 6.717 254 HD22 LEU 29 HD22 LEU 29 4.337 1.853 7.507 255 HD23 LEU 29 HD23 LEU 29 4.534 0.346 6.615 256 H ASN 30 HN ASN 30 0.489 2.201 4.998 257 HA ASN 30 HA ASN 30 -0.273 3.662 2.658 258 HB2 ASN 30 HB2 ASN 30 -1.907 3.021 4.282 259 HB3 ASN 30 HB1 ASN 30 -1.108 3.954 5.535 260 HD21 ASN 30 HD21 ASN 30 -3.108 4.049 2.705 261 HD22 ASN 30 HD22 ASN 30 -3.592 5.700 2.844 262 H THR 31 HN THR 31 1.329 4.809 1.998 263 HA THR 31 HA THR 31 3.019 6.379 3.622 264 HB THR 31 HB THR 31 3.499 7.309 1.195 265 HG1 THR 31 HG1 THR 31 3.069 5.181 -0.101 266 HG21 THR 31 HG21 THR 31 4.223 4.558 2.178 267 HG22 THR 31 HG22 THR 31 5.062 6.061 2.565 268 HG23 THR 31 HG23 THR 31 5.076 5.441 0.913 269 HA PRO 32 HA PRO 32 1.613 10.661 3.663 270 HB2 PRO 32 HB2 PRO 32 3.933 11.084 1.870 271 HB3 PRO 32 HB1 PRO 32 3.441 11.972 3.313 272 HG2 PRO 32 HG2 PRO 32 5.436 10.219 3.435 273 HG3 PRO 32 HG1 PRO 32 4.267 10.347 4.756 274 HD2 PRO 32 HD2 PRO 32 4.536 8.261 2.668 275 HD3 PRO 32 HD1 PRO 32 3.979 8.123 4.344 276 H ASN 33 HN ASN 33 1.214 8.785 1.053 277 HA ASN 33 HA ASN 33 0.364 8.969 -1.042 278 HB2 ASN 33 HB2 ASN 33 0.889 11.942 -1.128 279 HB3 ASN 33 HB1 ASN 33 -0.167 10.995 -2.163 280 HD21 ASN 33 HD21 ASN 33 -1.055 9.538 0.367 281 HD22 ASN 33 HD22 ASN 33 -2.148 10.633 1.125 282 H CYS 34 HN CYS 34 2.778 8.275 -0.278 283 HA CYS 34 HA CYS 34 4.535 8.975 -2.491 284 HB2 CYS 34 HB2 CYS 34 4.809 7.220 -0.042 285 HB3 CYS 34 HB1 CYS 34 5.996 7.223 -1.320 286 H ALA 35 HN ALA 35 5.467 6.847 -3.551 287 HA ALA 35 HA ALA 35 3.573 5.227 -4.720 288 HB1 ALA 35 HB1 ALA 35 5.360 3.569 -5.035 289 HB2 ALA 35 HB2 ALA 35 6.364 4.440 -3.871 290 HB3 ALA 35 HB3 ALA 35 5.916 5.203 -5.399 291 H LEU 36 HN LEU 36 2.537 3.342 -4.166 292 HA LEU 36 HA LEU 36 1.996 2.725 -1.487 293 HB2 LEU 36 HB2 LEU 36 1.697 1.154 -4.046 294 HB3 LEU 36 HB1 LEU 36 1.253 0.469 -2.498 295 HG LEU 36 HG LEU 36 -0.730 1.282 -3.576 296 HD11 LEU 36 HD11 LEU 36 0.095 3.182 -1.391 297 HD12 LEU 36 HD12 LEU 36 -0.630 1.587 -1.172 298 HD13 LEU 36 HD13 LEU 36 -1.556 2.882 -1.932 299 HD21 LEU 36 HD21 LEU 36 0.666 3.947 -3.790 300 HD22 LEU 36 HD22 LEU 36 -1.021 3.635 -4.199 301 HD23 LEU 36 HD23 LEU 36 0.266 2.863 -5.125 302 H GLN 37 HN GLN 37 3.538 2.115 -0.095 303 HA GLN 37 HA GLN 37 5.837 0.658 -1.065 304 HB2 GLN 37 HB2 GLN 37 5.164 1.729 1.672 305 HB3 GLN 37 HB1 GLN 37 6.682 0.945 1.255 306 HG2 GLN 37 HG2 GLN 37 7.017 2.701 -0.481 307 HG3 GLN 37 HG1 GLN 37 5.592 3.522 0.156 308 HE21 GLN 37 HE21 GLN 37 8.408 4.296 0.003 309 HE22 GLN 37 HE22 GLN 37 8.874 4.706 1.607 310 H ILE 38 HN ILE 38 5.876 -1.418 -1.165 311 HA ILE 38 HA ILE 38 3.845 -2.974 0.163 312 HB ILE 38 HB ILE 38 5.898 -3.901 -1.853 313 HG12 ILE 38 HG12 ILE 38 3.577 -3.654 -3.256 314 HG13 ILE 38 HG11 ILE 38 3.463 -2.269 -2.186 315 HG21 ILE 38 HG21 ILE 38 4.950 -5.811 -1.016 316 HG22 ILE 38 HG22 ILE 38 3.872 -5.454 -2.369 317 HG23 ILE 38 HG23 ILE 38 3.381 -5.036 -0.724 318 HD11 ILE 38 HD11 ILE 38 4.440 -1.616 -4.272 319 HD12 ILE 38 HD12 ILE 38 5.678 -2.865 -4.128 320 HD13 ILE 38 HD13 ILE 38 5.658 -1.508 -3.004 321 H VAL 39 HN VAL 39 4.380 -3.406 2.243 322 HA VAL 39 HA VAL 39 7.165 -3.979 2.939 323 HB VAL 39 HB VAL 39 5.474 -4.212 5.205 324 HG11 VAL 39 HG11 VAL 39 7.794 -3.667 5.286 325 HG12 VAL 39 HG12 VAL 39 6.853 -2.372 6.037 326 HG13 VAL 39 HG13 VAL 39 7.505 -2.159 4.410 327 HG21 VAL 39 HG21 VAL 39 4.871 -1.832 3.511 328 HG22 VAL 39 HG22 VAL 39 4.676 -1.818 5.263 329 HG23 VAL 39 HG23 VAL 39 3.757 -2.970 4.286 330 H ALA 40 HN ALA 40 7.841 -5.968 3.130 331 HA ALA 40 HA ALA 40 5.831 -8.049 3.534 332 HB1 ALA 40 HB1 ALA 40 7.060 -9.439 1.958 333 HB2 ALA 40 HB2 ALA 40 8.237 -8.149 1.726 334 HB3 ALA 40 HB3 ALA 40 6.566 -7.929 1.209 335 H ARG 41 HN ARG 41 6.445 -9.845 4.783 336 HA ARG 41 HA ARG 41 9.056 -9.598 6.082 337 HB2 ARG 41 HB2 ARG 41 6.459 -10.839 6.896 338 HB3 ARG 41 HB1 ARG 41 7.964 -11.436 7.594 339 HG2 ARG 41 HG2 ARG 41 6.980 -9.720 9.009 340 HG3 ARG 41 HG1 ARG 41 8.515 -9.197 8.343 341 HD2 ARG 41 HD2 ARG 41 6.985 -7.374 8.224 342 HD3 ARG 41 HD1 ARG 41 7.316 -7.985 6.602 343 HE ARG 41 HE ARG 41 5.124 -9.018 6.623 344 HH11 ARG 41 HH11 ARG 41 5.732 -6.702 9.184 345 HH12 ARG 41 HH12 ARG 41 4.054 -6.341 9.425 346 HH21 ARG 41 HH21 ARG 41 2.908 -8.539 6.952 347 HH22 ARG 41 HH22 ARG 41 2.453 -7.394 8.171 348 H LEU 42 HN LEU 42 10.593 -10.907 5.588 349 HA LEU 42 HA LEU 42 10.427 -12.609 3.370 350 HB2 LEU 42 HB2 LEU 42 12.469 -12.158 5.483 351 HB3 LEU 42 HB1 LEU 42 12.665 -13.536 4.423 352 HG LEU 42 HG LEU 42 12.427 -10.676 3.485 353 HD11 LEU 42 HD11 LEU 42 14.866 -12.446 3.621 354 HD12 LEU 42 HD12 LEU 42 14.505 -11.157 4.767 355 HD13 LEU 42 HD13 LEU 42 14.796 -10.772 3.071 356 HD21 LEU 42 HD21 LEU 42 13.201 -11.603 1.348 357 HD22 LEU 42 HD22 LEU 42 11.648 -12.282 1.835 358 HD23 LEU 42 HD23 LEU 42 13.127 -13.224 2.034 359 H LYS 43 HN LYS 43 10.729 -14.888 3.144 360 HA LYS 43 HA LYS 43 8.860 -16.366 4.573 361 HB2 LYS 43 HB2 LYS 43 9.669 -16.898 2.297 362 HB3 LYS 43 HB1 LYS 43 11.176 -17.448 3.005 363 HG2 LYS 43 HG2 LYS 43 9.992 -19.194 4.217 364 HG3 LYS 43 HG1 LYS 43 8.464 -18.633 3.534 365 HD2 LYS 43 HD2 LYS 43 9.272 -19.149 1.294 366 HD3 LYS 43 HD1 LYS 43 10.815 -19.679 1.957 367 HE2 LYS 43 HE2 LYS 43 9.634 -21.417 3.213 368 HE3 LYS 43 HE1 LYS 43 8.115 -20.908 2.486 369 HZ1 LYS 43 HZ1 LYS 43 8.965 -21.507 0.329 370 HZ2 LYS 43 HZ2 LYS 43 9.097 -22.834 1.367 371 HZ3 LYS 43 HZ3 LYS 43 10.468 -21.922 0.985 372 H ASN 44 HN ASN 44 12.384 -16.871 4.662 373 HA ASN 44 HA ASN 44 12.129 -18.416 7.094 374 HB2 ASN 44 HB2 ASN 44 14.581 -17.565 5.566 375 HB3 ASN 44 HB1 ASN 44 14.582 -18.664 6.932 376 HD21 ASN 44 HD21 ASN 44 15.488 -19.062 4.201 377 HD22 ASN 44 HD22 ASN 44 14.603 -20.420 3.596 378 H ASN 45 HN ASN 45 13.634 -15.416 6.057 379 HA ASN 45 HA ASN 45 14.856 -14.839 8.548 380 HB2 ASN 45 HB2 ASN 45 15.507 -14.064 6.190 381 HB3 ASN 45 HB1 ASN 45 14.265 -12.848 6.388 382 HD21 ASN 45 HD21 ASN 45 17.097 -12.530 6.001 383 HD22 ASN 45 HD22 ASN 45 17.671 -11.621 7.350 384 H ASN 46 HN ASN 46 11.765 -14.244 7.223 385 HA ASN 46 HA ASN 46 9.988 -12.933 7.689 386 HB2 ASN 46 HB2 ASN 46 9.119 -13.097 9.926 387 HB3 ASN 46 HB1 ASN 46 9.822 -14.635 9.458 388 HD21 ASN 46 HD21 ASN 46 9.994 -11.931 11.584 389 HD22 ASN 46 HD22 ASN 46 11.186 -12.581 12.652 390 H ARG 47 HN ARG 47 12.588 -11.507 7.567 391 HA ARG 47 HA ARG 47 12.256 -9.316 9.380 392 HB2 ARG 47 HB2 ARG 47 14.206 -8.391 8.449 393 HB3 ARG 47 HB1 ARG 47 14.479 -10.122 8.401 394 HG2 ARG 47 HG2 ARG 47 13.679 -10.051 6.008 395 HG3 ARG 47 HG1 ARG 47 13.778 -8.298 6.130 396 HD2 ARG 47 HD2 ARG 47 16.049 -10.200 6.644 397 HD3 ARG 47 HD1 ARG 47 15.782 -9.338 5.133 398 HE ARG 47 HE ARG 47 15.879 -7.470 7.215 399 HH11 ARG 47 HH11 ARG 47 17.981 -9.699 5.530 400 HH12 ARG 47 HH12 ARG 47 19.422 -8.781 5.838 401 HH21 ARG 47 HH21 ARG 47 17.775 -6.253 7.627 402 HH22 ARG 47 HH22 ARG 47 19.306 -6.824 7.043 403 H GLN 48 HN GLN 48 11.454 -7.401 8.961 404 HA GLN 48 HA GLN 48 9.510 -7.161 6.890 405 HB2 GLN 48 HB2 GLN 48 9.339 -6.164 9.209 406 HB3 GLN 48 HB1 GLN 48 10.474 -4.936 8.674 407 HG2 GLN 48 HG2 GLN 48 8.932 -4.266 6.924 408 HG3 GLN 48 HG1 GLN 48 7.799 -5.510 7.443 409 HE21 GLN 48 HE21 GLN 48 9.691 -3.518 9.641 410 HE22 GLN 48 HE22 GLN 48 8.353 -2.650 10.293 411 H VAL 49 HN VAL 49 9.864 -6.517 4.951 412 HA VAL 49 HA VAL 49 12.057 -4.672 4.297 413 HB VAL 49 HB VAL 49 12.852 -7.032 3.986 414 HG11 VAL 49 HG11 VAL 49 10.780 -8.105 3.412 415 HG12 VAL 49 HG12 VAL 49 11.952 -8.347 2.115 416 HG13 VAL 49 HG13 VAL 49 10.663 -7.156 1.930 417 HG21 VAL 49 HG21 VAL 49 13.746 -6.732 1.723 418 HG22 VAL 49 HG22 VAL 49 13.834 -5.239 2.657 419 HG23 VAL 49 HG23 VAL 49 12.576 -5.443 1.436 420 H CYS 50 HN CYS 50 11.727 -3.778 2.027 421 HA CYS 50 HA CYS 50 8.876 -3.825 1.375 422 HB2 CYS 50 HB2 CYS 50 11.002 -1.753 0.885 423 HB3 CYS 50 HB1 CYS 50 9.439 -1.713 0.090 424 H ILE 51 HN ILE 51 8.181 -4.433 -0.546 425 HA ILE 51 HA ILE 51 10.073 -5.710 -2.355 426 HB ILE 51 HB ILE 51 7.179 -5.614 -3.019 427 HG12 ILE 51 HG12 ILE 51 8.239 -7.269 -0.707 428 HG13 ILE 51 HG11 ILE 51 7.099 -5.931 -0.574 429 HG21 ILE 51 HG21 ILE 51 9.100 -6.892 -4.199 430 HG22 ILE 51 HG22 ILE 51 7.564 -7.711 -3.925 431 HG23 ILE 51 HG23 ILE 51 8.929 -8.034 -2.861 432 HD11 ILE 51 HD11 ILE 51 5.821 -7.903 -0.448 433 HD12 ILE 51 HD12 ILE 51 6.659 -8.628 -1.815 434 HD13 ILE 51 HD13 ILE 51 5.565 -7.272 -2.073 435 H ASP 52 HN ASP 52 10.369 -5.119 -4.475 436 HA ASP 52 HA ASP 52 9.988 -2.391 -5.170 437 HB2 ASP 52 HB2 ASP 52 11.861 -3.856 -5.979 438 HB3 ASP 52 HB1 ASP 52 10.701 -4.683 -7.006 439 HA PRO 53 HA PRO 53 5.791 -2.724 -6.529 440 HB2 PRO 53 HB2 PRO 53 5.643 -0.360 -7.857 441 HB3 PRO 53 HB1 PRO 53 5.610 -0.490 -6.097 442 HG2 PRO 53 HG2 PRO 53 7.913 0.158 -7.890 443 HG3 PRO 53 HG1 PRO 53 7.425 0.935 -6.380 444 HD2 PRO 53 HD2 PRO 53 9.418 -0.841 -6.467 445 HD3 PRO 53 HD1 PRO 53 8.312 -0.744 -5.090 446 H LYS 54 HN LYS 54 8.480 -2.487 -8.658 447 HA LYS 54 HA LYS 54 6.818 -2.641 -11.044 448 HB2 LYS 54 HB2 LYS 54 9.706 -2.093 -10.573 449 HB3 LYS 54 HB1 LYS 54 9.113 -2.527 -12.180 450 HG2 LYS 54 HG2 LYS 54 7.554 -0.700 -12.139 451 HG3 LYS 54 HG1 LYS 54 8.017 -0.305 -10.486 452 HD2 LYS 54 HD2 LYS 54 9.813 -0.175 -12.896 453 HD3 LYS 54 HD1 LYS 54 9.020 1.170 -12.093 454 HE2 LYS 54 HE2 LYS 54 10.203 0.564 -10.013 455 HE3 LYS 54 HE1 LYS 54 11.112 -0.632 -10.928 456 HZ1 LYS 54 HZ1 LYS 54 11.108 2.295 -11.415 457 HZ2 LYS 54 HZ2 LYS 54 11.966 1.155 -12.322 458 HZ3 LYS 54 HZ3 LYS 54 12.360 1.412 -10.700 459 H LEU 55 HN LEU 55 8.230 -4.740 -8.880 460 HA LEU 55 HA LEU 55 9.098 -6.894 -10.397 461 HB2 LEU 55 HB2 LEU 55 7.849 -6.489 -7.731 462 HB3 LEU 55 HB1 LEU 55 7.962 -8.135 -8.323 463 HG LEU 55 HG LEU 55 10.343 -6.296 -8.162 464 HD11 LEU 55 HD11 LEU 55 10.901 -7.461 -6.058 465 HD12 LEU 55 HD12 LEU 55 9.303 -8.212 -6.082 466 HD13 LEU 55 HD13 LEU 55 9.454 -6.459 -5.941 467 HD21 LEU 55 HD21 LEU 55 10.564 -8.211 -9.631 468 HD22 LEU 55 HD22 LEU 55 10.064 -9.290 -8.329 469 HD23 LEU 55 HD23 LEU 55 11.586 -8.400 -8.206 470 H LYS 56 HN LYS 56 8.066 -8.548 -11.445 471 HA LYS 56 HA LYS 56 5.654 -7.761 -12.690 472 HB2 LYS 56 HB2 LYS 56 7.305 -10.262 -12.870 473 HB3 LYS 56 HB1 LYS 56 5.793 -10.092 -13.745 474 HG2 LYS 56 HG2 LYS 56 7.479 -9.518 -15.269 475 HG3 LYS 56 HG1 LYS 56 6.760 -7.993 -14.760 476 HD2 LYS 56 HD2 LYS 56 9.118 -7.679 -14.792 477 HD3 LYS 56 HD1 LYS 56 8.634 -7.779 -13.098 478 HE2 LYS 56 HE2 LYS 56 10.660 -9.065 -13.506 479 HE3 LYS 56 HE1 LYS 56 9.332 -10.121 -13.037 480 HZ1 LYS 56 HZ1 LYS 56 10.555 -11.063 -14.871 481 HZ2 LYS 56 HZ2 LYS 56 10.311 -9.675 -15.800 482 HZ3 LYS 56 HZ3 LYS 56 8.999 -10.652 -15.384 483 H TRP 57 HN TRP 57 6.338 -9.903 -10.017 484 HA TRP 57 HA TRP 57 3.611 -10.895 -10.044 485 HB2 TRP 57 HB2 TRP 57 4.202 -12.245 -8.189 486 HB3 TRP 57 HB1 TRP 57 5.578 -12.285 -9.270 487 HD1 TRP 57 HD1 TRP 57 7.846 -11.246 -8.377 488 HE1 TRP 57 HE1 TRP 57 8.653 -10.595 -6.012 489 HE3 TRP 57 HE3 TRP 57 3.335 -11.197 -6.005 490 HZ2 TRP 57 HZ2 TRP 57 7.491 -10.129 -3.473 491 HZ3 TRP 57 HZ3 TRP 57 3.254 -10.628 -3.622 492 HH2 TRP 57 HH2 TRP 57 5.291 -10.113 -2.375 493 H ILE 58 HN ILE 58 5.435 -8.337 -8.709 494 HA ILE 58 HA ILE 58 3.639 -7.669 -6.577 495 HB ILE 58 HB ILE 58 5.953 -6.285 -7.887 496 HG12 ILE 58 HG12 ILE 58 6.360 -8.104 -6.270 497 HG13 ILE 58 HG11 ILE 58 6.971 -6.553 -5.702 498 HG21 ILE 58 HG21 ILE 58 4.454 -4.504 -7.423 499 HG22 ILE 58 HG22 ILE 58 5.705 -4.511 -6.173 500 HG23 ILE 58 HG23 ILE 58 4.100 -5.149 -5.817 501 HD11 ILE 58 HD11 ILE 58 4.308 -7.657 -4.892 502 HD12 ILE 58 HD12 ILE 58 5.196 -6.317 -4.171 503 HD13 ILE 58 HD13 ILE 58 5.792 -7.967 -4.007 504 H GLN 59 HN GLN 59 4.168 -6.485 -9.877 505 HA GLN 59 HA GLN 59 2.327 -4.413 -9.982 506 HB2 GLN 59 HB2 GLN 59 3.103 -6.492 -11.986 507 HB3 GLN 59 HB1 GLN 59 2.059 -5.148 -12.408 508 HG2 GLN 59 HG2 GLN 59 4.775 -4.721 -11.222 509 HG3 GLN 59 HG1 GLN 59 4.558 -4.988 -12.951 510 HE21 GLN 59 HE21 GLN 59 4.112 -2.800 -10.314 511 HE22 GLN 59 HE22 GLN 59 3.627 -1.433 -11.261 512 H GLU 60 HN GLU 60 1.866 -7.826 -9.959 513 HA GLU 60 HA GLU 60 -0.903 -7.837 -10.638 514 HB2 GLU 60 HB2 GLU 60 0.719 -9.923 -9.165 515 HB3 GLU 60 HB1 GLU 60 -0.853 -10.173 -9.902 516 HG2 GLU 60 HG2 GLU 60 1.648 -9.440 -11.400 517 HG3 GLU 60 HG1 GLU 60 1.019 -11.077 -11.226 518 H TYR 61 HN TYR 61 0.945 -7.828 -7.624 519 HA TYR 61 HA TYR 61 -1.367 -8.114 -5.949 520 HB2 TYR 61 HB2 TYR 61 0.838 -8.842 -5.149 521 HB3 TYR 61 HB1 TYR 61 1.465 -7.213 -5.323 522 HD1 TYR 61 HD1 TYR 61 -0.047 -9.523 -3.114 523 HD2 TYR 61 HD2 TYR 61 0.346 -5.377 -3.930 524 HE1 TYR 61 HE1 TYR 61 -0.702 -9.008 -0.815 525 HE2 TYR 61 HE2 TYR 61 -0.332 -4.854 -1.626 526 HH TYR 61 HH TYR 61 -0.401 -7.134 0.830 527 H LEU 62 HN LEU 62 0.573 -5.602 -7.289 528 HA LEU 62 HA LEU 62 -0.220 -3.361 -5.913 529 HB2 LEU 62 HB2 LEU 62 1.123 -4.008 -8.314 530 HB3 LEU 62 HB1 LEU 62 -0.027 -2.727 -8.672 531 HG LEU 62 HG LEU 62 0.966 -1.414 -6.776 532 HD11 LEU 62 HD11 LEU 62 2.846 -3.743 -6.825 533 HD12 LEU 62 HD12 LEU 62 1.985 -3.047 -5.447 534 HD13 LEU 62 HD13 LEU 62 3.323 -2.165 -6.189 535 HD21 LEU 62 HD21 LEU 62 2.814 -2.183 -9.030 536 HD22 LEU 62 HD22 LEU 62 2.957 -0.738 -8.029 537 HD23 LEU 62 HD23 LEU 62 1.561 -0.944 -9.087 538 H GLU 63 HN GLU 63 -1.742 -4.961 -8.645 539 HA GLU 63 HA GLU 63 -3.729 -3.164 -9.233 540 HB2 GLU 63 HB2 GLU 63 -3.766 -6.160 -9.190 541 HB3 GLU 63 HB1 GLU 63 -5.055 -5.192 -9.871 542 HG2 GLU 63 HG2 GLU 63 -3.393 -4.130 -11.342 543 HG3 GLU 63 HG1 GLU 63 -2.204 -5.278 -10.753 544 H LYS 64 HN LYS 64 -3.707 -5.630 -6.745 545 HA LYS 64 HA LYS 64 -6.320 -5.093 -5.747 546 HB2 LYS 64 HB2 LYS 64 -3.949 -6.491 -4.521 547 HB3 LYS 64 HB1 LYS 64 -5.529 -6.406 -3.754 548 HG2 LYS 64 HG2 LYS 64 -5.632 -8.469 -4.748 549 HG3 LYS 64 HG1 LYS 64 -6.352 -7.447 -5.990 550 HD2 LYS 64 HD2 LYS 64 -4.361 -7.435 -7.272 551 HD3 LYS 64 HD1 LYS 64 -3.440 -8.180 -5.963 552 HE2 LYS 64 HE2 LYS 64 -3.990 -9.778 -7.755 553 HE3 LYS 64 HE1 LYS 64 -4.689 -10.238 -6.204 554 HZ1 LYS 64 HZ1 LYS 64 -6.808 -9.321 -6.944 555 HZ2 LYS 64 HZ2 LYS 64 -6.273 -10.533 -7.989 556 HZ3 LYS 64 HZ3 LYS 64 -6.132 -8.910 -8.436 557 H ALA 65 HN ALA 65 -3.052 -4.246 -4.772 558 HA ALA 65 HA ALA 65 -3.625 -2.841 -2.433 559 HB1 ALA 65 HB1 ALA 65 -1.407 -1.833 -2.727 560 HB2 ALA 65 HB2 ALA 65 -1.371 -2.437 -4.387 561 HB3 ALA 65 HB3 ALA 65 -1.386 -3.571 -3.038 562 H LEU 66 HN LEU 66 -3.823 -1.926 -5.762 563 HA LEU 66 HA LEU 66 -4.100 0.904 -5.139 564 HB2 LEU 66 HB2 LEU 66 -3.921 -0.695 -7.639 565 HB3 LEU 66 HB1 LEU 66 -4.730 0.860 -7.720 566 HG LEU 66 HG LEU 66 -2.723 1.962 -6.898 567 HD11 LEU 66 HD11 LEU 66 -0.620 0.717 -6.696 568 HD12 LEU 66 HD12 LEU 66 -1.508 -0.788 -6.968 569 HD13 LEU 66 HD13 LEU 66 -1.828 0.175 -5.526 570 HD21 LEU 66 HD21 LEU 66 -2.216 0.145 -9.245 571 HD22 LEU 66 HD22 LEU 66 -1.317 1.616 -8.870 572 HD23 LEU 66 HD23 LEU 66 -3.027 1.710 -9.297 573 H ASN 67 HN ASN 67 -6.045 -1.843 -5.802 574 HA ASN 67 HA ASN 67 -8.485 -0.435 -6.195 575 HB2 ASN 67 HB2 ASN 67 -7.728 -3.245 -5.839 576 HB3 ASN 67 HB1 ASN 67 -9.361 -2.827 -5.394 577 HD21 ASN 67 HD21 ASN 67 -7.057 -3.006 -7.979 578 HD22 ASN 67 HD22 ASN 67 -8.209 -2.881 -9.268 579 H LYS 68 HN LYS 68 -6.634 -1.325 -3.468 580 HA LYS 68 HA LYS 68 -8.672 -1.074 -1.494 581 HB2 LYS 68 HB2 LYS 68 -5.753 -0.408 -1.119 582 HB3 LYS 68 HB1 LYS 68 -6.905 -0.890 0.116 583 HG2 LYS 68 HG2 LYS 68 -5.774 -2.623 -2.068 584 HG3 LYS 68 HG1 LYS 68 -5.422 -2.717 -0.342 585 HD2 LYS 68 HD2 LYS 68 -7.813 -3.258 0.058 586 HD3 LYS 68 HD1 LYS 68 -8.059 -3.280 -1.687 587 HE2 LYS 68 HE2 LYS 68 -7.749 -5.531 -0.811 588 HE3 LYS 68 HE1 LYS 68 -6.456 -5.078 -1.917 589 HZ1 LYS 68 HZ1 LYS 68 -5.616 -6.205 0.057 590 HZ2 LYS 68 HZ2 LYS 68 -6.281 -5.009 1.046 591 HZ3 LYS 68 HZ3 LYS 68 -5.038 -4.620 -0.028 592 H GLY 69 HN GLY 69 -6.269 1.127 -2.862 593 HA2 GLY 69 HA2 GLY 69 -7.140 3.417 -1.427 594 HA3 GLY 69 HA1 GLY 69 -6.117 3.420 -2.858 595 H ARG 70 HN ARG 70 -8.238 1.792 -4.227 596 HA ARG 70 HA ARG 70 -10.144 1.942 -5.408 597 HB2 ARG 70 HB2 ARG 70 -10.769 4.141 -3.447 598 HB3 ARG 70 HB1 ARG 70 -11.883 3.644 -4.715 599 HG2 ARG 70 HG2 ARG 70 -12.048 1.441 -3.800 600 HG3 ARG 70 HG1 ARG 70 -10.764 1.776 -2.639 601 HD2 ARG 70 HD2 ARG 70 -12.147 3.358 -1.480 602 HD3 ARG 70 HD1 ARG 70 -13.397 3.240 -2.719 603 HE ARG 70 HE ARG 70 -13.652 0.872 -1.999 604 HH11 ARG 70 HH11 ARG 70 -12.313 3.224 0.235 605 HH12 ARG 70 HH12 ARG 70 -12.825 2.355 1.644 606 HH21 ARG 70 HH21 ARG 70 -14.325 -0.254 -0.136 607 HH22 ARG 70 HH22 ARG 70 -13.969 0.390 1.434 608 H ARG 71 HN ARG 71 -9.874 5.446 -4.830 609 HA ARG 71 HA ARG 71 -9.035 5.733 -7.617 610 HB2 ARG 71 HB2 ARG 71 -11.580 6.657 -6.429 611 HB3 ARG 71 HB1 ARG 71 -10.753 7.801 -7.477 612 HG2 ARG 71 HG2 ARG 71 -11.441 4.980 -8.269 613 HG3 ARG 71 HG1 ARG 71 -12.442 6.390 -8.629 614 HD2 ARG 71 HD2 ARG 71 -10.636 7.381 -9.910 615 HD3 ARG 71 HD1 ARG 71 -9.567 6.047 -9.485 616 HE ARG 71 HE ARG 71 -11.707 4.860 -10.703 617 HH11 ARG 71 HH11 ARG 71 -9.447 7.385 -11.611 618 HH12 ARG 71 HH12 ARG 71 -9.462 6.965 -13.295 619 HH21 ARG 71 HH21 ARG 71 -11.728 4.313 -12.917 620 HH22 ARG 71 HH22 ARG 71 -10.762 5.219 -14.038 621 H GLU 72 HN GLU 72 -7.430 7.075 -7.847 622 HA GLU 72 HA GLU 72 -7.281 9.443 -6.128 623 HB2 GLU 72 HB2 GLU 72 -5.683 7.706 -5.293 624 HB3 GLU 72 HB1 GLU 72 -4.881 7.749 -6.857 625 HG2 GLU 72 HG2 GLU 72 -4.222 10.026 -6.525 626 HG3 GLU 72 HG1 GLU 72 -5.172 10.131 -5.044 627 H GLU 73 HN GLU 73 -6.547 7.790 -9.104 628 HA GLU 73 HA GLU 73 -5.758 10.226 -10.468 629 HB2 GLU 73 HB2 GLU 73 -6.210 7.402 -11.456 630 HB3 GLU 73 HB1 GLU 73 -5.670 8.729 -12.472 631 HG2 GLU 73 HG2 GLU 73 -4.154 7.924 -10.019 632 HG3 GLU 73 HG1 GLU 73 -3.917 7.108 -11.562 633 H LYS 74 HN LYS 74 -7.040 11.396 -11.823 634 HA LYS 74 HA LYS 74 -9.771 10.471 -12.343 635 HB2 LYS 74 HB2 LYS 74 -9.009 13.075 -11.022 636 HB3 LYS 74 HB1 LYS 74 -10.563 12.829 -11.802 637 HG2 LYS 74 HG2 LYS 74 -9.547 11.089 -9.572 638 HG3 LYS 74 HG1 LYS 74 -10.527 12.534 -9.314 639 HD2 LYS 74 HD2 LYS 74 -12.311 11.568 -10.684 640 HD3 LYS 74 HD1 LYS 74 -11.328 10.126 -10.950 641 HE2 LYS 74 HE2 LYS 74 -13.028 9.813 -9.190 642 HE3 LYS 74 HE1 LYS 74 -11.384 9.606 -8.594 643 HZ1 LYS 74 HZ1 LYS 74 -13.000 12.078 -8.291 644 HZ2 LYS 74 HZ2 LYS 74 -11.457 11.804 -7.651 645 HZ3 LYS 74 HZ3 LYS 74 -12.777 10.910 -7.086 646 H VAL 75 HN VAL 75 -9.529 10.291 -14.511 647 HA VAL 75 HA VAL 75 -8.255 12.305 -16.099 648 HB VAL 75 HB VAL 75 -8.270 9.985 -16.858 649 HG11 VAL 75 HG11 VAL 75 -11.258 10.292 -17.112 650 HG12 VAL 75 HG12 VAL 75 -10.409 9.275 -15.948 651 HG13 VAL 75 HG13 VAL 75 -10.311 8.912 -17.671 652 HG21 VAL 75 HG21 VAL 75 -9.852 11.796 -18.676 653 HG22 VAL 75 HG22 VAL 75 -8.992 10.339 -19.176 654 HG23 VAL 75 HG23 VAL 75 -8.095 11.720 -18.545 655 H GLY 76 HN GLY 76 -9.158 13.977 -17.207 656 HA2 GLY 76 HA2 GLY 76 -11.260 14.795 -18.303 657 HA3 GLY 76 HA1 GLY 76 -12.052 14.404 -16.784 658 H LYS 77 HN LYS 77 -8.955 15.991 -17.427 659 HA LYS 77 HA LYS 77 -9.587 18.040 -15.501 660 HB2 LYS 77 HB2 LYS 77 -7.311 16.981 -15.795 661 HB3 LYS 77 HB1 LYS 77 -7.176 17.859 -17.311 662 HG2 LYS 77 HG2 LYS 77 -5.995 19.005 -15.525 663 HG3 LYS 77 HG1 LYS 77 -7.348 19.976 -16.110 664 HD2 LYS 77 HD2 LYS 77 -8.679 19.392 -14.213 665 HD3 LYS 77 HD1 LYS 77 -7.497 18.192 -13.684 666 HE2 LYS 77 HE2 LYS 77 -5.882 19.939 -13.243 667 HE3 LYS 77 HE1 LYS 77 -6.994 21.158 -13.856 668 HZ1 LYS 77 HZ1 LYS 77 -7.557 19.427 -11.514 669 HZ2 LYS 77 HZ2 LYS 77 -8.479 20.747 -12.048 670 HZ3 LYS 77 HZ3 LYS 77 -6.931 20.994 -11.405 671 H LYS 78 HN LYS 78 -11.102 19.422 -16.220 672 HA LYS 78 HA LYS 78 -11.119 20.373 -18.953 673 HB2 LYS 78 HB2 LYS 78 -12.808 21.184 -16.579 674 HB3 LYS 78 HB1 LYS 78 -13.102 21.650 -18.248 675 HG2 LYS 78 HG2 LYS 78 -13.442 19.294 -18.837 676 HG3 LYS 78 HG1 LYS 78 -13.181 18.846 -17.150 677 HD2 LYS 78 HD2 LYS 78 -15.370 20.660 -18.163 678 HD3 LYS 78 HD1 LYS 78 -15.569 18.962 -17.729 679 HE2 LYS 78 HE2 LYS 78 -14.857 19.490 -15.431 680 HE3 LYS 78 HE1 LYS 78 -14.726 21.190 -15.879 681 HZ1 LYS 78 HZ1 LYS 78 -17.075 21.248 -16.330 682 HZ2 LYS 78 HZ2 LYS 78 -16.826 20.656 -14.766 683 HZ3 LYS 78 HZ3 LYS 78 -17.222 19.591 -16.014 684 H GLU 79 HN GLU 79 -9.761 21.304 -15.990 685 HA GLU 79 HA GLU 79 -9.654 24.135 -16.524 686 HB2 GLU 79 HB2 GLU 79 -8.245 22.505 -14.409 687 HB3 GLU 79 HB1 GLU 79 -8.412 24.254 -14.429 688 HG2 GLU 79 HG2 GLU 79 -10.700 24.155 -13.975 689 HG3 GLU 79 HG1 GLU 79 -10.800 22.448 -14.407 690 H LYS 80 HN LYS 80 -8.588 23.747 -18.647 691 HA LYS 80 HA LYS 80 -5.815 22.996 -18.655 692 HB2 LYS 80 HB2 LYS 80 -7.446 24.428 -20.761 693 HB3 LYS 80 HB1 LYS 80 -5.853 23.729 -20.999 694 HG2 LYS 80 HG2 LYS 80 -8.344 22.191 -20.295 695 HG3 LYS 80 HG1 LYS 80 -7.634 22.319 -21.904 696 HD2 LYS 80 HD2 LYS 80 -5.563 21.287 -21.018 697 HD3 LYS 80 HD1 LYS 80 -6.376 21.066 -19.466 698 HE2 LYS 80 HE2 LYS 80 -8.079 19.688 -20.568 699 HE3 LYS 80 HE1 LYS 80 -7.242 19.892 -22.107 700 HZ1 LYS 80 HZ1 LYS 80 -5.324 18.768 -21.177 701 HZ2 LYS 80 HZ2 LYS 80 -6.693 17.786 -21.064 702 HZ3 LYS 80 HZ3 LYS 80 -6.113 18.585 -19.693 703 H ILE 81 HN ILE 81 -7.664 25.996 -18.804 704 HA ILE 81 HA ILE 81 -5.779 27.517 -17.409 705 HB ILE 81 HB ILE 81 -4.390 27.336 -19.410 706 HG12 ILE 81 HG12 ILE 81 -4.072 29.763 -19.870 707 HG13 ILE 81 HG11 ILE 81 -5.581 30.090 -19.025 708 HG21 ILE 81 HG21 ILE 81 -6.133 26.977 -21.067 709 HG22 ILE 81 HG22 ILE 81 -5.075 28.305 -21.541 710 HG23 ILE 81 HG23 ILE 81 -6.673 28.644 -20.877 711 HD11 ILE 81 HD11 ILE 81 -3.133 28.834 -17.805 712 HD12 ILE 81 HD12 ILE 81 -4.634 29.223 -16.965 713 HD13 ILE 81 HD13 ILE 81 -3.632 30.515 -17.623 714 H GLY 82 HN GLY 82 -8.384 27.439 -19.756 715 HA2 GLY 82 HA2 GLY 82 -10.483 28.473 -19.391 716 HA3 GLY 82 HA1 GLY 82 -9.704 29.607 -18.295 717 H LYS 83 HN LYS 83 -11.452 30.012 -20.681 718 HA LYS 83 HA LYS 83 -9.718 31.243 -22.632 719 HB2 LYS 83 HB2 LYS 83 -12.718 31.094 -22.346 720 HB3 LYS 83 HB1 LYS 83 -11.949 32.076 -23.581 721 HG2 LYS 83 HG2 LYS 83 -12.566 30.018 -24.585 722 HG3 LYS 83 HG1 LYS 83 -10.812 30.007 -24.407 723 HD2 LYS 83 HD2 LYS 83 -11.069 28.654 -22.354 724 HD3 LYS 83 HD1 LYS 83 -12.811 28.616 -22.625 725 HE2 LYS 83 HE2 LYS 83 -12.461 27.480 -24.757 726 HE3 LYS 83 HE1 LYS 83 -10.716 27.537 -24.507 727 HZ1 LYS 83 HZ1 LYS 83 -11.025 26.180 -22.509 728 HZ2 LYS 83 HZ2 LYS 83 -11.570 25.387 -23.899 729 HZ3 LYS 83 HZ3 LYS 83 -12.680 26.078 -22.829 730 H LYS 84 HN LYS 84 -9.127 33.307 -22.732 731 HA LYS 84 HA LYS 84 -10.516 35.286 -21.102 732 HB2 LYS 84 HB2 LYS 84 -8.722 34.482 -19.666 733 HB3 LYS 84 HB1 LYS 84 -7.549 34.741 -20.946 734 HG2 LYS 84 HG2 LYS 84 -7.807 37.109 -20.799 735 HG3 LYS 84 HG1 LYS 84 -9.174 36.942 -19.700 736 HD2 LYS 84 HD2 LYS 84 -7.346 37.518 -18.334 737 HD3 LYS 84 HD1 LYS 84 -7.569 35.787 -18.108 738 HE2 LYS 84 HE2 LYS 84 -5.586 36.941 -20.054 739 HE3 LYS 84 HE1 LYS 84 -5.186 36.603 -18.376 740 HZ1 LYS 84 HZ1 LYS 84 -5.862 34.263 -18.812 741 HZ2 LYS 84 HZ2 LYS 84 -4.501 34.764 -19.678 742 HZ3 LYS 84 HZ3 LYS 84 -5.993 34.650 -20.454 743 H LYS 85 HN LYS 85 -10.737 37.168 -22.135 744 HA LYS 85 HA LYS 85 -8.976 37.737 -24.404 745 HB2 LYS 85 HB2 LYS 85 -11.022 36.661 -25.275 746 HB3 LYS 85 HB1 LYS 85 -11.995 37.894 -24.490 747 HG2 LYS 85 HG2 LYS 85 -11.732 38.313 -26.883 748 HG3 LYS 85 HG1 LYS 85 -11.032 39.606 -25.908 749 HD2 LYS 85 HD2 LYS 85 -9.585 39.010 -27.796 750 HD3 LYS 85 HD1 LYS 85 -8.804 38.678 -26.250 751 HE2 LYS 85 HE2 LYS 85 -9.402 36.315 -26.460 752 HE3 LYS 85 HE1 LYS 85 -10.186 36.647 -28.001 753 HZ1 LYS 85 HZ1 LYS 85 -7.949 35.747 -28.275 754 HZ2 LYS 85 HZ2 LYS 85 -7.303 37.059 -27.427 755 HZ3 LYS 85 HZ3 LYS 85 -8.064 37.309 -28.913 756 H ARG 86 HN ARG 86 -7.976 39.474 -23.606 757 HA ARG 86 HA ARG 86 -9.301 41.558 -22.166 758 HB2 ARG 86 HB2 ARG 86 -6.604 41.428 -23.529 759 HB3 ARG 86 HB1 ARG 86 -7.150 42.798 -22.572 760 HG2 ARG 86 HG2 ARG 86 -7.144 41.548 -20.584 761 HG3 ARG 86 HG1 ARG 86 -7.030 40.016 -21.453 762 HD2 ARG 86 HD2 ARG 86 -4.892 42.137 -21.500 763 HD3 ARG 86 HD1 ARG 86 -4.903 40.781 -20.372 764 HE ARG 86 HE ARG 86 -5.060 39.464 -22.647 765 HH11 ARG 86 HH11 ARG 86 -3.062 42.233 -21.868 766 HH12 ARG 86 HH12 ARG 86 -1.785 41.781 -22.952 767 HH21 ARG 86 HH21 ARG 86 -3.381 38.861 -24.071 768 HH22 ARG 86 HH22 ARG 86 -1.966 39.855 -24.202 769 H GLN 87 HN GLN 87 -10.731 42.882 -23.084 770 HA GLN 87 HA GLN 87 -10.485 43.403 -25.967 771 HB2 GLN 87 HB2 GLN 87 -12.929 43.488 -24.192 772 HB3 GLN 87 HB1 GLN 87 -12.914 43.877 -25.906 773 HG2 GLN 87 HG2 GLN 87 -12.178 41.585 -26.399 774 HG3 GLN 87 HG1 GLN 87 -12.263 41.207 -24.679 775 HE21 GLN 87 HE21 GLN 87 -14.071 41.887 -27.558 776 HE22 GLN 87 HE22 GLN 87 -15.608 41.366 -26.963 777 H LYS 88 HN LYS 88 -9.214 45.189 -25.973 778 HA LYS 88 HA LYS 88 -9.990 47.501 -24.377 779 HB2 LYS 88 HB2 LYS 88 -7.655 47.095 -26.259 780 HB3 LYS 88 HB1 LYS 88 -7.920 48.517 -25.259 781 HG2 LYS 88 HG2 LYS 88 -7.764 47.110 -23.249 782 HG3 LYS 88 HG1 LYS 88 -7.428 45.715 -24.274 783 HD2 LYS 88 HD2 LYS 88 -5.410 46.815 -25.108 784 HD3 LYS 88 HD1 LYS 88 -5.753 48.220 -24.097 785 HE2 LYS 88 HE2 LYS 88 -5.205 45.417 -23.123 786 HE3 LYS 88 HE1 LYS 88 -4.081 46.772 -23.061 787 HZ1 LYS 88 HZ1 LYS 88 -6.681 46.615 -21.640 788 HZ2 LYS 88 HZ2 LYS 88 -5.615 47.922 -21.585 789 HZ3 LYS 88 HZ3 LYS 88 -5.157 46.432 -20.935 790 H LYS 89 HN LYS 89 -11.192 49.109 -25.164 791 HA LYS 89 HA LYS 89 -11.828 49.009 -28.035 792 HB2 LYS 89 HB2 LYS 89 -13.519 49.734 -25.655 793 HB3 LYS 89 HB1 LYS 89 -13.998 50.107 -27.302 794 HG2 LYS 89 HG2 LYS 89 -14.195 47.835 -27.871 795 HG3 LYS 89 HG1 LYS 89 -13.329 47.319 -26.419 796 HD2 LYS 89 HD2 LYS 89 -15.136 47.886 -25.018 797 HD3 LYS 89 HD1 LYS 89 -15.930 48.820 -26.286 798 HE2 LYS 89 HE2 LYS 89 -15.475 45.848 -26.440 799 HE3 LYS 89 HE1 LYS 89 -16.947 46.574 -25.799 800 HZ1 LYS 89 HZ1 LYS 89 -17.256 46.004 -28.095 801 HZ2 LYS 89 HZ2 LYS 89 -15.893 46.885 -28.556 802 HZ3 LYS 89 HZ3 LYS 89 -17.250 47.688 -27.948 803 H ARG 90 HN ARG 90 -11.880 51.349 -25.329 804 HA ARG 90 HA ARG 90 -11.177 53.425 -27.296 805 HB2 ARG 90 HB2 ARG 90 -13.503 53.668 -26.714 806 HB3 ARG 90 HB1 ARG 90 -13.131 53.580 -25.000 807 HG2 ARG 90 HG2 ARG 90 -13.622 55.857 -25.689 808 HG3 ARG 90 HG1 ARG 90 -11.959 55.704 -25.126 809 HD2 ARG 90 HD2 ARG 90 -12.088 57.096 -27.125 810 HD3 ARG 90 HD1 ARG 90 -11.177 55.619 -27.436 811 HE ARG 90 HE ARG 90 -13.778 55.073 -28.170 812 HH11 ARG 90 HH11 ARG 90 -11.345 57.410 -29.078 813 HH12 ARG 90 HH12 ARG 90 -11.859 57.504 -30.729 814 HH21 ARG 90 HH21 ARG 90 -14.474 55.189 -30.337 815 HH22 ARG 90 HH22 ARG 90 -13.652 56.235 -31.450 816 H LYS 91 HN LYS 91 -9.179 54.040 -26.908 817 HA LYS 91 HA LYS 91 -8.362 54.552 -24.128 818 HB2 LYS 91 HB2 LYS 91 -6.035 54.569 -25.011 819 HB3 LYS 91 HB1 LYS 91 -6.840 53.022 -25.211 820 HG2 LYS 91 HG2 LYS 91 -7.173 53.415 -27.539 821 HG3 LYS 91 HG1 LYS 91 -6.616 55.082 -27.391 822 HD2 LYS 91 HD2 LYS 91 -4.886 53.644 -28.354 823 HD3 LYS 91 HD1 LYS 91 -4.386 54.294 -26.793 824 HE2 LYS 91 HE2 LYS 91 -3.790 51.936 -27.000 825 HE3 LYS 91 HE1 LYS 91 -4.971 52.182 -25.717 826 HZ1 LYS 91 HZ1 LYS 91 -6.706 51.413 -27.188 827 HZ2 LYS 91 HZ2 LYS 91 -5.482 50.251 -27.096 828 HZ3 LYS 91 HZ3 LYS 91 -5.604 51.240 -28.459 829 H ALA 92 HN ALA 92 -7.555 56.546 -23.575 830 HA ALA 92 HA ALA 92 -8.306 58.723 -25.351 831 HB1 ALA 92 HB1 ALA 92 -7.309 58.795 -22.503 832 HB2 ALA 92 HB2 ALA 92 -9.001 58.796 -22.995 833 HB3 ALA 92 HB3 ALA 92 -7.962 60.158 -23.412 834 H ALA 93 HN ALA 93 -5.476 57.851 -23.363 835 HA ALA 93 HA ALA 93 -3.263 58.354 -23.552 836 HB1 ALA 93 HB1 ALA 93 -2.267 57.968 -25.739 837 HB2 ALA 93 HB2 ALA 93 -3.854 58.088 -26.499 838 HB3 ALA 93 HB3 ALA 93 -3.501 56.755 -25.400 839 H GLN 94 HN GLN 94 -4.729 60.561 -23.106 840 HA GLN 94 HA GLN 94 -3.200 62.649 -24.388 841 HB2 GLN 94 HB2 GLN 94 -5.267 63.938 -24.985 842 HB3 GLN 94 HB1 GLN 94 -4.993 62.508 -25.968 843 HG2 GLN 94 HG2 GLN 94 -6.600 61.297 -24.479 844 HG3 GLN 94 HG1 GLN 94 -6.979 62.853 -23.742 845 HE21 GLN 94 HE21 GLN 94 -7.207 60.897 -26.593 846 HE22 GLN 94 HE22 GLN 94 -8.397 61.854 -27.404 847 H LYS 95 HN LYS 95 -2.902 61.896 -21.894 848 HA LYS 95 HA LYS 95 -4.597 63.282 -20.042 849 HB2 LYS 95 HB2 LYS 95 -2.835 62.673 -18.379 850 HB3 LYS 95 HB1 LYS 95 -3.457 61.299 -19.283 851 HG2 LYS 95 HG2 LYS 95 -1.482 61.379 -20.736 852 HG3 LYS 95 HG1 LYS 95 -0.855 62.726 -19.788 853 HD2 LYS 95 HD2 LYS 95 -0.791 61.309 -17.802 854 HD3 LYS 95 HD1 LYS 95 -1.454 59.963 -18.731 855 HE2 LYS 95 HE2 LYS 95 0.934 59.693 -18.521 856 HE3 LYS 95 HE1 LYS 95 0.532 60.047 -20.200 857 HZ1 LYS 95 HZ1 LYS 95 1.642 61.941 -18.202 858 HZ2 LYS 95 HZ2 LYS 95 1.136 62.384 -19.754 859 HZ3 LYS 95 HZ3 LYS 95 2.436 61.320 -19.561 860 H ARG 96 HN ARG 96 -2.028 64.108 -22.064 861 HA ARG 96 HA ARG 96 -1.289 66.487 -20.557 862 HB2 ARG 96 HB2 ARG 96 0.471 65.163 -21.644 863 HB3 ARG 96 HB1 ARG 96 -0.302 65.401 -23.203 864 HG2 ARG 96 HG2 ARG 96 0.101 67.817 -23.009 865 HG3 ARG 96 HG1 ARG 96 0.935 67.534 -21.480 866 HD2 ARG 96 HD2 ARG 96 2.492 67.754 -23.370 867 HD3 ARG 96 HD1 ARG 96 2.593 66.176 -22.595 868 HE ARG 96 HE ARG 96 0.784 66.090 -24.769 869 HH11 ARG 96 HH11 ARG 96 4.205 66.342 -24.098 870 HH12 ARG 96 HH12 ARG 96 4.679 65.478 -25.526 871 HH21 ARG 96 HH21 ARG 96 1.395 64.963 -26.655 872 HH22 ARG 96 HH22 ARG 96 3.078 64.711 -26.996 873 H LYS 97 HN LYS 97 -3.175 67.726 -20.674 874 HA LYS 97 HA LYS 97 -4.409 68.228 -23.244 875 HB2 LYS 97 HB2 LYS 97 -5.026 69.230 -20.465 876 HB3 LYS 97 HB1 LYS 97 -5.890 69.784 -21.886 877 HG2 LYS 97 HG2 LYS 97 -7.237 68.134 -20.899 878 HG3 LYS 97 HG1 LYS 97 -6.496 67.370 -22.305 879 HD2 LYS 97 HD2 LYS 97 -4.962 66.172 -20.955 880 HD3 LYS 97 HD1 LYS 97 -5.360 67.132 -19.531 881 HE2 LYS 97 HE2 LYS 97 -6.373 64.914 -19.421 882 HE3 LYS 97 HE1 LYS 97 -7.600 66.177 -19.497 883 HZ1 LYS 97 HZ1 LYS 97 -8.132 64.307 -20.933 884 HZ2 LYS 97 HZ2 LYS 97 -6.688 64.526 -21.790 885 HZ3 LYS 97 HZ3 LYS 97 -7.892 65.713 -21.841 886 H ASN 98 HN ASN 98 -3.270 69.520 -24.562 887 HA ASN 98 HA ASN 98 -2.523 72.160 -23.495 888 HB2 ASN 98 HB2 ASN 98 -1.226 70.511 -25.654 889 HB3 ASN 98 HB1 ASN 98 -1.026 72.259 -25.602 890 HD21 ASN 98 HD21 ASN 98 -0.211 69.245 -24.159 891 HD22 ASN 98 HD22 ASN 98 0.983 69.856 -23.064 Start of MODEL 3 1 H1 LYS 1 HT1 LYS 1 12.843 16.239 15.312 2 H2 LYS 1 HT2 LYS 1 14.105 17.340 15.099 3 H3 LYS 1 HT3 LYS 1 14.448 15.706 15.370 4 HA LYS 1 HA LYS 1 14.760 16.260 13.063 5 HB2 LYS 1 HB2 LYS 1 12.382 14.503 13.686 6 HB3 LYS 1 HB1 LYS 1 13.113 14.598 12.091 7 HG2 LYS 1 HG2 LYS 1 14.503 13.703 14.610 8 HG3 LYS 1 HG1 LYS 1 13.903 12.650 13.327 9 HD2 LYS 1 HD2 LYS 1 15.421 13.724 11.739 10 HD3 LYS 1 HD1 LYS 1 16.014 14.778 13.018 11 HE2 LYS 1 HE2 LYS 1 16.854 12.842 14.238 12 HE3 LYS 1 HE1 LYS 1 16.239 11.777 12.976 13 HZ1 LYS 1 HZ1 LYS 1 17.735 12.807 11.404 14 HZ2 LYS 1 HZ2 LYS 1 18.608 12.217 12.725 15 HZ3 LYS 1 HZ3 LYS 1 18.304 13.874 12.586 16 HA PRO 2 HA PRO 2 12.036 19.481 11.652 17 HB2 PRO 2 HB2 PRO 2 13.173 19.899 9.279 18 HB3 PRO 2 HB1 PRO 2 13.957 20.409 10.779 19 HG2 PRO 2 HG2 PRO 2 14.471 17.984 9.098 20 HG3 PRO 2 HG1 PRO 2 15.640 19.076 9.866 21 HD2 PRO 2 HD2 PRO 2 14.927 16.669 10.927 22 HD3 PRO 2 HD1 PRO 2 15.430 18.054 11.916 23 H VAL 3 HN VAL 3 10.474 17.572 11.562 24 HA VAL 3 HA VAL 3 9.967 16.185 9.179 25 HB VAL 3 HB VAL 3 7.702 15.785 10.114 26 HG11 VAL 3 HG11 VAL 3 9.975 15.401 12.056 27 HG12 VAL 3 HG12 VAL 3 9.564 14.332 10.715 28 HG13 VAL 3 HG13 VAL 3 8.449 14.517 12.069 29 HG21 VAL 3 HG21 VAL 3 8.650 17.584 12.342 30 HG22 VAL 3 HG22 VAL 3 7.183 16.607 12.372 31 HG23 VAL 3 HG23 VAL 3 7.341 17.925 11.211 32 H SER 4 HN SER 4 8.131 16.449 7.731 33 HA SER 4 HA SER 4 6.978 17.616 6.169 34 HB2 SER 4 HB2 SER 4 5.693 18.389 8.186 35 HB3 SER 4 HB1 SER 4 6.754 19.794 8.266 36 HG SER 4 HG SER 4 5.901 20.574 6.423 37 H LEU 5 HN LEU 5 9.606 17.651 5.809 38 HA LEU 5 HA LEU 5 10.115 20.345 4.781 39 HB2 LEU 5 HB2 LEU 5 11.328 20.096 6.924 40 HB3 LEU 5 HB1 LEU 5 12.153 18.692 6.271 41 HG LEU 5 HG LEU 5 13.172 20.145 4.531 42 HD11 LEU 5 HD11 LEU 5 11.520 21.903 4.443 43 HD12 LEU 5 HD12 LEU 5 13.091 22.583 4.860 44 HD13 LEU 5 HD13 LEU 5 11.869 22.355 6.111 45 HD21 LEU 5 HD21 LEU 5 13.672 21.008 7.376 46 HD22 LEU 5 HD22 LEU 5 14.775 21.219 6.017 47 HD23 LEU 5 HD23 LEU 5 14.375 19.598 6.585 48 H SER 6 HN SER 6 12.071 17.374 4.918 49 HA SER 6 HA SER 6 11.720 17.048 2.036 50 HB2 SER 6 HB2 SER 6 14.242 16.697 1.867 51 HB3 SER 6 HB1 SER 6 13.696 18.359 2.084 52 HG SER 6 HG SER 6 15.342 18.030 3.522 53 H TYR 7 HN TYR 7 11.070 15.634 4.665 54 HA TYR 7 HA TYR 7 12.507 13.153 4.508 55 HB2 TYR 7 HB2 TYR 7 10.068 14.025 6.045 56 HB3 TYR 7 HB1 TYR 7 10.654 12.367 6.081 57 HD1 TYR 7 HD1 TYR 7 12.665 11.783 7.275 58 HD2 TYR 7 HD2 TYR 7 11.370 15.829 7.052 59 HE1 TYR 7 HE1 TYR 7 14.239 12.383 9.063 60 HE2 TYR 7 HE2 TYR 7 12.945 16.437 8.838 61 HH TYR 7 HH TYR 7 14.104 15.304 10.723 62 H ARG 8 HN ARG 8 11.934 11.310 3.510 63 HA ARG 8 HA ARG 8 9.824 11.568 1.518 64 HB2 ARG 8 HB2 ARG 8 12.057 9.565 1.826 65 HB3 ARG 8 HB1 ARG 8 10.853 9.508 0.546 66 HG2 ARG 8 HG2 ARG 8 12.809 11.746 1.031 67 HG3 ARG 8 HG1 ARG 8 12.922 10.518 -0.231 68 HD2 ARG 8 HD2 ARG 8 10.848 11.313 -1.219 69 HD3 ARG 8 HD1 ARG 8 10.674 12.503 0.069 70 HE ARG 8 HE ARG 8 13.152 12.873 -1.205 71 HH11 ARG 8 HH11 ARG 8 9.725 13.246 -1.822 72 HH12 ARG 8 HH12 ARG 8 9.938 14.564 -2.929 73 HH21 ARG 8 HH21 ARG 8 13.433 14.623 -2.656 74 HH22 ARG 8 HH22 ARG 8 12.043 15.359 -3.387 75 H CYS 9 HN CYS 9 9.021 9.205 0.937 76 HA CYS 9 HA CYS 9 7.001 8.622 2.742 77 HB2 CYS 9 HB2 CYS 9 8.124 6.724 0.685 78 HB3 CYS 9 HB1 CYS 9 6.464 6.858 1.245 79 HA PRO 10 HA PRO 10 8.224 6.324 6.173 80 HB2 PRO 10 HB2 PRO 10 6.696 4.045 5.017 81 HB3 PRO 10 HB1 PRO 10 6.680 4.683 6.662 82 HG2 PRO 10 HG2 PRO 10 4.760 5.288 4.879 83 HG3 PRO 10 HG1 PRO 10 5.300 6.430 6.116 84 HD2 PRO 10 HD2 PRO 10 5.712 6.494 3.224 85 HD3 PRO 10 HD1 PRO 10 5.869 7.804 4.403 86 H CYS 11 HN CYS 11 8.214 4.064 3.410 87 HA CYS 11 HA CYS 11 10.364 2.593 4.696 88 HB2 CYS 11 HB2 CYS 11 8.435 1.361 3.752 89 HB3 CYS 11 HB1 CYS 11 8.869 1.943 2.149 90 H ARG 12 HN ARG 12 12.302 2.110 3.791 91 HA ARG 12 HA ARG 12 13.538 3.963 2.027 92 HB2 ARG 12 HB2 ARG 12 14.423 1.383 3.282 93 HB3 ARG 12 HB1 ARG 12 15.382 2.156 2.043 94 HG2 ARG 12 HG2 ARG 12 16.190 2.737 4.246 95 HG3 ARG 12 HG1 ARG 12 15.586 4.158 3.394 96 HD2 ARG 12 HD2 ARG 12 14.783 4.272 5.628 97 HD3 ARG 12 HD1 ARG 12 13.437 3.847 4.572 98 HE ARG 12 HE ARG 12 14.655 1.518 5.629 99 HH11 ARG 12 HH11 ARG 12 12.528 4.156 6.505 100 HH12 ARG 12 HH12 ARG 12 11.690 3.244 7.719 101 HH21 ARG 12 HH21 ARG 12 13.549 0.311 7.228 102 HH22 ARG 12 HH22 ARG 12 12.274 1.063 8.133 103 H PHE 13 HN PHE 13 15.063 2.473 0.280 104 HA PHE 13 HA PHE 13 13.095 2.115 -1.755 105 HB2 PHE 13 HB2 PHE 13 15.011 1.710 -3.252 106 HB3 PHE 13 HB1 PHE 13 15.200 3.185 -2.309 107 HD1 PHE 13 HD1 PHE 13 16.494 -0.123 -2.990 108 HD2 PHE 13 HD2 PHE 13 16.778 3.265 -0.442 109 HE1 PHE 13 HE1 PHE 13 18.648 -0.924 -2.173 110 HE2 PHE 13 HE2 PHE 13 18.931 2.472 0.381 111 HZ PHE 13 HZ PHE 13 19.890 0.370 -0.480 112 H PHE 14 HN PHE 14 12.767 0.267 -3.016 113 HA PHE 14 HA PHE 14 12.300 -1.930 -1.251 114 HB2 PHE 14 HB2 PHE 14 11.490 -1.925 -4.112 115 HB3 PHE 14 HB1 PHE 14 10.603 -2.433 -2.692 116 HD1 PHE 14 HD1 PHE 14 9.286 -0.891 -1.401 117 HD2 PHE 14 HD2 PHE 14 11.508 0.415 -4.782 118 HE1 PHE 14 HE1 PHE 14 8.045 1.231 -1.390 119 HE2 PHE 14 HE2 PHE 14 10.269 2.537 -4.783 120 HZ PHE 14 HZ PHE 14 8.506 2.931 -3.135 121 H GLU 15 HN GLU 15 12.435 -4.177 -2.105 122 HA GLU 15 HA GLU 15 14.944 -4.598 -3.571 123 HB2 GLU 15 HB2 GLU 15 13.368 -6.353 -1.708 124 HB3 GLU 15 HB1 GLU 15 14.645 -6.986 -2.728 125 HG2 GLU 15 HG2 GLU 15 14.953 -4.873 -0.618 126 HG3 GLU 15 HG1 GLU 15 15.435 -6.562 -0.479 127 H SER 16 HN SER 16 14.753 -5.075 -5.618 128 HA SER 16 HA SER 16 12.342 -6.354 -6.642 129 HB2 SER 16 HB2 SER 16 13.400 -4.408 -7.851 130 HB3 SER 16 HB1 SER 16 14.794 -5.433 -8.177 131 HG SER 16 HG SER 16 12.568 -5.238 -9.573 132 H HIS 17 HN HIS 17 13.879 -7.781 -4.841 133 HA HIS 17 HA HIS 17 14.968 -9.951 -6.506 134 HB2 HIS 17 HB2 HIS 17 15.981 -9.033 -3.801 135 HB3 HIS 17 HB1 HIS 17 16.572 -10.430 -4.688 136 HD1 HIS 17 HD1 HIS 17 17.444 -7.063 -4.012 137 HD2 HIS 17 HD2 HIS 17 17.593 -9.485 -7.401 138 HE1 HIS 17 HE1 HIS 17 19.103 -5.976 -5.561 139 HE2 HIS 17 HE2 HIS 17 19.074 -7.378 -7.652 140 H ILE 18 HN ILE 18 12.646 -8.959 -4.389 141 HA ILE 18 HA ILE 18 12.448 -11.372 -2.816 142 HB ILE 18 HB ILE 18 10.628 -8.979 -2.975 143 HG12 ILE 18 HG12 ILE 18 12.650 -9.730 -0.874 144 HG13 ILE 18 HG11 ILE 18 12.941 -8.554 -2.147 145 HG21 ILE 18 HG21 ILE 18 10.656 -11.271 -1.021 146 HG22 ILE 18 HG22 ILE 18 9.399 -10.912 -2.206 147 HG23 ILE 18 HG23 ILE 18 9.682 -9.808 -0.857 148 HD11 ILE 18 HD11 ILE 18 10.970 -7.274 -1.235 149 HD12 ILE 18 HD12 ILE 18 12.407 -7.330 -0.212 150 HD13 ILE 18 HD13 ILE 18 11.022 -8.361 0.157 151 H ALA 19 HN ALA 19 11.047 -13.003 -3.086 152 HA ALA 19 HA ALA 19 9.311 -12.937 -5.465 153 HB1 ALA 19 HB1 ALA 19 9.559 -15.337 -5.594 154 HB2 ALA 19 HB2 ALA 19 10.487 -15.352 -4.096 155 HB3 ALA 19 HB3 ALA 19 11.156 -14.590 -5.541 156 H ARG 20 HN ARG 20 7.261 -14.005 -5.315 157 HA ARG 20 HA ARG 20 5.774 -13.473 -3.018 158 HB2 ARG 20 HB2 ARG 20 4.963 -13.815 -5.405 159 HB3 ARG 20 HB1 ARG 20 5.083 -15.544 -5.084 160 HG2 ARG 20 HG2 ARG 20 3.426 -15.429 -3.395 161 HG3 ARG 20 HG1 ARG 20 3.431 -13.665 -3.429 162 HD2 ARG 20 HD2 ARG 20 1.505 -14.441 -4.626 163 HD3 ARG 20 HD1 ARG 20 2.656 -13.759 -5.775 164 HE ARG 20 HE ARG 20 3.212 -16.445 -5.721 165 HH11 ARG 20 HH11 ARG 20 0.398 -14.477 -6.393 166 HH12 ARG 20 HH12 ARG 20 -0.280 -15.604 -7.527 167 HH21 ARG 20 HH21 ARG 20 2.317 -17.940 -7.222 168 HH22 ARG 20 HH22 ARG 20 0.807 -17.571 -7.995 169 H ALA 21 HN ALA 21 7.416 -16.361 -4.103 170 HA ALA 21 HA ALA 21 6.284 -18.009 -2.031 171 HB1 ALA 21 HB1 ALA 21 7.683 -19.783 -2.939 172 HB2 ALA 21 HB2 ALA 21 8.505 -18.613 -3.972 173 HB3 ALA 21 HB3 ALA 21 6.794 -18.963 -4.223 174 H ASN 22 HN ASN 22 8.643 -15.721 -2.084 175 HA ASN 22 HA ASN 22 10.187 -17.051 0.009 176 HB2 ASN 22 HB2 ASN 22 10.844 -15.004 -2.050 177 HB3 ASN 22 HB1 ASN 22 11.670 -14.901 -0.506 178 HD21 ASN 22 HD21 ASN 22 13.650 -15.405 -1.347 179 HD22 ASN 22 HD22 ASN 22 14.056 -16.985 -1.909 180 H VAL 23 HN VAL 23 7.742 -14.871 -0.445 181 HA VAL 23 HA VAL 23 8.537 -13.268 1.868 182 HB VAL 23 HB VAL 23 7.973 -11.942 -0.081 183 HG11 VAL 23 HG11 VAL 23 5.659 -11.894 -0.941 184 HG12 VAL 23 HG12 VAL 23 5.277 -13.278 0.088 185 HG13 VAL 23 HG13 VAL 23 6.453 -13.449 -1.224 186 HG21 VAL 23 HG21 VAL 23 6.381 -10.461 0.917 187 HG22 VAL 23 HG22 VAL 23 7.474 -11.113 2.150 188 HG23 VAL 23 HG23 VAL 23 5.833 -11.742 2.001 189 H LYS 24 HN LYS 24 7.243 -12.943 3.544 190 HA LYS 24 HA LYS 24 5.120 -14.877 4.034 191 HB2 LYS 24 HB2 LYS 24 6.557 -13.017 5.939 192 HB3 LYS 24 HB1 LYS 24 5.326 -14.178 6.393 193 HG2 LYS 24 HG2 LYS 24 6.939 -15.880 5.269 194 HG3 LYS 24 HG1 LYS 24 8.133 -14.622 5.588 195 HD2 LYS 24 HD2 LYS 24 6.338 -15.197 7.832 196 HD3 LYS 24 HD1 LYS 24 7.388 -16.532 7.371 197 HE2 LYS 24 HE2 LYS 24 9.342 -15.183 7.653 198 HE3 LYS 24 HE1 LYS 24 8.363 -13.730 7.894 199 HZ1 LYS 24 HZ1 LYS 24 7.495 -14.708 9.926 200 HZ2 LYS 24 HZ2 LYS 24 9.179 -14.604 9.988 201 HZ3 LYS 24 HZ3 LYS 24 8.436 -16.091 9.691 202 H HIS 25 HN HIS 25 3.908 -13.363 6.057 203 HA HIS 25 HA HIS 25 1.730 -12.196 5.089 204 HB2 HIS 25 HB2 HIS 25 3.097 -10.642 7.238 205 HB3 HIS 25 HB1 HIS 25 1.418 -11.154 7.142 206 HD1 HIS 25 HD1 HIS 25 2.949 -11.435 9.731 207 HD2 HIS 25 HD2 HIS 25 2.793 -14.483 6.904 208 HE1 HIS 25 HE1 HIS 25 3.514 -13.535 10.966 209 HE2 HIS 25 HE2 HIS 25 3.225 -15.389 9.284 210 H LEU 26 HN LEU 26 1.436 -10.698 3.549 211 HA LEU 26 HA LEU 26 3.469 -8.606 3.262 212 HB2 LEU 26 HB2 LEU 26 3.213 -10.079 1.336 213 HB3 LEU 26 HB1 LEU 26 1.509 -9.681 1.231 214 HG LEU 26 HG LEU 26 1.992 -7.448 0.525 215 HD11 LEU 26 HD11 LEU 26 3.834 -6.922 1.968 216 HD12 LEU 26 HD12 LEU 26 4.345 -6.676 0.304 217 HD13 LEU 26 HD13 LEU 26 4.851 -8.120 1.179 218 HD21 LEU 26 HD21 LEU 26 2.459 -9.540 -1.041 219 HD22 LEU 26 HD22 LEU 26 4.110 -8.891 -0.997 220 HD23 LEU 26 HD23 LEU 26 2.775 -7.890 -1.576 221 H LYS 27 HN LYS 27 2.980 -6.562 3.450 222 HA LYS 27 HA LYS 27 0.181 -5.746 3.855 223 HB2 LYS 27 HB2 LYS 27 0.987 -5.956 6.067 224 HB3 LYS 27 HB1 LYS 27 2.567 -5.325 5.637 225 HG2 LYS 27 HG2 LYS 27 1.495 -3.660 6.910 226 HG3 LYS 27 HG1 LYS 27 1.474 -3.114 5.231 227 HD2 LYS 27 HD2 LYS 27 -0.696 -2.674 5.769 228 HD3 LYS 27 HD1 LYS 27 -0.884 -4.357 5.280 229 HE2 LYS 27 HE2 LYS 27 -0.511 -3.377 8.109 230 HE3 LYS 27 HE1 LYS 27 -2.043 -3.863 7.392 231 HZ1 LYS 27 HZ1 LYS 27 -1.093 -5.623 8.736 232 HZ2 LYS 27 HZ2 LYS 27 0.312 -5.624 7.798 233 HZ3 LYS 27 HZ3 LYS 27 -1.159 -6.093 7.114 234 H ILE 28 HN ILE 28 -0.229 -3.523 3.348 235 HA ILE 28 HA ILE 28 1.943 -2.245 1.831 236 HB ILE 28 HB ILE 28 -0.969 -1.751 1.305 237 HG12 ILE 28 HG12 ILE 28 0.612 -3.512 -0.485 238 HG13 ILE 28 HG11 ILE 28 0.066 -4.213 1.033 239 HG21 ILE 28 HG21 ILE 28 0.552 -0.076 0.448 240 HG22 ILE 28 HG22 ILE 28 -0.054 -1.040 -0.899 241 HG23 ILE 28 HG23 ILE 28 1.579 -1.319 -0.276 242 HD11 ILE 28 HD11 ILE 28 -2.221 -3.638 0.472 243 HD12 ILE 28 HD12 ILE 28 -1.490 -4.659 -0.765 244 HD13 ILE 28 HD13 ILE 28 -1.674 -2.928 -1.043 245 H LEU 29 HN LEU 29 2.626 -0.379 2.616 246 HA LEU 29 HA LEU 29 1.433 0.852 4.894 247 HB2 LEU 29 HB2 LEU 29 3.917 0.895 4.053 248 HB3 LEU 29 HB1 LEU 29 3.379 2.253 3.090 249 HG LEU 29 HG LEU 29 4.444 3.116 5.044 250 HD11 LEU 29 HD11 LEU 29 2.558 4.426 4.404 251 HD12 LEU 29 HD12 LEU 29 2.613 4.357 6.165 252 HD13 LEU 29 HD13 LEU 29 1.449 3.369 5.278 253 HD21 LEU 29 HD21 LEU 29 2.560 1.406 6.663 254 HD22 LEU 29 HD22 LEU 29 3.726 2.560 7.308 255 HD23 LEU 29 HD23 LEU 29 4.287 1.129 6.444 256 H ASN 30 HN ASN 30 -0.369 2.024 4.822 257 HA ASN 30 HA ASN 30 -1.290 3.383 2.491 258 HB2 ASN 30 HB2 ASN 30 -2.055 3.376 5.386 259 HB3 ASN 30 HB1 ASN 30 -2.703 4.610 4.321 260 HD21 ASN 30 HD21 ASN 30 -1.982 1.367 3.254 261 HD22 ASN 30 HD22 ASN 30 -3.622 0.869 3.024 262 H THR 31 HN THR 31 0.322 4.735 1.739 263 HA THR 31 HA THR 31 1.595 6.592 3.513 264 HB THR 31 HB THR 31 2.669 7.264 1.300 265 HG1 THR 31 HG1 THR 31 2.148 4.747 0.301 266 HG21 THR 31 HG21 THR 31 4.260 5.431 1.453 267 HG22 THR 31 HG22 THR 31 3.090 4.480 2.367 268 HG23 THR 31 HG23 THR 31 3.758 5.960 3.060 269 HA PRO 32 HA PRO 32 -0.068 10.609 2.571 270 HB2 PRO 32 HB2 PRO 32 2.219 11.323 0.986 271 HB3 PRO 32 HB1 PRO 32 1.688 11.900 2.559 272 HG2 PRO 32 HG2 PRO 32 3.753 10.003 1.959 273 HG3 PRO 32 HG1 PRO 32 3.308 10.733 3.501 274 HD2 PRO 32 HD2 PRO 32 2.952 8.092 2.824 275 HD3 PRO 32 HD1 PRO 32 2.133 8.932 4.114 276 H ASN 33 HN ASN 33 0.076 8.310 0.291 277 HA ASN 33 HA ASN 33 -0.531 8.063 -1.874 278 HB2 ASN 33 HB2 ASN 33 -0.550 11.087 -2.049 279 HB3 ASN 33 HB1 ASN 33 -0.921 10.002 -3.385 280 HD21 ASN 33 HD21 ASN 33 -1.949 11.173 -0.288 281 HD22 ASN 33 HD22 ASN 33 -3.591 10.662 -0.399 282 H CYS 34 HN CYS 34 1.760 7.603 -0.955 283 HA CYS 34 HA CYS 34 3.747 8.417 -2.923 284 HB2 CYS 34 HB2 CYS 34 3.779 6.745 -0.403 285 HB3 CYS 34 HB1 CYS 34 5.134 6.759 -1.509 286 H ALA 35 HN ALA 35 4.959 6.379 -3.839 287 HA ALA 35 HA ALA 35 3.285 4.527 -5.072 288 HB1 ALA 35 HB1 ALA 35 5.276 3.120 -5.339 289 HB2 ALA 35 HB2 ALA 35 6.137 4.107 -4.158 290 HB3 ALA 35 HB3 ALA 35 5.642 4.808 -5.699 291 H LEU 36 HN LEU 36 2.011 3.017 -4.200 292 HA LEU 36 HA LEU 36 1.647 2.601 -1.509 293 HB2 LEU 36 HB2 LEU 36 1.021 0.882 -3.895 294 HB3 LEU 36 HB1 LEU 36 0.650 0.340 -2.275 295 HG LEU 36 HG LEU 36 -1.329 1.282 -3.281 296 HD11 LEU 36 HD11 LEU 36 -0.987 1.625 -0.879 297 HD12 LEU 36 HD12 LEU 36 -1.928 2.922 -1.611 298 HD13 LEU 36 HD13 LEU 36 -0.231 3.181 -1.218 299 HD21 LEU 36 HD21 LEU 36 0.265 3.819 -3.626 300 HD22 LEU 36 HD22 LEU 36 -1.459 3.629 -3.949 301 HD23 LEU 36 HD23 LEU 36 -0.276 2.749 -4.917 302 H GLN 37 HN GLN 37 2.938 1.821 -0.044 303 HA GLN 37 HA GLN 37 5.404 0.587 -0.822 304 HB2 GLN 37 HB2 GLN 37 4.360 1.095 1.958 305 HB3 GLN 37 HB1 GLN 37 6.034 0.868 1.480 306 HG2 GLN 37 HG2 GLN 37 4.621 3.091 0.164 307 HG3 GLN 37 HG1 GLN 37 4.889 3.261 1.897 308 HE21 GLN 37 HE21 GLN 37 6.243 4.968 1.488 309 HE22 GLN 37 HE22 GLN 37 7.864 4.748 0.917 310 H ILE 38 HN ILE 38 5.562 -1.495 -1.141 311 HA ILE 38 HA ILE 38 3.734 -3.388 0.055 312 HB ILE 38 HB ILE 38 6.147 -4.297 -1.446 313 HG12 ILE 38 HG12 ILE 38 5.393 -2.346 -2.780 314 HG13 ILE 38 HG11 ILE 38 5.185 -3.867 -3.628 315 HG21 ILE 38 HG21 ILE 38 4.989 -6.168 -1.301 316 HG22 ILE 38 HG22 ILE 38 3.841 -5.478 -2.454 317 HG23 ILE 38 HG23 ILE 38 3.558 -5.306 -0.719 318 HD11 ILE 38 HD11 ILE 38 3.316 -2.380 -3.988 319 HD12 ILE 38 HD12 ILE 38 3.012 -2.315 -2.248 320 HD13 ILE 38 HD13 ILE 38 2.808 -3.834 -3.123 321 H VAL 39 HN VAL 39 4.230 -3.571 2.253 322 HA VAL 39 HA VAL 39 7.049 -3.986 2.932 323 HB VAL 39 HB VAL 39 5.614 -2.250 4.180 324 HG11 VAL 39 HG11 VAL 39 3.667 -3.618 4.615 325 HG12 VAL 39 HG12 VAL 39 4.388 -3.030 6.114 326 HG13 VAL 39 HG13 VAL 39 4.642 -4.701 5.609 327 HG21 VAL 39 HG21 VAL 39 7.841 -2.868 4.878 328 HG22 VAL 39 HG22 VAL 39 7.226 -4.310 5.685 329 HG23 VAL 39 HG23 VAL 39 6.803 -2.708 6.294 330 H ALA 40 HN ALA 40 7.789 -5.878 3.436 331 HA ALA 40 HA ALA 40 5.892 -8.108 3.728 332 HB1 ALA 40 HB1 ALA 40 6.776 -7.819 1.409 333 HB2 ALA 40 HB2 ALA 40 7.163 -9.374 2.140 334 HB3 ALA 40 HB3 ALA 40 8.392 -8.113 2.046 335 H ARG 41 HN ARG 41 6.664 -9.896 4.913 336 HA ARG 41 HA ARG 41 9.293 -9.534 6.185 337 HB2 ARG 41 HB2 ARG 41 6.846 -11.093 6.964 338 HB3 ARG 41 HB1 ARG 41 8.421 -11.445 7.669 339 HG2 ARG 41 HG2 ARG 41 7.669 -8.615 7.708 340 HG3 ARG 41 HG1 ARG 41 6.652 -9.670 8.670 341 HD2 ARG 41 HD2 ARG 41 8.634 -10.558 9.793 342 HD3 ARG 41 HD1 ARG 41 9.643 -9.469 8.847 343 HE ARG 41 HE ARG 41 7.687 -7.959 10.177 344 HH11 ARG 41 HH11 ARG 41 10.547 -9.853 10.896 345 HH12 ARG 41 HH12 ARG 41 10.895 -8.990 12.361 346 HH21 ARG 41 HH21 ARG 41 8.153 -6.819 12.091 347 HH22 ARG 41 HH22 ARG 41 9.540 -7.257 13.038 348 H LEU 42 HN LEU 42 10.911 -10.923 5.683 349 HA LEU 42 HA LEU 42 10.504 -12.640 3.429 350 HB2 LEU 42 HB2 LEU 42 12.844 -11.988 5.176 351 HB3 LEU 42 HB1 LEU 42 12.946 -13.317 4.041 352 HG LEU 42 HG LEU 42 12.220 -10.521 3.188 353 HD11 LEU 42 HD11 LEU 42 14.565 -10.290 2.490 354 HD12 LEU 42 HD12 LEU 42 14.942 -11.817 3.286 355 HD13 LEU 42 HD13 LEU 42 14.406 -10.435 4.240 356 HD21 LEU 42 HD21 LEU 42 13.283 -12.923 1.698 357 HD22 LEU 42 HD22 LEU 42 12.940 -11.341 0.996 358 HD23 LEU 42 HD23 LEU 42 11.625 -12.322 1.642 359 H LYS 43 HN LYS 43 10.387 -14.792 3.276 360 HA LYS 43 HA LYS 43 8.999 -16.210 5.147 361 HB2 LYS 43 HB2 LYS 43 9.302 -16.788 2.756 362 HB3 LYS 43 HB1 LYS 43 10.906 -17.371 3.147 363 HG2 LYS 43 HG2 LYS 43 9.904 -19.049 4.648 364 HG3 LYS 43 HG1 LYS 43 8.304 -18.498 4.141 365 HD2 LYS 43 HD2 LYS 43 8.907 -19.036 1.799 366 HD3 LYS 43 HD1 LYS 43 10.448 -19.674 2.375 367 HE2 LYS 43 HE2 LYS 43 9.228 -21.314 3.749 368 HE3 LYS 43 HE1 LYS 43 7.708 -20.702 3.099 369 HZ1 LYS 43 HZ1 LYS 43 9.893 -21.938 1.517 370 HZ2 LYS 43 HZ2 LYS 43 8.439 -21.354 0.888 371 HZ3 LYS 43 HZ3 LYS 43 8.434 -22.687 1.931 372 H ASN 44 HN ASN 44 12.415 -16.862 4.431 373 HA ASN 44 HA ASN 44 12.676 -18.281 6.934 374 HB2 ASN 44 HB2 ASN 44 14.695 -17.723 4.773 375 HB3 ASN 44 HB1 ASN 44 14.975 -18.757 6.163 376 HD21 ASN 44 HD21 ASN 44 15.082 -19.382 3.335 377 HD22 ASN 44 HD22 ASN 44 13.948 -20.659 3.074 378 H ASN 45 HN ASN 45 13.767 -15.297 5.481 379 HA ASN 45 HA ASN 45 15.853 -14.827 7.344 380 HB2 ASN 45 HB2 ASN 45 15.411 -13.864 4.931 381 HB3 ASN 45 HB1 ASN 45 14.606 -12.594 5.832 382 HD21 ASN 45 HD21 ASN 45 15.814 -11.257 7.178 383 HD22 ASN 45 HD22 ASN 45 17.525 -11.133 7.029 384 H ASN 46 HN ASN 46 12.468 -14.092 7.294 385 HA ASN 46 HA ASN 46 11.051 -13.408 8.927 386 HB2 ASN 46 HB2 ASN 46 12.693 -14.710 10.405 387 HB3 ASN 46 HB1 ASN 46 13.377 -13.146 10.820 388 HD21 ASN 46 HD21 ASN 46 10.734 -15.308 11.223 389 HD22 ASN 46 HD22 ASN 46 9.912 -14.421 12.462 390 H ARG 47 HN ARG 47 13.451 -11.492 7.672 391 HA ARG 47 HA ARG 47 13.014 -9.199 9.346 392 HB2 ARG 47 HB2 ARG 47 14.603 -8.056 8.035 393 HB3 ARG 47 HB1 ARG 47 15.190 -9.703 8.116 394 HG2 ARG 47 HG2 ARG 47 14.699 -10.149 5.938 395 HG3 ARG 47 HG1 ARG 47 13.522 -8.840 5.816 396 HD2 ARG 47 HD2 ARG 47 16.471 -8.432 6.222 397 HD3 ARG 47 HD1 ARG 47 15.696 -8.445 4.638 398 HE ARG 47 HE ARG 47 14.708 -6.566 6.657 399 HH11 ARG 47 HH11 ARG 47 16.489 -7.091 3.683 400 HH12 ARG 47 HH12 ARG 47 16.454 -5.418 3.223 401 HH21 ARG 47 HH21 ARG 47 14.655 -4.372 6.043 402 HH22 ARG 47 HH22 ARG 47 15.412 -3.875 4.562 403 H GLN 48 HN GLN 48 11.959 -7.400 8.878 404 HA GLN 48 HA GLN 48 9.878 -7.457 6.904 405 HB2 GLN 48 HB2 GLN 48 9.675 -6.378 9.172 406 HB3 GLN 48 HB1 GLN 48 10.768 -5.124 8.612 407 HG2 GLN 48 HG2 GLN 48 9.168 -4.621 6.800 408 HG3 GLN 48 HG1 GLN 48 8.054 -5.778 7.526 409 HE21 GLN 48 HE21 GLN 48 9.535 -2.664 7.812 410 HE22 GLN 48 HE22 GLN 48 8.540 -2.078 9.098 411 H VAL 49 HN VAL 49 9.986 -6.545 4.945 412 HA VAL 49 HA VAL 49 12.097 -4.672 4.205 413 HB VAL 49 HB VAL 49 13.092 -6.928 3.864 414 HG11 VAL 49 HG11 VAL 49 11.104 -8.219 3.456 415 HG12 VAL 49 HG12 VAL 49 12.205 -8.385 2.087 416 HG13 VAL 49 HG13 VAL 49 10.794 -7.333 1.963 417 HG21 VAL 49 HG21 VAL 49 13.790 -6.625 1.527 418 HG22 VAL 49 HG22 VAL 49 13.813 -5.106 2.422 419 HG23 VAL 49 HG23 VAL 49 12.495 -5.449 1.302 420 H CYS 50 HN CYS 50 11.606 -3.708 2.032 421 HA CYS 50 HA CYS 50 8.759 -3.986 1.440 422 HB2 CYS 50 HB2 CYS 50 10.684 -1.735 0.880 423 HB3 CYS 50 HB1 CYS 50 9.036 -1.791 0.288 424 H ILE 51 HN ILE 51 8.103 -4.807 -0.387 425 HA ILE 51 HA ILE 51 10.001 -5.856 -2.296 426 HB ILE 51 HB ILE 51 7.085 -5.847 -2.911 427 HG12 ILE 51 HG12 ILE 51 8.289 -7.511 -0.683 428 HG13 ILE 51 HG11 ILE 51 7.040 -6.280 -0.508 429 HG21 ILE 51 HG21 ILE 51 8.899 -8.220 -2.908 430 HG22 ILE 51 HG22 ILE 51 9.053 -7.002 -4.172 431 HG23 ILE 51 HG23 ILE 51 7.525 -7.857 -3.955 432 HD11 ILE 51 HD11 ILE 51 5.949 -8.367 -0.420 433 HD12 ILE 51 HD12 ILE 51 6.818 -8.968 -1.827 434 HD13 ILE 51 HD13 ILE 51 5.603 -7.710 -2.018 435 H ASP 52 HN ASP 52 10.193 -5.205 -4.465 436 HA ASP 52 HA ASP 52 9.743 -2.406 -4.880 437 HB2 ASP 52 HB2 ASP 52 11.727 -3.783 -5.736 438 HB3 ASP 52 HB1 ASP 52 10.638 -4.362 -6.990 439 HA PRO 53 HA PRO 53 5.623 -2.804 -6.457 440 HB2 PRO 53 HB2 PRO 53 5.483 -0.321 -7.596 441 HB3 PRO 53 HB1 PRO 53 5.269 -0.634 -5.868 442 HG2 PRO 53 HG2 PRO 53 7.700 0.309 -7.336 443 HG3 PRO 53 HG1 PRO 53 7.029 0.882 -5.797 444 HD2 PRO 53 HD2 PRO 53 9.116 -0.780 -5.865 445 HD3 PRO 53 HD1 PRO 53 7.868 -0.925 -4.616 446 H LYS 54 HN LYS 54 8.447 -2.350 -8.323 447 HA LYS 54 HA LYS 54 7.030 -2.351 -10.870 448 HB2 LYS 54 HB2 LYS 54 9.924 -1.979 -10.183 449 HB3 LYS 54 HB1 LYS 54 9.298 -2.008 -11.830 450 HG2 LYS 54 HG2 LYS 54 7.951 -0.076 -11.425 451 HG3 LYS 54 HG1 LYS 54 8.343 -0.113 -9.707 452 HD2 LYS 54 HD2 LYS 54 10.363 0.245 -11.881 453 HD3 LYS 54 HD1 LYS 54 9.607 1.592 -11.026 454 HE2 LYS 54 HE2 LYS 54 10.448 0.584 -8.897 455 HE3 LYS 54 HE1 LYS 54 11.330 -0.585 -9.872 456 HZ1 LYS 54 HZ1 LYS 54 12.520 1.272 -10.906 457 HZ2 LYS 54 HZ2 LYS 54 12.765 1.214 -9.235 458 HZ3 LYS 54 HZ3 LYS 54 11.707 2.355 -9.891 459 H LEU 55 HN LEU 55 8.201 -4.571 -8.719 460 HA LEU 55 HA LEU 55 9.247 -6.601 -10.328 461 HB2 LEU 55 HB2 LEU 55 7.877 -6.388 -7.707 462 HB3 LEU 55 HB1 LEU 55 8.021 -7.992 -8.404 463 HG LEU 55 HG LEU 55 10.371 -6.150 -7.988 464 HD11 LEU 55 HD11 LEU 55 10.850 -7.600 -6.006 465 HD12 LEU 55 HD12 LEU 55 9.207 -8.230 -6.151 466 HD13 LEU 55 HD13 LEU 55 9.472 -6.515 -5.833 467 HD21 LEU 55 HD21 LEU 55 10.148 -9.113 -8.477 468 HD22 LEU 55 HD22 LEU 55 11.648 -8.227 -8.184 469 HD23 LEU 55 HD23 LEU 55 10.696 -7.896 -9.631 470 H LYS 56 HN LYS 56 8.297 -8.231 -11.492 471 HA LYS 56 HA LYS 56 5.948 -7.396 -12.834 472 HB2 LYS 56 HB2 LYS 56 7.548 -9.943 -13.059 473 HB3 LYS 56 HB1 LYS 56 6.221 -9.514 -14.131 474 HG2 LYS 56 HG2 LYS 56 8.803 -8.002 -13.781 475 HG3 LYS 56 HG1 LYS 56 8.330 -8.978 -15.172 476 HD2 LYS 56 HD2 LYS 56 6.442 -7.450 -15.579 477 HD3 LYS 56 HD1 LYS 56 6.964 -6.461 -14.216 478 HE2 LYS 56 HE2 LYS 56 9.116 -6.079 -15.356 479 HE3 LYS 56 HE1 LYS 56 8.526 -7.006 -16.733 480 HZ1 LYS 56 HZ1 LYS 56 8.274 -4.634 -17.088 481 HZ2 LYS 56 HZ2 LYS 56 7.322 -4.497 -15.699 482 HZ3 LYS 56 HZ3 LYS 56 6.760 -5.384 -17.026 483 H TRP 57 HN TRP 57 6.509 -9.692 -10.259 484 HA TRP 57 HA TRP 57 3.787 -10.694 -10.497 485 HB2 TRP 57 HB2 TRP 57 4.303 -12.172 -8.714 486 HB3 TRP 57 HB1 TRP 57 5.735 -12.126 -9.717 487 HD1 TRP 57 HD1 TRP 57 7.927 -11.132 -8.648 488 HE1 TRP 57 HE1 TRP 57 8.615 -10.632 -6.207 489 HE3 TRP 57 HE3 TRP 57 3.312 -11.275 -6.492 490 HZ2 TRP 57 HZ2 TRP 57 7.337 -10.344 -3.702 491 HZ3 TRP 57 HZ3 TRP 57 3.117 -10.860 -4.081 492 HH2 TRP 57 HH2 TRP 57 5.088 -10.412 -2.709 493 H ILE 58 HN ILE 58 5.548 -8.242 -8.899 494 HA ILE 58 HA ILE 58 3.686 -7.752 -6.798 495 HB ILE 58 HB ILE 58 6.024 -6.268 -7.933 496 HG12 ILE 58 HG12 ILE 58 6.379 -8.175 -6.397 497 HG13 ILE 58 HG11 ILE 58 6.975 -6.653 -5.741 498 HG21 ILE 58 HG21 ILE 58 5.702 -4.604 -6.111 499 HG22 ILE 58 HG22 ILE 58 4.072 -5.249 -5.900 500 HG23 ILE 58 HG23 ILE 58 4.538 -4.511 -7.437 501 HD11 ILE 58 HD11 ILE 58 4.296 -7.803 -5.054 502 HD12 ILE 58 HD12 ILE 58 5.147 -6.483 -4.256 503 HD13 ILE 58 HD13 ILE 58 5.758 -8.131 -4.138 504 H GLN 59 HN GLN 59 4.201 -6.485 -10.032 505 HA GLN 59 HA GLN 59 2.487 -4.312 -10.096 506 HB2 GLN 59 HB2 GLN 59 3.157 -6.424 -12.090 507 HB3 GLN 59 HB1 GLN 59 2.132 -5.067 -12.524 508 HG2 GLN 59 HG2 GLN 59 4.867 -4.715 -11.370 509 HG3 GLN 59 HG1 GLN 59 4.611 -4.947 -13.096 510 HE21 GLN 59 HE21 GLN 59 4.279 -2.780 -10.420 511 HE22 GLN 59 HE22 GLN 59 3.801 -1.396 -11.342 512 H GLU 60 HN GLU 60 1.787 -7.687 -10.103 513 HA GLU 60 HA GLU 60 -0.987 -7.450 -10.780 514 HB2 GLU 60 HB2 GLU 60 0.548 -9.724 -9.496 515 HB3 GLU 60 HB1 GLU 60 -1.089 -9.835 -10.128 516 HG2 GLU 60 HG2 GLU 60 1.363 -9.189 -11.749 517 HG3 GLU 60 HG1 GLU 60 0.592 -10.770 -11.649 518 H TYR 61 HN TYR 61 0.902 -7.676 -7.844 519 HA TYR 61 HA TYR 61 -1.371 -7.879 -6.088 520 HB2 TYR 61 HB2 TYR 61 0.830 -8.823 -5.471 521 HB3 TYR 61 HB1 TYR 61 1.539 -7.222 -5.527 522 HD1 TYR 61 HD1 TYR 61 -0.436 -9.544 -3.604 523 HD2 TYR 61 HD2 TYR 61 1.009 -5.552 -3.818 524 HE1 TYR 61 HE1 TYR 61 -0.932 -9.244 -1.236 525 HE2 TYR 61 HE2 TYR 61 0.508 -5.246 -1.422 526 HH TYR 61 HH TYR 61 -0.933 -6.205 0.298 527 H LEU 62 HN LEU 62 0.662 -5.464 -7.446 528 HA LEU 62 HA LEU 62 0.046 -3.230 -5.962 529 HB2 LEU 62 HB2 LEU 62 1.266 -3.874 -8.401 530 HB3 LEU 62 HB1 LEU 62 0.121 -2.580 -8.737 531 HG LEU 62 HG LEU 62 1.180 -1.272 -6.881 532 HD11 LEU 62 HD11 LEU 62 3.533 -2.095 -6.342 533 HD12 LEU 62 HD12 LEU 62 2.967 -3.665 -6.934 534 HD13 LEU 62 HD13 LEU 62 2.174 -2.899 -5.559 535 HD21 LEU 62 HD21 LEU 62 2.990 -2.090 -9.150 536 HD22 LEU 62 HD22 LEU 62 3.147 -0.628 -8.176 537 HD23 LEU 62 HD23 LEU 62 1.742 -0.845 -9.219 538 H GLU 63 HN GLU 63 -1.624 -4.602 -8.745 539 HA GLU 63 HA GLU 63 -3.668 -2.765 -8.965 540 HB2 GLU 63 HB2 GLU 63 -3.738 -5.729 -9.393 541 HB3 GLU 63 HB1 GLU 63 -4.945 -4.601 -9.973 542 HG2 GLU 63 HG2 GLU 63 -3.139 -3.410 -11.170 543 HG3 GLU 63 HG1 GLU 63 -2.067 -4.727 -10.738 544 H LYS 64 HN LYS 64 -3.227 -5.358 -6.735 545 HA LYS 64 HA LYS 64 -5.816 -5.295 -5.525 546 HB2 LYS 64 HB2 LYS 64 -3.278 -6.201 -4.199 547 HB3 LYS 64 HB1 LYS 64 -4.918 -6.738 -3.861 548 HG2 LYS 64 HG2 LYS 64 -3.332 -7.311 -6.344 549 HG3 LYS 64 HG1 LYS 64 -3.673 -8.452 -5.043 550 HD2 LYS 64 HD2 LYS 64 -6.112 -8.116 -5.547 551 HD3 LYS 64 HD1 LYS 64 -5.607 -7.189 -6.960 552 HE2 LYS 64 HE2 LYS 64 -6.116 -9.480 -7.585 553 HE3 LYS 64 HE1 LYS 64 -4.404 -9.134 -7.816 554 HZ1 LYS 64 HZ1 LYS 64 -3.899 -10.285 -5.782 555 HZ2 LYS 64 HZ2 LYS 64 -4.811 -11.304 -6.776 556 HZ3 LYS 64 HZ3 LYS 64 -5.542 -10.537 -5.458 557 H ALA 65 HN ALA 65 -2.658 -3.963 -4.809 558 HA ALA 65 HA ALA 65 -3.268 -2.716 -2.359 559 HB1 ALA 65 HB1 ALA 65 -0.996 -3.266 -3.075 560 HB2 ALA 65 HB2 ALA 65 -1.143 -1.549 -2.690 561 HB3 ALA 65 HB3 ALA 65 -1.119 -2.081 -4.373 562 H LEU 66 HN LEU 66 -3.477 -1.721 -5.662 563 HA LEU 66 HA LEU 66 -3.922 1.077 -4.989 564 HB2 LEU 66 HB2 LEU 66 -3.498 -0.468 -7.491 565 HB3 LEU 66 HB1 LEU 66 -4.314 1.074 -7.589 566 HG LEU 66 HG LEU 66 -2.369 2.144 -6.523 567 HD11 LEU 66 HD11 LEU 66 -1.118 -0.578 -6.809 568 HD12 LEU 66 HD12 LEU 66 -1.557 0.203 -5.291 569 HD13 LEU 66 HD13 LEU 66 -0.284 0.896 -6.303 570 HD21 LEU 66 HD21 LEU 66 -1.751 0.550 -9.003 571 HD22 LEU 66 HD22 LEU 66 -0.868 1.972 -8.450 572 HD23 LEU 66 HD23 LEU 66 -2.554 2.120 -8.943 573 H ASN 67 HN ASN 67 -5.728 -1.631 -5.286 574 HA ASN 67 HA ASN 67 -7.950 -1.414 -6.584 575 HB2 ASN 67 HB2 ASN 67 -9.143 -2.596 -4.934 576 HB3 ASN 67 HB1 ASN 67 -7.495 -3.151 -4.871 577 HD21 ASN 67 HD21 ASN 67 -6.511 -0.879 -3.370 578 HD22 ASN 67 HD22 ASN 67 -7.132 -1.039 -1.769 579 H LYS 68 HN LYS 68 -9.609 -0.337 -6.830 580 HA LYS 68 HA LYS 68 -10.194 1.981 -5.102 581 HB2 LYS 68 HB2 LYS 68 -10.885 2.167 -7.976 582 HB3 LYS 68 HB1 LYS 68 -10.315 3.414 -6.881 583 HG2 LYS 68 HG2 LYS 68 -8.615 3.197 -8.463 584 HG3 LYS 68 HG1 LYS 68 -8.025 2.294 -7.068 585 HD2 LYS 68 HD2 LYS 68 -8.682 0.199 -8.100 586 HD3 LYS 68 HD1 LYS 68 -9.391 1.066 -9.469 587 HE2 LYS 68 HE2 LYS 68 -7.150 1.952 -10.011 588 HE3 LYS 68 HE1 LYS 68 -6.486 1.009 -8.679 589 HZ1 LYS 68 HZ1 LYS 68 -6.213 -0.099 -10.826 590 HZ2 LYS 68 HZ2 LYS 68 -7.890 -0.133 -11.032 591 HZ3 LYS 68 HZ3 LYS 68 -7.177 -1.009 -9.777 592 H GLY 69 HN GLY 69 -11.319 -0.607 -7.107 593 HA2 GLY 69 HA2 GLY 69 -13.563 -1.515 -6.535 594 HA3 GLY 69 HA1 GLY 69 -14.112 0.158 -6.583 595 H ARG 70 HN ARG 70 -13.380 1.293 -8.701 596 HA ARG 70 HA ARG 70 -13.301 -0.473 -11.003 597 HB2 ARG 70 HB2 ARG 70 -15.704 -0.132 -10.669 598 HB3 ARG 70 HB1 ARG 70 -15.468 1.610 -10.653 599 HG2 ARG 70 HG2 ARG 70 -14.659 1.492 -12.981 600 HG3 ARG 70 HG1 ARG 70 -15.004 -0.240 -12.983 601 HD2 ARG 70 HD2 ARG 70 -17.353 0.198 -12.591 602 HD3 ARG 70 HD1 ARG 70 -17.035 1.928 -12.476 603 HE ARG 70 HE ARG 70 -16.225 0.708 -14.966 604 HH11 ARG 70 HH11 ARG 70 -18.790 2.311 -13.211 605 HH12 ARG 70 HH12 ARG 70 -19.599 2.864 -14.644 606 HH21 ARG 70 HH21 ARG 70 -17.287 1.436 -16.862 607 HH22 ARG 70 HH22 ARG 70 -18.767 2.337 -16.715 608 H ARG 71 HN ARG 71 -13.993 2.964 -10.411 609 HA ARG 71 HA ARG 71 -13.115 4.864 -11.281 610 HB2 ARG 71 HB2 ARG 71 -10.643 3.307 -10.566 611 HB3 ARG 71 HB1 ARG 71 -10.561 4.949 -11.179 612 HG2 ARG 71 HG2 ARG 71 -12.038 4.109 -8.696 613 HG3 ARG 71 HG1 ARG 71 -10.430 4.827 -8.729 614 HD2 ARG 71 HD2 ARG 71 -11.894 6.602 -8.245 615 HD3 ARG 71 HD1 ARG 71 -11.488 6.784 -9.948 616 HE ARG 71 HE ARG 71 -13.975 5.415 -9.195 617 HH11 ARG 71 HH11 ARG 71 -12.352 8.149 -10.669 618 HH12 ARG 71 HH12 ARG 71 -13.791 8.756 -11.426 619 HH21 ARG 71 HH21 ARG 71 -15.873 6.228 -10.195 620 HH22 ARG 71 HH22 ARG 71 -15.779 7.667 -11.171 621 H GLU 72 HN GLU 72 -14.097 3.729 -13.348 622 HA GLU 72 HA GLU 72 -12.230 3.040 -15.396 623 HB2 GLU 72 HB2 GLU 72 -14.640 2.318 -15.337 624 HB3 GLU 72 HB1 GLU 72 -15.085 3.972 -15.733 625 HG2 GLU 72 HG2 GLU 72 -13.872 3.809 -17.836 626 HG3 GLU 72 HG1 GLU 72 -13.387 2.162 -17.437 627 H GLU 73 HN GLU 73 -13.457 5.939 -14.073 628 HA GLU 73 HA GLU 73 -12.856 7.699 -16.226 629 HB2 GLU 73 HB2 GLU 73 -13.008 8.243 -13.256 630 HB3 GLU 73 HB1 GLU 73 -12.987 9.466 -14.516 631 HG2 GLU 73 HG2 GLU 73 -15.112 8.618 -15.373 632 HG3 GLU 73 HG1 GLU 73 -15.134 7.404 -14.092 633 H LYS 74 HN LYS 74 -10.798 7.012 -16.916 634 HA LYS 74 HA LYS 74 -8.540 7.006 -17.062 635 HB2 LYS 74 HB2 LYS 74 -8.674 9.032 -14.816 636 HB3 LYS 74 HB1 LYS 74 -7.259 8.689 -15.803 637 HG2 LYS 74 HG2 LYS 74 -8.438 9.476 -17.784 638 HG3 LYS 74 HG1 LYS 74 -9.868 9.808 -16.805 639 HD2 LYS 74 HD2 LYS 74 -8.541 11.406 -15.472 640 HD3 LYS 74 HD1 LYS 74 -7.160 11.109 -16.530 641 HE2 LYS 74 HE2 LYS 74 -8.328 13.148 -17.174 642 HE3 LYS 74 HE1 LYS 74 -8.442 11.929 -18.441 643 HZ1 LYS 74 HZ1 LYS 74 -10.671 11.424 -17.772 644 HZ2 LYS 74 HZ2 LYS 74 -10.553 13.097 -17.994 645 HZ3 LYS 74 HZ3 LYS 74 -10.565 12.454 -16.431 646 H VAL 75 HN VAL 75 -8.631 4.832 -16.354 647 HA VAL 75 HA VAL 75 -8.486 4.041 -13.643 648 HB VAL 75 HB VAL 75 -7.496 2.448 -16.012 649 HG11 VAL 75 HG11 VAL 75 -8.603 1.610 -13.336 650 HG12 VAL 75 HG12 VAL 75 -6.919 1.513 -13.849 651 HG13 VAL 75 HG13 VAL 75 -8.141 0.519 -14.642 652 HG21 VAL 75 HG21 VAL 75 -10.310 2.644 -14.943 653 HG22 VAL 75 HG22 VAL 75 -9.758 1.535 -16.198 654 HG23 VAL 75 HG23 VAL 75 -9.744 3.274 -16.490 655 H GLY 76 HN GLY 76 -6.857 5.249 -12.673 656 HA2 GLY 76 HA2 GLY 76 -4.751 5.637 -11.871 657 HA3 GLY 76 HA1 GLY 76 -4.332 4.053 -12.507 658 H LYS 77 HN LYS 77 -2.866 3.989 -14.044 659 HA LYS 77 HA LYS 77 -2.406 6.414 -15.658 660 HB2 LYS 77 HB2 LYS 77 -0.351 4.363 -14.821 661 HB3 LYS 77 HB1 LYS 77 -0.042 5.836 -15.726 662 HG2 LYS 77 HG2 LYS 77 -0.649 7.180 -13.803 663 HG3 LYS 77 HG1 LYS 77 -1.060 5.724 -12.894 664 HD2 LYS 77 HD2 LYS 77 1.674 6.457 -13.943 665 HD3 LYS 77 HD1 LYS 77 1.144 6.553 -12.265 666 HE2 LYS 77 HE2 LYS 77 0.799 4.132 -12.231 667 HE3 LYS 77 HE1 LYS 77 1.316 4.031 -13.912 668 HZ1 LYS 77 HZ1 LYS 77 2.988 4.918 -11.628 669 HZ2 LYS 77 HZ2 LYS 77 3.490 4.876 -13.244 670 HZ3 LYS 77 HZ3 LYS 77 3.109 3.436 -12.438 671 H LYS 78 HN LYS 78 -3.378 3.233 -15.651 672 HA LYS 78 HA LYS 78 -3.434 1.481 -17.077 673 HB2 LYS 78 HB2 LYS 78 -4.745 3.044 -18.439 674 HB3 LYS 78 HB1 LYS 78 -3.274 3.668 -19.164 675 HG2 LYS 78 HG2 LYS 78 -4.515 2.106 -20.625 676 HG3 LYS 78 HG1 LYS 78 -2.867 1.582 -20.279 677 HD2 LYS 78 HD2 LYS 78 -3.737 0.063 -18.547 678 HD3 LYS 78 HD1 LYS 78 -5.380 0.562 -18.954 679 HE2 LYS 78 HE2 LYS 78 -4.800 -1.560 -20.024 680 HE3 LYS 78 HE1 LYS 78 -5.095 -0.295 -21.214 681 HZ1 LYS 78 HZ1 LYS 78 -2.686 0.004 -21.400 682 HZ2 LYS 78 HZ2 LYS 78 -3.158 -1.563 -21.816 683 HZ3 LYS 78 HZ3 LYS 78 -2.430 -1.273 -20.314 684 H GLU 79 HN GLU 79 -1.170 1.530 -15.955 685 HA GLU 79 HA GLU 79 0.963 0.766 -16.036 686 HB2 GLU 79 HB2 GLU 79 0.456 0.432 -18.999 687 HB3 GLU 79 HB1 GLU 79 1.809 -0.249 -18.106 688 HG2 GLU 79 HG2 GLU 79 0.384 -1.704 -16.889 689 HG3 GLU 79 HG1 GLU 79 -1.060 -0.886 -17.483 690 H LYS 80 HN LYS 80 3.132 1.201 -17.398 691 HA LYS 80 HA LYS 80 4.706 2.697 -18.085 692 HB2 LYS 80 HB2 LYS 80 2.343 4.252 -19.153 693 HB3 LYS 80 HB1 LYS 80 4.025 4.521 -19.582 694 HG2 LYS 80 HG2 LYS 80 4.157 2.414 -20.692 695 HG3 LYS 80 HG1 LYS 80 2.566 1.939 -20.095 696 HD2 LYS 80 HD2 LYS 80 3.077 4.284 -21.925 697 HD3 LYS 80 HD1 LYS 80 2.568 2.685 -22.472 698 HE2 LYS 80 HE2 LYS 80 0.530 2.884 -21.117 699 HE3 LYS 80 HE1 LYS 80 1.041 4.486 -20.592 700 HZ1 LYS 80 HZ1 LYS 80 0.909 5.260 -22.854 701 HZ2 LYS 80 HZ2 LYS 80 -0.569 4.570 -22.409 702 HZ3 LYS 80 HZ3 LYS 80 0.497 3.716 -23.405 703 H ILE 81 HN ILE 81 4.934 5.367 -18.140 704 HA ILE 81 HA ILE 81 5.216 7.254 -16.933 705 HB ILE 81 HB ILE 81 2.586 6.501 -15.651 706 HG12 ILE 81 HG12 ILE 81 3.143 8.155 -18.125 707 HG13 ILE 81 HG11 ILE 81 2.496 6.519 -18.127 708 HG21 ILE 81 HG21 ILE 81 2.335 8.912 -15.290 709 HG22 ILE 81 HG22 ILE 81 3.940 9.180 -15.970 710 HG23 ILE 81 HG23 ILE 81 3.761 8.281 -14.463 711 HD11 ILE 81 HD11 ILE 81 1.162 8.961 -16.980 712 HD12 ILE 81 HD12 ILE 81 0.518 7.321 -16.921 713 HD13 ILE 81 HD13 ILE 81 0.733 8.127 -18.473 714 H GLY 82 HN GLY 82 7.053 6.434 -15.863 715 HA2 GLY 82 HA2 GLY 82 7.318 6.836 -13.216 716 HA3 GLY 82 HA1 GLY 82 6.762 5.168 -13.279 717 H LYS 83 HN LYS 83 8.808 4.611 -12.315 718 HA LYS 83 HA LYS 83 11.223 5.029 -13.832 719 HB2 LYS 83 HB2 LYS 83 10.566 3.643 -11.253 720 HB3 LYS 83 HB1 LYS 83 12.129 3.403 -12.015 721 HG2 LYS 83 HG2 LYS 83 11.009 6.095 -11.271 722 HG3 LYS 83 HG1 LYS 83 12.100 5.155 -10.253 723 HD2 LYS 83 HD2 LYS 83 12.719 6.105 -13.053 724 HD3 LYS 83 HD1 LYS 83 13.274 6.887 -11.573 725 HE2 LYS 83 HE2 LYS 83 14.503 4.880 -10.954 726 HE3 LYS 83 HE1 LYS 83 13.903 4.050 -12.386 727 HZ1 LYS 83 HZ1 LYS 83 15.615 6.472 -12.422 728 HZ2 LYS 83 HZ2 LYS 83 15.095 5.595 -13.770 729 HZ3 LYS 83 HZ3 LYS 83 16.165 4.891 -12.666 730 H LYS 84 HN LYS 84 9.816 3.896 -15.627 731 HA LYS 84 HA LYS 84 10.160 1.001 -15.585 732 HB2 LYS 84 HB2 LYS 84 8.975 2.838 -17.677 733 HB3 LYS 84 HB1 LYS 84 9.017 1.086 -17.789 734 HG2 LYS 84 HG2 LYS 84 7.624 2.610 -15.599 735 HG3 LYS 84 HG1 LYS 84 6.833 2.007 -17.056 736 HD2 LYS 84 HD2 LYS 84 8.332 0.248 -15.119 737 HD3 LYS 84 HD1 LYS 84 6.597 0.543 -15.026 738 HE2 LYS 84 HE2 LYS 84 8.043 -0.657 -17.387 739 HE3 LYS 84 HE1 LYS 84 7.128 -1.562 -16.185 740 HZ1 LYS 84 HZ1 LYS 84 5.152 -0.282 -16.843 741 HZ2 LYS 84 HZ2 LYS 84 5.775 -1.207 -18.113 742 HZ3 LYS 84 HZ3 LYS 84 6.049 0.461 -18.071 743 H LYS 85 HN LYS 85 11.191 -0.034 -17.495 744 HA LYS 85 HA LYS 85 12.990 -0.436 -18.815 745 HB2 LYS 85 HB2 LYS 85 12.212 1.553 -20.080 746 HB3 LYS 85 HB1 LYS 85 13.203 2.574 -19.050 747 HG2 LYS 85 HG2 LYS 85 15.213 1.529 -19.885 748 HG3 LYS 85 HG1 LYS 85 14.257 0.401 -20.848 749 HD2 LYS 85 HD2 LYS 85 13.348 2.258 -22.140 750 HD3 LYS 85 HD1 LYS 85 14.264 3.402 -21.160 751 HE2 LYS 85 HE2 LYS 85 15.461 1.236 -22.884 752 HE3 LYS 85 HE1 LYS 85 15.332 2.935 -23.334 753 HZ1 LYS 85 HZ1 LYS 85 16.713 3.466 -21.378 754 HZ2 LYS 85 HZ2 LYS 85 17.518 2.501 -22.509 755 HZ3 LYS 85 HZ3 LYS 85 16.916 1.813 -21.091 756 H ARG 86 HN ARG 86 15.194 -0.779 -18.532 757 HA ARG 86 HA ARG 86 17.051 -1.119 -17.264 758 HB2 ARG 86 HB2 ARG 86 16.496 1.739 -16.445 759 HB3 ARG 86 HB1 ARG 86 17.924 0.848 -15.940 760 HG2 ARG 86 HG2 ARG 86 18.546 0.567 -18.313 761 HG3 ARG 86 HG1 ARG 86 17.154 1.554 -18.763 762 HD2 ARG 86 HD2 ARG 86 19.215 2.872 -18.714 763 HD3 ARG 86 HD1 ARG 86 18.061 3.431 -17.503 764 HE ARG 86 HE ARG 86 19.909 1.523 -16.451 765 HH11 ARG 86 HH11 ARG 86 19.521 4.904 -17.269 766 HH12 ARG 86 HH12 ARG 86 20.698 5.446 -16.114 767 HH21 ARG 86 HH21 ARG 86 21.466 2.238 -14.939 768 HH22 ARG 86 HH22 ARG 86 21.799 3.934 -14.792 769 H GLN 87 HN GLN 87 14.638 -2.053 -16.335 770 HA GLN 87 HA GLN 87 15.136 -2.176 -13.460 771 HB2 GLN 87 HB2 GLN 87 13.325 -0.488 -13.859 772 HB3 GLN 87 HB1 GLN 87 12.381 -1.747 -14.643 773 HG2 GLN 87 HG2 GLN 87 11.628 -1.421 -12.378 774 HG3 GLN 87 HG1 GLN 87 12.350 -3.019 -12.554 775 HE21 GLN 87 HE21 GLN 87 14.244 -0.093 -12.349 776 HE22 GLN 87 HE22 GLN 87 14.916 -0.408 -10.789 777 H LYS 88 HN LYS 88 15.523 -4.256 -13.128 778 HA LYS 88 HA LYS 88 15.433 -6.523 -13.196 779 HB2 LYS 88 HB2 LYS 88 12.959 -6.258 -13.011 780 HB3 LYS 88 HB1 LYS 88 12.863 -6.229 -14.766 781 HG2 LYS 88 HG2 LYS 88 13.855 -8.496 -14.807 782 HG3 LYS 88 HG1 LYS 88 13.795 -8.516 -13.046 783 HD2 LYS 88 HD2 LYS 88 11.356 -8.214 -13.144 784 HD3 LYS 88 HD1 LYS 88 11.434 -8.243 -14.906 785 HE2 LYS 88 HE2 LYS 88 12.212 -10.480 -13.038 786 HE3 LYS 88 HE1 LYS 88 10.768 -10.413 -14.047 787 HZ1 LYS 88 HZ1 LYS 88 13.570 -10.492 -15.030 788 HZ2 LYS 88 HZ2 LYS 88 12.191 -10.411 -16.006 789 HZ3 LYS 88 HZ3 LYS 88 12.473 -11.778 -15.054 790 H LYS 89 HN LYS 89 14.617 -4.906 -16.218 791 HA LYS 89 HA LYS 89 16.912 -6.187 -17.452 792 HB2 LYS 89 HB2 LYS 89 15.617 -6.677 -19.538 793 HB3 LYS 89 HB1 LYS 89 15.186 -7.690 -18.173 794 HG2 LYS 89 HG2 LYS 89 13.152 -7.170 -19.174 795 HG3 LYS 89 HG1 LYS 89 13.246 -6.060 -17.807 796 HD2 LYS 89 HD2 LYS 89 13.914 -4.254 -19.260 797 HD3 LYS 89 HD1 LYS 89 14.015 -5.350 -20.637 798 HE2 LYS 89 HE2 LYS 89 11.491 -4.749 -19.101 799 HE3 LYS 89 HE1 LYS 89 11.953 -3.970 -20.614 800 HZ1 LYS 89 HZ1 LYS 89 11.948 -6.166 -21.669 801 HZ2 LYS 89 HZ2 LYS 89 10.433 -5.761 -21.041 802 HZ3 LYS 89 HZ3 LYS 89 11.415 -6.865 -20.221 803 H ARG 90 HN ARG 90 17.598 -5.029 -19.419 804 HA ARG 90 HA ARG 90 17.080 -2.179 -19.121 805 HB2 ARG 90 HB2 ARG 90 18.947 -3.567 -21.048 806 HB3 ARG 90 HB1 ARG 90 18.922 -1.854 -20.668 807 HG2 ARG 90 HG2 ARG 90 19.587 -2.374 -18.364 808 HG3 ARG 90 HG1 ARG 90 19.662 -4.086 -18.789 809 HD2 ARG 90 HD2 ARG 90 21.361 -1.841 -19.856 810 HD3 ARG 90 HD1 ARG 90 21.881 -3.225 -18.900 811 HE ARG 90 HE ARG 90 20.661 -3.932 -21.406 812 HH11 ARG 90 HH11 ARG 90 23.655 -3.081 -19.809 813 HH12 ARG 90 HH12 ARG 90 24.653 -3.802 -21.029 814 HH21 ARG 90 HH21 ARG 90 21.959 -4.869 -23.013 815 HH22 ARG 90 HH22 ARG 90 23.687 -4.831 -22.858 816 H LYS 91 HN LYS 91 17.017 -4.602 -21.700 817 HA LYS 91 HA LYS 91 14.920 -3.036 -23.050 818 HB2 LYS 91 HB2 LYS 91 17.261 -4.469 -24.322 819 HB3 LYS 91 HB1 LYS 91 15.879 -3.860 -25.219 820 HG2 LYS 91 HG2 LYS 91 17.694 -2.142 -23.550 821 HG3 LYS 91 HG1 LYS 91 17.881 -2.397 -25.285 822 HD2 LYS 91 HD2 LYS 91 15.552 -1.532 -25.577 823 HD3 LYS 91 HD1 LYS 91 15.554 -1.114 -23.863 824 HE2 LYS 91 HE2 LYS 91 16.120 0.810 -25.276 825 HE3 LYS 91 HE1 LYS 91 17.445 0.366 -24.201 826 HZ1 LYS 91 HZ1 LYS 91 17.250 -0.416 -27.057 827 HZ2 LYS 91 HZ2 LYS 91 18.546 -0.730 -26.020 828 HZ3 LYS 91 HZ3 LYS 91 18.190 0.859 -26.467 829 H ALA 92 HN ALA 92 16.545 -6.139 -23.555 830 HA ALA 92 HA ALA 92 14.116 -7.612 -22.987 831 HB1 ALA 92 HB1 ALA 92 14.087 -8.727 -25.168 832 HB2 ALA 92 HB2 ALA 92 15.410 -7.697 -25.716 833 HB3 ALA 92 HB3 ALA 92 13.840 -6.990 -25.341 834 H ALA 93 HN ALA 93 14.515 -9.905 -22.841 835 HA ALA 93 HA ALA 93 17.245 -10.501 -22.053 836 HB1 ALA 93 HB1 ALA 93 14.749 -12.195 -21.943 837 HB2 ALA 93 HB2 ALA 93 15.425 -11.248 -20.618 838 HB3 ALA 93 HB3 ALA 93 16.314 -12.629 -21.257 839 H GLN 94 HN GLN 94 18.127 -10.306 -24.200 840 HA GLN 94 HA GLN 94 17.275 -12.143 -26.254 841 HB2 GLN 94 HB2 GLN 94 19.719 -10.366 -26.143 842 HB3 GLN 94 HB1 GLN 94 19.127 -11.213 -27.563 843 HG2 GLN 94 HG2 GLN 94 17.049 -9.882 -27.442 844 HG3 GLN 94 HG1 GLN 94 17.738 -8.986 -26.091 845 HE21 GLN 94 HE21 GLN 94 19.573 -10.098 -28.849 846 HE22 GLN 94 HE22 GLN 94 19.908 -8.533 -29.500 847 H LYS 95 HN LYS 95 17.569 -14.030 -24.833 848 HA LYS 95 HA LYS 95 20.257 -14.843 -24.196 849 HB2 LYS 95 HB2 LYS 95 18.394 -15.479 -22.742 850 HB3 LYS 95 HB1 LYS 95 17.641 -16.357 -24.064 851 HG2 LYS 95 HG2 LYS 95 19.363 -17.995 -24.068 852 HG3 LYS 95 HG1 LYS 95 20.352 -17.043 -22.959 853 HD2 LYS 95 HD2 LYS 95 19.295 -18.864 -21.765 854 HD3 LYS 95 HD1 LYS 95 18.631 -17.326 -21.219 855 HE2 LYS 95 HE2 LYS 95 16.852 -18.928 -21.470 856 HE3 LYS 95 HE1 LYS 95 16.688 -17.676 -22.698 857 HZ1 LYS 95 HZ1 LYS 95 17.603 -19.158 -24.329 858 HZ2 LYS 95 HZ2 LYS 95 16.317 -19.933 -23.555 859 HZ3 LYS 95 HZ3 LYS 95 17.910 -20.342 -23.161 860 H ARG 96 HN ARG 96 17.850 -15.572 -26.642 861 HA ARG 96 HA ARG 96 19.841 -17.232 -28.036 862 HB2 ARG 96 HB2 ARG 96 17.736 -18.381 -27.294 863 HB3 ARG 96 HB1 ARG 96 16.839 -17.313 -28.362 864 HG2 ARG 96 HG2 ARG 96 17.977 -18.231 -30.290 865 HG3 ARG 96 HG1 ARG 96 18.972 -19.247 -29.243 866 HD2 ARG 96 HD2 ARG 96 15.979 -19.385 -29.583 867 HD3 ARG 96 HD1 ARG 96 17.162 -20.558 -30.160 868 HE ARG 96 HE ARG 96 17.675 -20.607 -27.562 869 HH11 ARG 96 HH11 ARG 96 14.598 -20.651 -29.236 870 HH12 ARG 96 HH12 ARG 96 13.789 -21.519 -27.971 871 HH21 ARG 96 HH21 ARG 96 16.609 -21.745 -25.904 872 HH22 ARG 96 HH22 ARG 96 14.931 -22.142 -26.080 873 H LYS 97 HN LYS 97 20.316 -16.772 -30.153 874 HA LYS 97 HA LYS 97 19.090 -14.317 -31.225 875 HB2 LYS 97 HB2 LYS 97 21.886 -15.388 -31.636 876 HB3 LYS 97 HB1 LYS 97 21.223 -13.981 -32.457 877 HG2 LYS 97 HG2 LYS 97 20.913 -12.888 -30.270 878 HG3 LYS 97 HG1 LYS 97 21.671 -14.280 -29.496 879 HD2 LYS 97 HD2 LYS 97 23.725 -13.870 -30.734 880 HD3 LYS 97 HD1 LYS 97 22.969 -12.511 -31.567 881 HE2 LYS 97 HE2 LYS 97 22.640 -11.413 -29.369 882 HE3 LYS 97 HE1 LYS 97 23.517 -12.740 -28.611 883 HZ1 LYS 97 HZ1 LYS 97 25.451 -12.159 -29.960 884 HZ2 LYS 97 HZ2 LYS 97 24.966 -10.870 -28.979 885 HZ3 LYS 97 HZ3 LYS 97 24.605 -10.856 -30.632 886 H ASN 98 HN ASN 98 19.019 -14.166 -33.585 887 HA ASN 98 HA ASN 98 18.159 -16.690 -34.731 888 HB2 ASN 98 HB2 ASN 98 16.745 -14.704 -35.048 889 HB3 ASN 98 HB1 ASN 98 18.072 -13.880 -35.861 890 HD21 ASN 98 HD21 ASN 98 16.898 -13.612 -37.741 891 HD22 ASN 98 HD22 ASN 98 16.557 -14.925 -38.814 Start of MODEL 4 1 H1 LYS 1 HT1 LYS 1 8.747 28.500 1.747 2 H2 LYS 1 HT2 LYS 1 9.046 28.241 0.104 3 H3 LYS 1 HT3 LYS 1 10.053 27.542 1.263 4 HA LYS 1 HA LYS 1 8.201 26.212 2.082 5 HB2 LYS 1 HB2 LYS 1 6.776 27.242 -0.384 6 HB3 LYS 1 HB1 LYS 1 6.163 26.050 0.747 7 HG2 LYS 1 HG2 LYS 1 5.038 27.911 1.436 8 HG3 LYS 1 HG1 LYS 1 6.450 27.983 2.487 9 HD2 LYS 1 HD2 LYS 1 6.048 30.181 1.603 10 HD3 LYS 1 HD1 LYS 1 7.509 29.538 0.853 11 HE2 LYS 1 HE2 LYS 1 6.226 28.932 -1.139 12 HE3 LYS 1 HE1 LYS 1 4.757 29.544 -0.384 13 HZ1 LYS 1 HZ1 LYS 1 7.155 31.183 -1.002 14 HZ2 LYS 1 HZ2 LYS 1 5.688 31.747 -0.376 15 HZ3 LYS 1 HZ3 LYS 1 5.753 31.124 -1.944 16 HA PRO 2 HA PRO 2 10.897 24.098 -0.977 17 HB2 PRO 2 HB2 PRO 2 10.967 22.088 1.188 18 HB3 PRO 2 HB1 PRO 2 12.299 22.883 0.353 19 HG2 PRO 2 HG2 PRO 2 11.717 23.508 2.871 20 HG3 PRO 2 HG1 PRO 2 12.220 24.756 1.714 21 HD2 PRO 2 HD2 PRO 2 9.463 24.043 2.647 22 HD3 PRO 2 HD1 PRO 2 10.199 25.650 2.463 23 H VAL 3 HN VAL 3 10.785 21.936 -1.940 24 HA VAL 3 HA VAL 3 8.026 21.093 -2.215 25 HB VAL 3 HB VAL 3 8.937 19.673 -4.071 26 HG11 VAL 3 HG11 VAL 3 9.542 22.621 -4.170 27 HG12 VAL 3 HG12 VAL 3 8.002 21.851 -4.545 28 HG13 VAL 3 HG13 VAL 3 9.401 21.568 -5.576 29 HG21 VAL 3 HG21 VAL 3 11.202 20.059 -4.859 30 HG22 VAL 3 HG22 VAL 3 11.227 19.431 -3.211 31 HG23 VAL 3 HG23 VAL 3 11.505 21.146 -3.505 32 H SER 4 HN SER 4 8.739 20.404 0.254 33 HA SER 4 HA SER 4 9.538 17.574 0.135 34 HB2 SER 4 HB2 SER 4 9.623 19.482 2.480 35 HB3 SER 4 HB1 SER 4 10.205 17.818 2.480 36 HG SER 4 HG SER 4 11.800 19.570 2.121 37 H LEU 5 HN LEU 5 6.846 18.726 -0.333 38 HA LEU 5 HA LEU 5 5.205 18.378 1.933 39 HB2 LEU 5 HB2 LEU 5 4.622 18.406 -1.015 40 HB3 LEU 5 HB1 LEU 5 3.358 18.142 0.169 41 HG LEU 5 HG LEU 5 3.929 20.360 1.183 42 HD11 LEU 5 HD11 LEU 5 5.626 20.666 -1.290 43 HD12 LEU 5 HD12 LEU 5 6.219 20.550 0.369 44 HD13 LEU 5 HD13 LEU 5 5.245 21.937 -0.127 45 HD21 LEU 5 HD21 LEU 5 2.832 21.671 -0.561 46 HD22 LEU 5 HD22 LEU 5 2.055 20.102 -0.347 47 HD23 LEU 5 HD23 LEU 5 3.125 20.376 -1.722 48 H SER 6 HN SER 6 6.078 16.222 -0.717 49 HA SER 6 HA SER 6 4.943 13.982 0.824 50 HB2 SER 6 HB2 SER 6 3.667 14.605 -1.289 51 HB3 SER 6 HB1 SER 6 5.095 14.120 -2.198 52 HG SER 6 HG SER 6 3.371 12.494 -1.870 53 H TYR 7 HN TYR 7 7.558 15.063 0.998 54 HA TYR 7 HA TYR 7 9.271 13.237 -0.500 55 HB2 TYR 7 HB2 TYR 7 9.781 15.690 -0.368 56 HB3 TYR 7 HB1 TYR 7 10.065 15.487 1.357 57 HD1 TYR 7 HD1 TYR 7 11.120 13.670 -1.739 58 HD2 TYR 7 HD2 TYR 7 12.306 15.533 1.896 59 HE1 TYR 7 HE1 TYR 7 13.460 13.108 -2.221 60 HE2 TYR 7 HE2 TYR 7 14.653 14.970 1.422 61 HH TYR 7 HH TYR 7 15.679 13.833 -1.643 62 H ARG 8 HN ARG 8 10.843 11.940 0.549 63 HA ARG 8 HA ARG 8 11.483 10.331 1.992 64 HB2 ARG 8 HB2 ARG 8 10.690 12.438 3.999 65 HB3 ARG 8 HB1 ARG 8 11.550 10.958 4.409 66 HG2 ARG 8 HG2 ARG 8 12.550 13.025 2.468 67 HG3 ARG 8 HG1 ARG 8 13.008 12.939 4.163 68 HD2 ARG 8 HD2 ARG 8 13.474 10.812 2.082 69 HD3 ARG 8 HD1 ARG 8 14.693 11.891 2.751 70 HE ARG 8 HE ARG 8 13.242 10.085 4.553 71 HH11 ARG 8 HH11 ARG 8 16.223 11.002 2.958 72 HH12 ARG 8 HH12 ARG 8 17.215 9.987 3.954 73 HH21 ARG 8 HH21 ARG 8 14.544 8.733 5.852 74 HH22 ARG 8 HH22 ARG 8 16.260 8.703 5.602 75 H CYS 9 HN CYS 9 9.767 9.018 1.236 76 HA CYS 9 HA CYS 9 7.248 8.854 2.496 77 HB2 CYS 9 HB2 CYS 9 8.715 6.683 0.996 78 HB3 CYS 9 HB1 CYS 9 6.982 6.879 1.168 79 HA PRO 10 HA PRO 10 7.917 6.428 6.076 80 HB2 PRO 10 HB2 PRO 10 6.358 4.080 5.260 81 HB3 PRO 10 HB1 PRO 10 6.025 5.263 6.526 82 HG2 PRO 10 HG2 PRO 10 4.573 5.176 4.279 83 HG3 PRO 10 HG1 PRO 10 4.950 6.705 5.095 84 HD2 PRO 10 HD2 PRO 10 6.264 5.464 2.708 85 HD3 PRO 10 HD1 PRO 10 5.772 7.139 2.959 86 H CYS 11 HN CYS 11 7.769 4.005 3.494 87 HA CYS 11 HA CYS 11 10.058 2.616 4.642 88 HB2 CYS 11 HB2 CYS 11 8.207 1.232 3.812 89 HB3 CYS 11 HB1 CYS 11 8.386 1.933 2.206 90 H ARG 12 HN ARG 12 12.036 2.541 3.802 91 HA ARG 12 HA ARG 12 12.919 4.426 1.871 92 HB2 ARG 12 HB2 ARG 12 14.339 2.021 3.011 93 HB3 ARG 12 HB1 ARG 12 15.089 3.273 2.025 94 HG2 ARG 12 HG2 ARG 12 13.990 4.804 3.925 95 HG3 ARG 12 HG1 ARG 12 14.268 3.327 4.851 96 HD2 ARG 12 HD2 ARG 12 16.605 3.335 4.200 97 HD3 ARG 12 HD1 ARG 12 16.329 4.761 3.199 98 HE ARG 12 HE ARG 12 15.543 5.268 5.866 99 HH11 ARG 12 HH11 ARG 12 18.403 4.894 3.891 100 HH12 ARG 12 HH12 ARG 12 19.386 5.900 4.905 101 HH21 ARG 12 HH21 ARG 12 16.817 6.595 7.193 102 HH22 ARG 12 HH22 ARG 12 18.483 6.871 6.792 103 H PHE 13 HN PHE 13 14.671 3.024 0.231 104 HA PHE 13 HA PHE 13 12.736 2.352 -1.773 105 HB2 PHE 13 HB2 PHE 13 15.760 2.268 -1.915 106 HB3 PHE 13 HB1 PHE 13 14.652 2.246 -3.285 107 HD1 PHE 13 HD1 PHE 13 13.556 4.252 -4.032 108 HD2 PHE 13 HD2 PHE 13 16.090 4.307 -0.617 109 HE1 PHE 13 HE1 PHE 13 13.571 6.703 -4.083 110 HE2 PHE 13 HE2 PHE 13 16.107 6.749 -0.659 111 HZ PHE 13 HZ PHE 13 14.848 7.966 -2.397 112 H PHE 14 HN PHE 14 12.486 0.410 -2.814 113 HA PHE 14 HA PHE 14 12.683 -1.708 -0.833 114 HB2 PHE 14 HB2 PHE 14 10.860 -2.340 -2.933 115 HB3 PHE 14 HB1 PHE 14 10.523 -1.969 -1.257 116 HD1 PHE 14 HD1 PHE 14 9.619 0.111 -0.610 117 HD2 PHE 14 HD2 PHE 14 10.956 -0.486 -4.599 118 HE1 PHE 14 HE1 PHE 14 8.516 2.197 -1.287 119 HE2 PHE 14 HE2 PHE 14 9.862 1.600 -5.281 120 HZ PHE 14 HZ PHE 14 8.748 3.023 -3.570 121 H GLU 15 HN GLU 15 12.491 -4.014 -1.842 122 HA GLU 15 HA GLU 15 14.964 -4.250 -3.339 123 HB2 GLU 15 HB2 GLU 15 15.169 -5.195 -1.215 124 HB3 GLU 15 HB1 GLU 15 13.530 -5.816 -1.230 125 HG2 GLU 15 HG2 GLU 15 14.919 -7.666 -1.420 126 HG3 GLU 15 HG1 GLU 15 14.252 -7.338 -3.015 127 H SER 16 HN SER 16 14.980 -5.203 -5.257 128 HA SER 16 HA SER 16 12.423 -6.209 -6.309 129 HB2 SER 16 HB2 SER 16 13.804 -4.254 -7.402 130 HB3 SER 16 HB1 SER 16 14.789 -5.567 -8.044 131 HG SER 16 HG SER 16 12.124 -4.885 -8.597 132 H HIS 17 HN HIS 17 14.078 -7.769 -4.623 133 HA HIS 17 HA HIS 17 14.709 -9.962 -6.479 134 HB2 HIS 17 HB2 HIS 17 16.732 -8.911 -5.362 135 HB3 HIS 17 HB1 HIS 17 16.092 -9.490 -3.832 136 HD1 HIS 17 HD1 HIS 17 17.371 -10.830 -7.138 137 HD2 HIS 17 HD2 HIS 17 16.739 -12.080 -3.225 138 HE1 HIS 17 HE1 HIS 17 18.391 -13.122 -6.987 139 HE2 HIS 17 HE2 HIS 17 18.035 -13.846 -4.598 140 H ILE 18 HN ILE 18 12.724 -8.801 -4.128 141 HA ILE 18 HA ILE 18 12.197 -11.087 -2.550 142 HB ILE 18 HB ILE 18 10.216 -8.964 -3.357 143 HG12 ILE 18 HG12 ILE 18 12.189 -7.887 -2.444 144 HG13 ILE 18 HG11 ILE 18 10.852 -7.805 -1.312 145 HG21 ILE 18 HG21 ILE 18 9.144 -9.481 -1.202 146 HG22 ILE 18 HG22 ILE 18 10.317 -10.773 -0.947 147 HG23 ILE 18 HG23 ILE 18 9.174 -10.872 -2.287 148 HD11 ILE 18 HD11 ILE 18 11.812 -9.493 0.065 149 HD12 ILE 18 HD12 ILE 18 13.030 -8.258 -0.253 150 HD13 ILE 18 HD13 ILE 18 13.084 -9.795 -1.122 151 H ALA 19 HN ALA 19 10.336 -12.448 -2.684 152 HA ALA 19 HA ALA 19 9.214 -12.887 -5.353 153 HB1 ALA 19 HB1 ALA 19 9.793 -15.216 -5.402 154 HB2 ALA 19 HB2 ALA 19 10.532 -15.111 -3.809 155 HB3 ALA 19 HB3 ALA 19 11.272 -14.282 -5.178 156 H ARG 20 HN ARG 20 7.244 -14.101 -5.336 157 HA ARG 20 HA ARG 20 5.615 -13.581 -3.150 158 HB2 ARG 20 HB2 ARG 20 4.654 -15.818 -4.657 159 HB3 ARG 20 HB1 ARG 20 4.049 -14.192 -4.561 160 HG2 ARG 20 HG2 ARG 20 5.608 -13.514 -6.328 161 HG3 ARG 20 HG1 ARG 20 6.116 -15.202 -6.465 162 HD2 ARG 20 HD2 ARG 20 3.843 -15.863 -7.016 163 HD3 ARG 20 HD1 ARG 20 3.298 -14.199 -6.824 164 HE ARG 20 HE ARG 20 5.344 -14.750 -8.840 165 HH11 ARG 20 HH11 ARG 20 2.011 -14.019 -8.065 166 HH12 ARG 20 HH12 ARG 20 1.619 -13.466 -9.667 167 HH21 ARG 20 HH21 ARG 20 4.830 -14.052 -10.964 168 HH22 ARG 20 HH22 ARG 20 3.223 -13.478 -11.314 169 H ALA 21 HN ALA 21 7.245 -16.502 -4.174 170 HA ALA 21 HA ALA 21 6.194 -18.107 -2.041 171 HB1 ALA 21 HB1 ALA 21 7.649 -19.858 -2.888 172 HB2 ALA 21 HB2 ALA 21 8.467 -18.690 -3.924 173 HB3 ALA 21 HB3 ALA 21 6.774 -19.086 -4.209 174 H ASN 22 HN ASN 22 8.535 -15.776 -2.122 175 HA ASN 22 HA ASN 22 10.060 -17.029 0.024 176 HB2 ASN 22 HB2 ASN 22 10.645 -14.859 -1.951 177 HB3 ASN 22 HB1 ASN 22 11.499 -14.877 -0.423 178 HD21 ASN 22 HD21 ASN 22 13.083 -16.315 -0.082 179 HD22 ASN 22 HD22 ASN 22 13.640 -17.439 -1.269 180 H VAL 23 HN VAL 23 7.566 -14.840 -0.500 181 HA VAL 23 HA VAL 23 8.312 -13.281 1.851 182 HB VAL 23 HB VAL 23 7.690 -11.971 -0.105 183 HG11 VAL 23 HG11 VAL 23 5.342 -11.874 -0.841 184 HG12 VAL 23 HG12 VAL 23 4.979 -13.248 0.206 185 HG13 VAL 23 HG13 VAL 23 6.077 -13.446 -1.162 186 HG21 VAL 23 HG21 VAL 23 7.325 -11.157 2.163 187 HG22 VAL 23 HG22 VAL 23 5.660 -11.733 2.075 188 HG23 VAL 23 HG23 VAL 23 6.209 -10.460 0.983 189 H LYS 24 HN LYS 24 7.113 -13.044 3.558 190 HA LYS 24 HA LYS 24 4.906 -14.890 4.036 191 HB2 LYS 24 HB2 LYS 24 6.543 -13.271 5.997 192 HB3 LYS 24 HB1 LYS 24 5.284 -14.419 6.408 193 HG2 LYS 24 HG2 LYS 24 6.746 -16.115 5.122 194 HG3 LYS 24 HG1 LYS 24 8.015 -14.918 5.363 195 HD2 LYS 24 HD2 LYS 24 7.829 -15.039 7.691 196 HD3 LYS 24 HD1 LYS 24 6.319 -15.938 7.624 197 HE2 LYS 24 HE2 LYS 24 7.750 -17.740 6.438 198 HE3 LYS 24 HE1 LYS 24 9.124 -16.852 7.107 199 HZ1 LYS 24 HZ1 LYS 24 8.188 -17.157 9.320 200 HZ2 LYS 24 HZ2 LYS 24 8.473 -18.640 8.569 201 HZ3 LYS 24 HZ3 LYS 24 6.897 -18.040 8.676 202 H HIS 25 HN HIS 25 3.960 -13.313 6.233 203 HA HIS 25 HA HIS 25 1.792 -12.029 5.373 204 HB2 HIS 25 HB2 HIS 25 3.248 -10.437 7.407 205 HB3 HIS 25 HB1 HIS 25 1.596 -11.029 7.430 206 HD1 HIS 25 HD1 HIS 25 3.534 -11.131 9.859 207 HD2 HIS 25 HD2 HIS 25 2.861 -14.315 7.274 208 HE1 HIS 25 HE1 HIS 25 4.099 -13.198 11.165 209 HE2 HIS 25 HE2 HIS 25 3.621 -15.117 9.608 210 H LEU 26 HN LEU 26 1.389 -10.438 3.960 211 HA LEU 26 HA LEU 26 3.501 -8.447 3.480 212 HB2 LEU 26 HB2 LEU 26 3.196 -9.911 1.580 213 HB3 LEU 26 HB1 LEU 26 1.471 -9.598 1.563 214 HG LEU 26 HG LEU 26 1.822 -7.332 0.821 215 HD11 LEU 26 HD11 LEU 26 4.048 -6.431 0.467 216 HD12 LEU 26 HD12 LEU 26 4.762 -7.914 1.090 217 HD13 LEU 26 HD13 LEU 26 3.825 -6.877 2.151 218 HD21 LEU 26 HD21 LEU 26 2.238 -9.453 -0.757 219 HD22 LEU 26 HD22 LEU 26 3.841 -8.701 -0.882 220 HD23 LEU 26 HD23 LEU 26 2.394 -7.795 -1.338 221 H LYS 27 HN LYS 27 3.033 -6.371 3.610 222 HA LYS 27 HA LYS 27 0.255 -5.534 4.113 223 HB2 LYS 27 HB2 LYS 27 1.245 -5.675 6.266 224 HB3 LYS 27 HB1 LYS 27 2.746 -4.979 5.690 225 HG2 LYS 27 HG2 LYS 27 1.579 -3.391 7.066 226 HG3 LYS 27 HG1 LYS 27 1.649 -2.828 5.393 227 HD2 LYS 27 HD2 LYS 27 -0.556 -2.430 6.399 228 HD3 LYS 27 HD1 LYS 27 -0.655 -3.553 5.046 229 HE2 LYS 27 HE2 LYS 27 -0.637 -5.429 6.670 230 HE3 LYS 27 HE1 LYS 27 -0.675 -4.249 7.977 231 HZ1 LYS 27 HZ1 LYS 27 -2.789 -3.445 7.136 232 HZ2 LYS 27 HZ2 LYS 27 -2.875 -5.095 7.484 233 HZ3 LYS 27 HZ3 LYS 27 -2.748 -4.576 5.880 234 H ILE 28 HN ILE 28 -0.294 -3.500 3.354 235 HA ILE 28 HA ILE 28 1.762 -2.120 1.755 236 HB ILE 28 HB ILE 28 -1.223 -2.062 1.286 237 HG12 ILE 28 HG12 ILE 28 -0.299 -4.318 0.910 238 HG13 ILE 28 HG11 ILE 28 -0.809 -3.572 -0.589 239 HG21 ILE 28 HG21 ILE 28 -0.587 -1.105 -0.897 240 HG22 ILE 28 HG22 ILE 28 1.100 -1.086 -0.375 241 HG23 ILE 28 HG23 ILE 28 -0.093 -0.088 0.459 242 HD11 ILE 28 HD11 ILE 28 2.014 -3.739 0.378 243 HD12 ILE 28 HD12 ILE 28 1.474 -3.059 -1.159 244 HD13 ILE 28 HD13 ILE 28 1.274 -4.785 -0.834 245 H LEU 29 HN LEU 29 2.203 -0.052 2.228 246 HA LEU 29 HA LEU 29 0.675 1.272 4.339 247 HB2 LEU 29 HB2 LEU 29 3.299 1.157 4.105 248 HB3 LEU 29 HB1 LEU 29 3.065 2.485 2.981 249 HG LEU 29 HG LEU 29 3.705 3.276 5.198 250 HD11 LEU 29 HD11 LEU 29 0.875 4.002 4.422 251 HD12 LEU 29 HD12 LEU 29 2.362 4.742 3.825 252 HD13 LEU 29 HD13 LEU 29 1.910 4.924 5.517 253 HD21 LEU 29 HD21 LEU 29 2.708 1.472 6.523 254 HD22 LEU 29 HD22 LEU 29 1.098 2.079 6.139 255 HD23 LEU 29 HD23 LEU 29 2.203 3.060 7.098 256 H ASN 30 HN ASN 30 -0.832 2.735 3.889 257 HA ASN 30 HA ASN 30 -1.236 3.728 1.223 258 HB2 ASN 30 HB2 ASN 30 -2.539 4.302 3.878 259 HB3 ASN 30 HB1 ASN 30 -2.985 5.148 2.410 260 HD21 ASN 30 HD21 ASN 30 -3.044 2.130 4.112 261 HD22 ASN 30 HD22 ASN 30 -4.199 1.341 3.096 262 H THR 31 HN THR 31 0.577 4.919 0.653 263 HA THR 31 HA THR 31 1.728 6.836 2.400 264 HB THR 31 HB THR 31 2.826 7.387 0.067 265 HG1 THR 31 HG1 THR 31 2.847 5.086 -0.926 266 HG21 THR 31 HG21 THR 31 3.294 4.943 1.748 267 HG22 THR 31 HG22 THR 31 4.015 6.540 1.966 268 HG23 THR 31 HG23 THR 31 4.434 5.566 0.556 269 HA PRO 32 HA PRO 32 0.295 10.955 1.398 270 HB2 PRO 32 HB2 PRO 32 3.045 11.260 0.278 271 HB3 PRO 32 HB1 PRO 32 2.149 12.312 1.377 272 HG2 PRO 32 HG2 PRO 32 4.030 10.707 2.309 273 HG3 PRO 32 HG1 PRO 32 2.519 10.941 3.205 274 HD2 PRO 32 HD2 PRO 32 3.421 8.621 1.588 275 HD3 PRO 32 HD1 PRO 32 2.418 8.666 3.046 276 H ASN 33 HN ASN 33 0.652 8.749 -0.990 277 HA ASN 33 HA ASN 33 0.531 8.651 -3.244 278 HB2 ASN 33 HB2 ASN 33 0.497 10.473 -4.774 279 HB3 ASN 33 HB1 ASN 33 -0.546 10.898 -3.434 280 HD21 ASN 33 HD21 ASN 33 -0.402 13.045 -4.209 281 HD22 ASN 33 HD22 ASN 33 0.966 14.033 -3.839 282 H CYS 34 HN CYS 34 2.594 8.086 -1.661 283 HA CYS 34 HA CYS 34 4.937 8.436 -3.363 284 HB2 CYS 34 HB2 CYS 34 4.407 7.108 -0.709 285 HB3 CYS 34 HB1 CYS 34 5.851 6.737 -1.598 286 H ALA 35 HN ALA 35 6.002 6.146 -3.859 287 HA ALA 35 HA ALA 35 4.269 4.534 -5.327 288 HB1 ALA 35 HB1 ALA 35 6.701 4.397 -5.549 289 HB2 ALA 35 HB2 ALA 35 5.999 2.810 -5.231 290 HB3 ALA 35 HB3 ALA 35 6.812 3.692 -3.937 291 H LEU 36 HN LEU 36 3.153 2.629 -4.848 292 HA LEU 36 HA LEU 36 1.950 2.391 -2.356 293 HB2 LEU 36 HB2 LEU 36 2.318 0.446 -4.641 294 HB3 LEU 36 HB1 LEU 36 1.371 0.072 -3.232 295 HG LEU 36 HG LEU 36 -0.194 0.707 -4.856 296 HD11 LEU 36 HD11 LEU 36 -1.187 2.751 -4.011 297 HD12 LEU 36 HD12 LEU 36 0.323 3.169 -3.202 298 HD13 LEU 36 HD13 LEU 36 -0.590 1.750 -2.686 299 HD21 LEU 36 HD21 LEU 36 1.526 3.110 -5.458 300 HD22 LEU 36 HD22 LEU 36 -0.029 2.739 -6.202 301 HD23 LEU 36 HD23 LEU 36 1.352 1.675 -6.470 302 H GLN 37 HN GLN 37 2.968 1.912 -0.543 303 HA GLN 37 HA GLN 37 5.559 0.684 -0.581 304 HB2 GLN 37 HB2 GLN 37 3.823 1.426 1.756 305 HB3 GLN 37 HB1 GLN 37 5.544 1.087 1.810 306 HG2 GLN 37 HG2 GLN 37 4.435 3.310 0.133 307 HG3 GLN 37 HG1 GLN 37 4.802 3.520 1.846 308 HE21 GLN 37 HE21 GLN 37 6.266 5.090 1.131 309 HE22 GLN 37 HE22 GLN 37 7.842 4.636 0.585 310 H ILE 38 HN ILE 38 5.824 -1.385 -0.660 311 HA ILE 38 HA ILE 38 3.728 -3.144 0.357 312 HB ILE 38 HB ILE 38 5.896 -3.890 -1.594 313 HG12 ILE 38 HG12 ILE 38 3.141 -3.039 -2.432 314 HG13 ILE 38 HG11 ILE 38 4.405 -1.836 -2.209 315 HG21 ILE 38 HG21 ILE 38 3.307 -5.056 -0.669 316 HG22 ILE 38 HG22 ILE 38 4.874 -5.850 -0.960 317 HG23 ILE 38 HG23 ILE 38 3.853 -5.374 -2.318 318 HD11 ILE 38 HD11 ILE 38 4.520 -4.178 -4.079 319 HD12 ILE 38 HD12 ILE 38 5.766 -2.945 -3.875 320 HD13 ILE 38 HD13 ILE 38 4.186 -2.504 -4.524 321 H VAL 39 HN VAL 39 4.327 -3.501 2.457 322 HA VAL 39 HA VAL 39 7.156 -4.022 2.979 323 HB VAL 39 HB VAL 39 5.902 -2.280 4.346 324 HG11 VAL 39 HG11 VAL 39 3.859 -3.482 4.771 325 HG12 VAL 39 HG12 VAL 39 4.661 -3.051 6.282 326 HG13 VAL 39 HG13 VAL 39 4.750 -4.705 5.678 327 HG21 VAL 39 HG21 VAL 39 8.089 -3.141 4.964 328 HG22 VAL 39 HG22 VAL 39 7.338 -4.512 5.782 329 HG23 VAL 39 HG23 VAL 39 7.101 -2.876 6.399 330 H ALA 40 HN ALA 40 7.882 -5.928 3.379 331 HA ALA 40 HA ALA 40 5.956 -8.116 3.762 332 HB1 ALA 40 HB1 ALA 40 8.361 -8.133 1.947 333 HB2 ALA 40 HB2 ALA 40 6.705 -7.860 1.409 334 HB3 ALA 40 HB3 ALA 40 7.154 -9.407 2.121 335 H ARG 41 HN ARG 41 6.716 -9.900 4.916 336 HA ARG 41 HA ARG 41 9.396 -9.608 6.094 337 HB2 ARG 41 HB2 ARG 41 6.847 -10.810 7.096 338 HB3 ARG 41 HB1 ARG 41 8.386 -11.431 7.688 339 HG2 ARG 41 HG2 ARG 41 8.089 -8.501 7.703 340 HG3 ARG 41 HG1 ARG 41 7.080 -9.388 8.831 341 HD2 ARG 41 HD2 ARG 41 9.030 -10.496 9.751 342 HD3 ARG 41 HD1 ARG 41 10.059 -9.681 8.579 343 HE ARG 41 HE ARG 41 8.630 -7.763 10.061 344 HH11 ARG 41 HH11 ARG 41 11.220 -10.085 10.447 345 HH12 ARG 41 HH12 ARG 41 11.994 -9.197 11.725 346 HH21 ARG 41 HH21 ARG 41 9.663 -6.582 11.729 347 HH22 ARG 41 HH22 ARG 41 11.107 -7.213 12.452 348 H LEU 42 HN LEU 42 10.891 -11.041 5.504 349 HA LEU 42 HA LEU 42 10.288 -12.806 3.369 350 HB2 LEU 42 HB2 LEU 42 12.753 -12.289 4.987 351 HB3 LEU 42 HB1 LEU 42 12.703 -13.615 3.841 352 HG LEU 42 HG LEU 42 12.177 -10.736 3.108 353 HD11 LEU 42 HD11 LEU 42 14.400 -10.659 2.222 354 HD12 LEU 42 HD12 LEU 42 14.670 -12.355 2.617 355 HD13 LEU 42 HD13 LEU 42 14.508 -11.168 3.907 356 HD21 LEU 42 HD21 LEU 42 12.653 -13.206 1.439 357 HD22 LEU 42 HD22 LEU 42 12.515 -11.563 0.815 358 HD23 LEU 42 HD23 LEU 42 11.133 -12.325 1.599 359 H LYS 43 HN LYS 43 10.590 -15.034 3.251 360 HA LYS 43 HA LYS 43 9.222 -16.409 5.319 361 HB2 LYS 43 HB2 LYS 43 9.061 -16.882 2.884 362 HB3 LYS 43 HB1 LYS 43 10.706 -17.477 2.926 363 HG2 LYS 43 HG2 LYS 43 9.963 -19.226 4.532 364 HG3 LYS 43 HG1 LYS 43 8.305 -18.679 4.259 365 HD2 LYS 43 HD2 LYS 43 8.697 -19.058 1.805 366 HD3 LYS 43 HD1 LYS 43 10.223 -19.822 2.237 367 HE2 LYS 43 HE2 LYS 43 8.516 -21.498 1.909 368 HE3 LYS 43 HE1 LYS 43 9.008 -21.441 3.592 369 HZ1 LYS 43 HZ1 LYS 43 6.608 -21.624 3.355 370 HZ2 LYS 43 HZ2 LYS 43 6.568 -20.173 2.489 371 HZ3 LYS 43 HZ3 LYS 43 7.037 -20.176 4.112 372 H ASN 44 HN ASN 44 12.500 -16.883 3.975 373 HA ASN 44 HA ASN 44 13.223 -18.604 6.170 374 HB2 ASN 44 HB2 ASN 44 14.753 -17.541 3.816 375 HB3 ASN 44 HB1 ASN 44 15.502 -18.528 5.056 376 HD21 ASN 44 HD21 ASN 44 16.012 -20.080 3.570 377 HD22 ASN 44 HD22 ASN 44 14.838 -21.172 2.920 378 H ASN 45 HN ASN 45 14.411 -15.544 4.882 379 HA ASN 45 HA ASN 45 16.184 -14.948 6.968 380 HB2 ASN 45 HB2 ASN 45 16.033 -13.912 4.643 381 HB3 ASN 45 HB1 ASN 45 14.760 -12.903 5.297 382 HD21 ASN 45 HD21 ASN 45 17.394 -12.238 4.208 383 HD22 ASN 45 HD22 ASN 45 18.198 -11.332 5.442 384 H ASN 46 HN ASN 46 12.775 -14.279 6.558 385 HA ASN 46 HA ASN 46 11.128 -13.668 7.987 386 HB2 ASN 46 HB2 ASN 46 12.222 -15.249 9.564 387 HB3 ASN 46 HB1 ASN 46 13.189 -13.920 10.183 388 HD21 ASN 46 HD21 ASN 46 9.973 -15.245 9.949 389 HD22 ASN 46 HD22 ASN 46 9.293 -14.344 11.257 390 H ARG 47 HN ARG 47 13.587 -11.797 7.137 391 HA ARG 47 HA ARG 47 13.287 -9.631 8.991 392 HB2 ARG 47 HB2 ARG 47 15.002 -8.562 7.833 393 HB3 ARG 47 HB1 ARG 47 15.382 -10.258 7.573 394 HG2 ARG 47 HG2 ARG 47 14.475 -10.198 5.376 395 HG3 ARG 47 HG1 ARG 47 13.862 -8.568 5.614 396 HD2 ARG 47 HD2 ARG 47 16.771 -9.345 5.674 397 HD3 ARG 47 HD1 ARG 47 15.936 -8.674 4.274 398 HE ARG 47 HE ARG 47 15.850 -7.122 6.738 399 HH11 ARG 47 HH11 ARG 47 17.296 -7.587 3.578 400 HH12 ARG 47 HH12 ARG 47 17.928 -5.972 3.498 401 HH21 ARG 47 HH21 ARG 47 16.702 -5.005 6.630 402 HH22 ARG 47 HH22 ARG 47 17.613 -4.516 5.236 403 H GLN 48 HN GLN 48 12.456 -7.626 8.529 404 HA GLN 48 HA GLN 48 10.223 -7.577 6.712 405 HB2 GLN 48 HB2 GLN 48 9.984 -6.528 8.895 406 HB3 GLN 48 HB1 GLN 48 11.339 -5.458 8.564 407 HG2 GLN 48 HG2 GLN 48 10.072 -4.409 6.778 408 HG3 GLN 48 HG1 GLN 48 8.726 -5.504 7.087 409 HE21 GLN 48 HE21 GLN 48 10.522 -2.770 8.252 410 HE22 GLN 48 HE22 GLN 48 9.378 -2.272 9.450 411 H VAL 49 HN VAL 49 10.210 -6.658 4.760 412 HA VAL 49 HA VAL 49 12.298 -4.810 3.907 413 HB VAL 49 HB VAL 49 13.194 -7.098 3.425 414 HG11 VAL 49 HG11 VAL 49 10.860 -7.354 1.540 415 HG12 VAL 49 HG12 VAL 49 11.050 -8.228 3.058 416 HG13 VAL 49 HG13 VAL 49 12.186 -8.500 1.739 417 HG21 VAL 49 HG21 VAL 49 12.507 -5.448 0.996 418 HG22 VAL 49 HG22 VAL 49 13.740 -6.709 1.048 419 HG23 VAL 49 HG23 VAL 49 13.920 -5.257 2.035 420 H CYS 50 HN CYS 50 11.652 -3.764 1.829 421 HA CYS 50 HA CYS 50 8.773 -4.017 1.396 422 HB2 CYS 50 HB2 CYS 50 10.718 -1.787 0.834 423 HB3 CYS 50 HB1 CYS 50 9.135 -1.842 0.081 424 H ILE 51 HN ILE 51 7.957 -4.586 -0.528 425 HA ILE 51 HA ILE 51 9.803 -5.814 -2.397 426 HB ILE 51 HB ILE 51 6.889 -5.747 -2.999 427 HG12 ILE 51 HG12 ILE 51 8.049 -7.413 -0.746 428 HG13 ILE 51 HG11 ILE 51 6.882 -6.108 -0.559 429 HG21 ILE 51 HG21 ILE 51 8.840 -6.980 -4.211 430 HG22 ILE 51 HG22 ILE 51 7.295 -7.797 -3.980 431 HG23 ILE 51 HG23 ILE 51 8.646 -8.155 -2.908 432 HD11 ILE 51 HD11 ILE 51 6.422 -8.712 -2.002 433 HD12 ILE 51 HD12 ILE 51 5.251 -7.404 -1.868 434 HD13 ILE 51 HD13 ILE 51 5.785 -8.261 -0.424 435 H ASP 52 HN ASP 52 10.268 -5.092 -4.370 436 HA ASP 52 HA ASP 52 9.836 -2.387 -5.058 437 HB2 ASP 52 HB2 ASP 52 11.818 -3.560 -5.777 438 HB3 ASP 52 HB1 ASP 52 10.861 -4.745 -6.641 439 HA PRO 53 HA PRO 53 5.739 -2.892 -6.808 440 HB2 PRO 53 HB2 PRO 53 5.531 -0.376 -7.817 441 HB3 PRO 53 HB1 PRO 53 5.263 -0.777 -6.121 442 HG2 PRO 53 HG2 PRO 53 7.694 0.358 -7.420 443 HG3 PRO 53 HG1 PRO 53 6.936 0.789 -5.885 444 HD2 PRO 53 HD2 PRO 53 9.118 -0.757 -6.016 445 HD3 PRO 53 HD1 PRO 53 7.874 -0.976 -4.781 446 H LYS 54 HN LYS 54 8.629 -2.169 -8.445 447 HA LYS 54 HA LYS 54 7.489 -2.172 -11.089 448 HB2 LYS 54 HB2 LYS 54 10.358 -2.258 -10.187 449 HB3 LYS 54 HB1 LYS 54 9.809 -2.049 -11.846 450 HG2 LYS 54 HG2 LYS 54 8.404 -0.118 -10.631 451 HG3 LYS 54 HG1 LYS 54 9.826 -0.159 -9.601 452 HD2 LYS 54 HD2 LYS 54 9.914 1.449 -11.502 453 HD3 LYS 54 HD1 LYS 54 11.276 0.339 -11.409 454 HE2 LYS 54 HE2 LYS 54 10.247 -1.013 -13.179 455 HE3 LYS 54 HE1 LYS 54 8.880 0.095 -13.220 456 HZ1 LYS 54 HZ1 LYS 54 10.347 1.846 -13.946 457 HZ2 LYS 54 HZ2 LYS 54 10.486 0.523 -14.988 458 HZ3 LYS 54 HZ3 LYS 54 11.689 0.822 -13.838 459 H LEU 55 HN LEU 55 8.358 -4.490 -8.827 460 HA LEU 55 HA LEU 55 9.273 -6.622 -10.378 461 HB2 LEU 55 HB2 LEU 55 7.821 -6.280 -7.801 462 HB3 LEU 55 HB1 LEU 55 7.955 -7.902 -8.457 463 HG LEU 55 HG LEU 55 10.335 -6.118 -7.988 464 HD11 LEU 55 HD11 LEU 55 9.077 -8.115 -6.124 465 HD12 LEU 55 HD12 LEU 55 9.277 -6.380 -5.867 466 HD13 LEU 55 HD13 LEU 55 10.691 -7.432 -5.921 467 HD21 LEU 55 HD21 LEU 55 10.628 -7.985 -9.539 468 HD22 LEU 55 HD22 LEU 55 10.085 -9.103 -8.290 469 HD23 LEU 55 HD23 LEU 55 11.582 -8.188 -8.073 470 H LYS 56 HN LYS 56 8.301 -7.927 -11.776 471 HA LYS 56 HA LYS 56 5.893 -7.159 -12.967 472 HB2 LYS 56 HB2 LYS 56 7.275 -9.833 -13.179 473 HB3 LYS 56 HB1 LYS 56 6.097 -9.183 -14.309 474 HG2 LYS 56 HG2 LYS 56 8.856 -8.107 -13.769 475 HG3 LYS 56 HG1 LYS 56 8.310 -8.947 -15.221 476 HD2 LYS 56 HD2 LYS 56 6.719 -7.118 -15.649 477 HD3 LYS 56 HD1 LYS 56 7.328 -6.272 -14.225 478 HE2 LYS 56 HE2 LYS 56 9.563 -6.206 -15.238 479 HE3 LYS 56 HE1 LYS 56 8.932 -7.013 -16.672 480 HZ1 LYS 56 HZ1 LYS 56 9.092 -4.612 -16.968 481 HZ2 LYS 56 HZ2 LYS 56 8.041 -4.364 -15.668 482 HZ3 LYS 56 HZ3 LYS 56 7.486 -5.132 -17.066 483 H TRP 57 HN TRP 57 6.554 -9.466 -10.416 484 HA TRP 57 HA TRP 57 3.854 -10.515 -10.550 485 HB2 TRP 57 HB2 TRP 57 4.475 -12.033 -8.862 486 HB3 TRP 57 HB1 TRP 57 5.898 -11.879 -9.863 487 HD1 TRP 57 HD1 TRP 57 8.064 -10.960 -8.739 488 HE1 TRP 57 HE1 TRP 57 8.739 -10.548 -6.282 489 HE3 TRP 57 HE3 TRP 57 3.438 -11.155 -6.598 490 HZ2 TRP 57 HZ2 TRP 57 7.461 -10.321 -3.777 491 HZ3 TRP 57 HZ3 TRP 57 3.242 -10.818 -4.172 492 HH2 TRP 57 HH2 TRP 57 5.214 -10.416 -2.788 493 H ILE 58 HN ILE 58 5.626 -8.078 -8.861 494 HA ILE 58 HA ILE 58 3.689 -7.641 -6.812 495 HB ILE 58 HB ILE 58 5.947 -6.025 -7.926 496 HG12 ILE 58 HG12 ILE 58 6.518 -7.737 -6.327 497 HG13 ILE 58 HG11 ILE 58 6.686 -6.166 -5.546 498 HG21 ILE 58 HG21 ILE 58 5.334 -4.402 -6.029 499 HG22 ILE 58 HG22 ILE 58 3.713 -5.079 -6.199 500 HG23 ILE 58 HG23 ILE 58 4.484 -4.285 -7.574 501 HD11 ILE 58 HD11 ILE 58 4.636 -8.275 -5.126 502 HD12 ILE 58 HD12 ILE 58 4.261 -6.595 -4.758 503 HD13 ILE 58 HD13 ILE 58 5.594 -7.396 -3.940 504 H GLN 59 HN GLN 59 4.206 -6.354 -10.049 505 HA GLN 59 HA GLN 59 2.193 -4.465 -10.217 506 HB2 GLN 59 HB2 GLN 59 3.243 -6.480 -12.150 507 HB3 GLN 59 HB1 GLN 59 2.004 -5.330 -12.635 508 HG2 GLN 59 HG2 GLN 59 4.714 -4.606 -11.551 509 HG3 GLN 59 HG1 GLN 59 4.293 -4.648 -13.263 510 HE21 GLN 59 HE21 GLN 59 3.994 -2.929 -10.281 511 HE22 GLN 59 HE22 GLN 59 3.225 -1.521 -10.928 512 H GLU 60 HN GLU 60 2.011 -7.912 -10.145 513 HA GLU 60 HA GLU 60 -0.733 -8.151 -10.865 514 HB2 GLU 60 HB2 GLU 60 0.961 -10.049 -9.236 515 HB3 GLU 60 HB1 GLU 60 -0.590 -10.425 -9.965 516 HG2 GLU 60 HG2 GLU 60 0.409 -10.047 -12.185 517 HG3 GLU 60 HG1 GLU 60 1.959 -9.782 -11.405 518 H TYR 61 HN TYR 61 1.017 -7.894 -7.818 519 HA TYR 61 HA TYR 61 -1.307 -8.366 -6.205 520 HB2 TYR 61 HB2 TYR 61 0.908 -8.936 -5.346 521 HB3 TYR 61 HB1 TYR 61 1.435 -7.273 -5.524 522 HD1 TYR 61 HD1 TYR 61 -0.222 -9.636 -3.406 523 HD2 TYR 61 HD2 TYR 61 0.426 -5.505 -4.107 524 HE1 TYR 61 HE1 TYR 61 -0.952 -9.135 -1.131 525 HE2 TYR 61 HE2 TYR 61 -0.329 -4.994 -1.827 526 HH TYR 61 HH TYR 61 -0.751 -7.429 0.547 527 H LEU 62 HN LEU 62 0.468 -5.714 -7.504 528 HA LEU 62 HA LEU 62 -0.560 -3.557 -6.139 529 HB2 LEU 62 HB2 LEU 62 0.917 -4.063 -8.503 530 HB3 LEU 62 HB1 LEU 62 -0.325 -2.873 -8.882 531 HG LEU 62 HG LEU 62 0.510 -1.561 -6.871 532 HD11 LEU 62 HD11 LEU 62 2.649 -3.642 -7.105 533 HD12 LEU 62 HD12 LEU 62 1.736 -3.155 -5.672 534 HD13 LEU 62 HD13 LEU 62 2.941 -2.063 -6.366 535 HD21 LEU 62 HD21 LEU 62 2.375 -1.972 -9.203 536 HD22 LEU 62 HD22 LEU 62 2.371 -0.581 -8.118 537 HD23 LEU 62 HD23 LEU 62 0.984 -0.890 -9.162 538 H GLU 63 HN GLU 63 -1.832 -5.258 -8.976 539 HA GLU 63 HA GLU 63 -3.919 -3.582 -9.604 540 HB2 GLU 63 HB2 GLU 63 -3.658 -6.554 -9.788 541 HB3 GLU 63 HB1 GLU 63 -5.053 -5.694 -10.410 542 HG2 GLU 63 HG2 GLU 63 -3.365 -4.245 -11.633 543 HG3 GLU 63 HG1 GLU 63 -2.217 -5.519 -11.279 544 H LYS 64 HN LYS 64 -3.776 -6.057 -7.148 545 HA LYS 64 HA LYS 64 -6.481 -5.813 -6.289 546 HB2 LYS 64 HB2 LYS 64 -4.032 -6.897 -4.919 547 HB3 LYS 64 HB1 LYS 64 -5.647 -6.975 -4.223 548 HG2 LYS 64 HG2 LYS 64 -5.516 -9.041 -5.181 549 HG3 LYS 64 HG1 LYS 64 -6.228 -8.117 -6.501 550 HD2 LYS 64 HD2 LYS 64 -4.036 -7.853 -7.523 551 HD3 LYS 64 HD1 LYS 64 -3.303 -8.761 -6.199 552 HE2 LYS 64 HE2 LYS 64 -5.367 -9.809 -8.132 553 HE3 LYS 64 HE1 LYS 64 -3.641 -10.162 -8.179 554 HZ1 LYS 64 HZ1 LYS 64 -4.887 -11.941 -7.124 555 HZ2 LYS 64 HZ2 LYS 64 -5.486 -10.869 -5.964 556 HZ3 LYS 64 HZ3 LYS 64 -3.832 -11.215 -6.019 557 H ALA 65 HN ALA 65 -3.402 -4.490 -5.223 558 HA ALA 65 HA ALA 65 -4.298 -3.025 -3.018 559 HB1 ALA 65 HB1 ALA 65 -2.029 -2.446 -4.913 560 HB2 ALA 65 HB2 ALA 65 -1.946 -3.443 -3.461 561 HB3 ALA 65 HB3 ALA 65 -2.241 -1.707 -3.323 562 H LEU 66 HN LEU 66 -4.360 -2.382 -6.422 563 HA LEU 66 HA LEU 66 -5.111 0.392 -6.153 564 HB2 LEU 66 HB2 LEU 66 -4.744 -1.500 -8.412 565 HB3 LEU 66 HB1 LEU 66 -5.799 -0.126 -8.681 566 HG LEU 66 HG LEU 66 -3.980 1.391 -8.099 567 HD11 LEU 66 HD11 LEU 66 -1.724 0.574 -7.776 568 HD12 LEU 66 HD12 LEU 66 -2.291 -1.093 -7.934 569 HD13 LEU 66 HD13 LEU 66 -2.804 -0.115 -6.559 570 HD21 LEU 66 HD21 LEU 66 -4.302 0.785 -10.427 571 HD22 LEU 66 HD22 LEU 66 -3.268 -0.628 -10.217 572 HD23 LEU 66 HD23 LEU 66 -2.585 0.992 -10.077 573 H ASN 67 HN ASN 67 -6.669 -2.617 -6.207 574 HA ASN 67 HA ASN 67 -9.312 -1.513 -6.590 575 HB2 ASN 67 HB2 ASN 67 -8.201 -4.236 -6.334 576 HB3 ASN 67 HB1 ASN 67 -9.876 -4.002 -5.917 577 HD21 ASN 67 HD21 ASN 67 -7.511 -3.852 -8.464 578 HD22 ASN 67 HD22 ASN 67 -8.652 -3.847 -9.770 579 H LYS 68 HN LYS 68 -7.153 -1.802 -4.107 580 HA LYS 68 HA LYS 68 -9.183 -2.026 -2.013 581 HB2 LYS 68 HB2 LYS 68 -6.170 -2.014 -1.957 582 HB3 LYS 68 HB1 LYS 68 -7.143 -1.910 -0.497 583 HG2 LYS 68 HG2 LYS 68 -8.116 -4.078 -0.952 584 HG3 LYS 68 HG1 LYS 68 -7.262 -4.166 -2.493 585 HD2 LYS 68 HD2 LYS 68 -5.120 -4.124 -1.294 586 HD3 LYS 68 HD1 LYS 68 -5.986 -4.055 0.240 587 HE2 LYS 68 HE2 LYS 68 -6.247 -6.286 -1.768 588 HE3 LYS 68 HE1 LYS 68 -5.169 -6.321 -0.376 589 HZ1 LYS 68 HZ1 LYS 68 -7.201 -7.466 0.136 590 HZ2 LYS 68 HZ2 LYS 68 -8.131 -6.125 -0.304 591 HZ3 LYS 68 HZ3 LYS 68 -7.128 -6.048 1.058 592 H GLY 69 HN GLY 69 -6.540 0.124 -3.018 593 HA2 GLY 69 HA2 GLY 69 -7.141 2.141 -1.131 594 HA3 GLY 69 HA1 GLY 69 -6.133 2.336 -2.559 595 H ARG 70 HN ARG 70 -9.088 3.071 -1.106 596 HA ARG 70 HA ARG 70 -10.463 3.710 -3.586 597 HB2 ARG 70 HB2 ARG 70 -11.327 4.214 -0.732 598 HB3 ARG 70 HB1 ARG 70 -12.340 4.317 -2.164 599 HG2 ARG 70 HG2 ARG 70 -11.034 1.807 -1.136 600 HG3 ARG 70 HG1 ARG 70 -12.717 2.264 -0.876 601 HD2 ARG 70 HD2 ARG 70 -13.132 2.194 -3.265 602 HD3 ARG 70 HD1 ARG 70 -11.435 1.824 -3.568 603 HE ARG 70 HE ARG 70 -12.146 -0.184 -1.951 604 HH11 ARG 70 HH11 ARG 70 -13.689 1.139 -4.794 605 HH12 ARG 70 HH12 ARG 70 -14.399 -0.373 -5.262 606 HH21 ARG 70 HH21 ARG 70 -13.051 -2.179 -2.581 607 HH22 ARG 70 HH22 ARG 70 -14.022 -2.263 -4.016 608 H ARG 71 HN ARG 71 -11.116 5.797 -4.155 609 HA ARG 71 HA ARG 71 -10.997 8.044 -4.417 610 HB2 ARG 71 HB2 ARG 71 -10.153 7.967 -1.517 611 HB3 ARG 71 HB1 ARG 71 -10.465 9.447 -2.408 612 HG2 ARG 71 HG2 ARG 71 -12.772 8.776 -2.755 613 HG3 ARG 71 HG1 ARG 71 -12.466 7.256 -1.913 614 HD2 ARG 71 HD2 ARG 71 -13.545 8.816 -0.414 615 HD3 ARG 71 HD1 ARG 71 -11.893 8.521 0.119 616 HE ARG 71 HE ARG 71 -11.799 10.777 -1.474 617 HH11 ARG 71 HH11 ARG 71 -13.354 9.797 1.499 618 HH12 ARG 71 HH12 ARG 71 -13.402 11.398 2.159 619 HH21 ARG 71 HH21 ARG 71 -11.849 12.900 -0.606 620 HH22 ARG 71 HH22 ARG 71 -12.546 13.167 0.960 621 H GLU 72 HN GLU 72 -9.404 9.990 -3.988 622 HA GLU 72 HA GLU 72 -7.424 10.978 -4.418 623 HB2 GLU 72 HB2 GLU 72 -6.382 8.585 -2.903 624 HB3 GLU 72 HB1 GLU 72 -5.445 10.027 -3.269 625 HG2 GLU 72 HG2 GLU 72 -7.935 9.905 -1.582 626 HG3 GLU 72 HG1 GLU 72 -6.282 10.103 -1.000 627 H GLU 73 HN GLU 73 -8.130 10.131 -6.676 628 HA GLU 73 HA GLU 73 -6.043 8.426 -7.822 629 HB2 GLU 73 HB2 GLU 73 -8.515 8.149 -8.387 630 HB3 GLU 73 HB1 GLU 73 -8.395 9.671 -9.255 631 HG2 GLU 73 HG2 GLU 73 -6.757 8.725 -10.759 632 HG3 GLU 73 HG1 GLU 73 -6.768 7.212 -9.855 633 H LYS 74 HN LYS 74 -6.027 11.345 -6.812 634 HA LYS 74 HA LYS 74 -5.340 12.949 -9.073 635 HB2 LYS 74 HB2 LYS 74 -6.233 13.955 -7.035 636 HB3 LYS 74 HB1 LYS 74 -4.866 13.354 -6.112 637 HG2 LYS 74 HG2 LYS 74 -3.372 14.770 -7.494 638 HG3 LYS 74 HG1 LYS 74 -4.801 15.435 -8.287 639 HD2 LYS 74 HD2 LYS 74 -5.605 16.310 -6.176 640 HD3 LYS 74 HD1 LYS 74 -4.256 15.562 -5.322 641 HE2 LYS 74 HE2 LYS 74 -4.017 17.693 -7.443 642 HE3 LYS 74 HE1 LYS 74 -3.905 17.968 -5.707 643 HZ1 LYS 74 HZ1 LYS 74 -1.721 17.817 -6.703 644 HZ2 LYS 74 HZ2 LYS 74 -2.063 16.279 -7.320 645 HZ3 LYS 74 HZ3 LYS 74 -1.964 16.519 -5.648 646 H VAL 75 HN VAL 75 -3.319 13.605 -9.759 647 HA VAL 75 HA VAL 75 -1.101 11.888 -8.968 648 HB VAL 75 HB VAL 75 0.103 12.874 -10.886 649 HG11 VAL 75 HG11 VAL 75 -2.645 11.816 -11.531 650 HG12 VAL 75 HG12 VAL 75 -1.199 10.858 -11.217 651 HG13 VAL 75 HG13 VAL 75 -1.287 11.879 -12.652 652 HG21 VAL 75 HG21 VAL 75 -1.095 14.311 -12.474 653 HG22 VAL 75 HG22 VAL 75 -0.913 15.087 -10.900 654 HG23 VAL 75 HG23 VAL 75 -2.463 14.388 -11.363 655 H GLY 76 HN GLY 76 0.834 12.641 -8.181 656 HA2 GLY 76 HA2 GLY 76 0.961 15.491 -7.432 657 HA3 GLY 76 HA1 GLY 76 1.374 14.225 -6.280 658 H LYS 77 HN LYS 77 2.846 12.489 -7.680 659 HA LYS 77 HA LYS 77 5.070 14.088 -8.773 660 HB2 LYS 77 HB2 LYS 77 5.147 11.510 -7.199 661 HB3 LYS 77 HB1 LYS 77 6.535 12.167 -8.051 662 HG2 LYS 77 HG2 LYS 77 6.381 14.200 -6.661 663 HG3 LYS 77 HG1 LYS 77 5.059 13.450 -5.765 664 HD2 LYS 77 HD2 LYS 77 6.529 11.645 -5.070 665 HD3 LYS 77 HD1 LYS 77 7.847 12.329 -6.019 666 HE2 LYS 77 HE2 LYS 77 7.815 14.334 -4.634 667 HE3 LYS 77 HE1 LYS 77 6.479 13.674 -3.695 668 HZ1 LYS 77 HZ1 LYS 77 7.870 11.950 -2.875 669 HZ2 LYS 77 HZ2 LYS 77 8.695 13.408 -2.653 670 HZ3 LYS 77 HZ3 LYS 77 9.135 12.374 -3.913 671 H LYS 78 HN LYS 78 3.817 10.755 -8.814 672 HA LYS 78 HA LYS 78 4.854 10.383 -11.491 673 HB2 LYS 78 HB2 LYS 78 3.310 8.502 -9.700 674 HB3 LYS 78 HB1 LYS 78 4.016 8.071 -11.251 675 HG2 LYS 78 HG2 LYS 78 5.523 8.967 -8.805 676 HG3 LYS 78 HG1 LYS 78 5.409 7.317 -9.417 677 HD2 LYS 78 HD2 LYS 78 6.501 8.054 -11.507 678 HD3 LYS 78 HD1 LYS 78 6.675 9.669 -10.819 679 HE2 LYS 78 HE2 LYS 78 8.740 8.385 -10.600 680 HE3 LYS 78 HE1 LYS 78 8.053 8.767 -9.023 681 HZ1 LYS 78 HZ1 LYS 78 8.854 6.457 -9.229 682 HZ2 LYS 78 HZ2 LYS 78 7.684 6.172 -10.414 683 HZ3 LYS 78 HZ3 LYS 78 7.214 6.553 -8.835 684 H GLU 79 HN GLU 79 3.740 10.657 -13.284 685 HA GLU 79 HA GLU 79 0.870 11.190 -13.087 686 HB2 GLU 79 HB2 GLU 79 2.724 11.557 -15.448 687 HB3 GLU 79 HB1 GLU 79 1.070 12.138 -15.317 688 HG2 GLU 79 HG2 GLU 79 1.741 13.625 -13.495 689 HG3 GLU 79 HG1 GLU 79 3.401 13.049 -13.645 690 H LYS 80 HN LYS 80 2.237 8.510 -13.007 691 HA LYS 80 HA LYS 80 1.468 7.210 -15.458 692 HB2 LYS 80 HB2 LYS 80 3.430 6.515 -14.023 693 HB3 LYS 80 HB1 LYS 80 2.268 5.904 -12.854 694 HG2 LYS 80 HG2 LYS 80 1.385 4.361 -14.529 695 HG3 LYS 80 HG1 LYS 80 2.546 4.976 -15.706 696 HD2 LYS 80 HD2 LYS 80 4.378 4.254 -14.176 697 HD3 LYS 80 HD1 LYS 80 3.156 3.509 -13.143 698 HE2 LYS 80 HE2 LYS 80 2.452 2.089 -15.008 699 HE3 LYS 80 HE1 LYS 80 3.675 2.832 -16.036 700 HZ1 LYS 80 HZ1 LYS 80 5.377 1.979 -14.531 701 HZ2 LYS 80 HZ2 LYS 80 4.449 0.731 -15.191 702 HZ3 LYS 80 HZ3 LYS 80 4.188 1.226 -13.595 703 H ILE 81 HN ILE 81 -0.753 8.043 -15.256 704 HA ILE 81 HA ILE 81 -2.401 6.199 -13.665 705 HB ILE 81 HB ILE 81 -4.167 8.064 -13.789 706 HG12 ILE 81 HG12 ILE 81 -3.057 10.375 -13.694 707 HG13 ILE 81 HG11 ILE 81 -1.666 9.619 -14.458 708 HG21 ILE 81 HG21 ILE 81 -3.132 7.355 -11.724 709 HG22 ILE 81 HG22 ILE 81 -3.313 9.110 -11.737 710 HG23 ILE 81 HG23 ILE 81 -1.734 8.384 -12.043 711 HD11 ILE 81 HD11 ILE 81 -3.052 10.754 -16.086 712 HD12 ILE 81 HD12 ILE 81 -4.444 9.785 -15.604 713 HD13 ILE 81 HD13 ILE 81 -3.059 9.013 -16.376 714 H GLY 82 HN GLY 82 -4.797 6.362 -14.666 715 HA2 GLY 82 HA2 GLY 82 -5.112 6.791 -17.407 716 HA3 GLY 82 HA1 GLY 82 -4.629 5.114 -17.185 717 H LYS 83 HN LYS 83 -6.832 4.906 -18.217 718 HA LYS 83 HA LYS 83 -9.043 5.340 -16.393 719 HB2 LYS 83 HB2 LYS 83 -8.846 4.409 -19.244 720 HB3 LYS 83 HB1 LYS 83 -10.337 4.210 -18.335 721 HG2 LYS 83 HG2 LYS 83 -10.478 6.217 -19.631 722 HG3 LYS 83 HG1 LYS 83 -10.364 6.653 -17.927 723 HD2 LYS 83 HD2 LYS 83 -7.908 7.005 -18.270 724 HD3 LYS 83 HD1 LYS 83 -8.175 6.766 -19.998 725 HE2 LYS 83 HE2 LYS 83 -9.733 8.659 -20.006 726 HE3 LYS 83 HE1 LYS 83 -9.446 8.898 -18.285 727 HZ1 LYS 83 HZ1 LYS 83 -8.131 10.404 -19.656 728 HZ2 LYS 83 HZ2 LYS 83 -7.373 9.088 -20.400 729 HZ3 LYS 83 HZ3 LYS 83 -7.141 9.374 -18.750 730 H LYS 84 HN LYS 84 -10.678 3.400 -16.401 731 HA LYS 84 HA LYS 84 -9.195 1.272 -15.075 732 HB2 LYS 84 HB2 LYS 84 -11.118 2.557 -14.019 733 HB3 LYS 84 HB1 LYS 84 -12.184 1.713 -15.128 734 HG2 LYS 84 HG2 LYS 84 -11.669 -0.394 -14.138 735 HG3 LYS 84 HG1 LYS 84 -10.378 0.319 -13.168 736 HD2 LYS 84 HD2 LYS 84 -13.300 1.041 -12.938 737 HD3 LYS 84 HD1 LYS 84 -12.462 -0.097 -11.882 738 HE2 LYS 84 HE2 LYS 84 -10.896 1.719 -11.245 739 HE3 LYS 84 HE1 LYS 84 -11.849 2.839 -12.218 740 HZ1 LYS 84 HZ1 LYS 84 -12.856 1.312 -9.886 741 HZ2 LYS 84 HZ2 LYS 84 -13.745 2.417 -10.801 742 HZ3 LYS 84 HZ3 LYS 84 -12.436 2.945 -9.876 743 H LYS 85 HN LYS 85 -9.061 1.303 -17.889 744 HA LYS 85 HA LYS 85 -9.260 -0.007 -19.727 745 HB2 LYS 85 HB2 LYS 85 -9.845 -2.033 -17.574 746 HB3 LYS 85 HB1 LYS 85 -9.824 -2.474 -19.272 747 HG2 LYS 85 HG2 LYS 85 -7.714 -3.039 -18.345 748 HG3 LYS 85 HG1 LYS 85 -7.478 -1.635 -19.385 749 HD2 LYS 85 HD2 LYS 85 -7.416 -0.173 -17.463 750 HD3 LYS 85 HD1 LYS 85 -7.799 -1.519 -16.390 751 HE2 LYS 85 HE2 LYS 85 -5.695 -2.615 -17.053 752 HE3 LYS 85 HE1 LYS 85 -5.310 -1.223 -18.063 753 HZ1 LYS 85 HZ1 LYS 85 -5.734 -1.107 -15.129 754 HZ2 LYS 85 HZ2 LYS 85 -5.239 0.167 -16.128 755 HZ3 LYS 85 HZ3 LYS 85 -4.221 -1.159 -15.882 756 H ARG 86 HN ARG 86 -11.398 1.611 -19.302 757 HA ARG 86 HA ARG 86 -13.553 1.997 -19.888 758 HB2 ARG 86 HB2 ARG 86 -12.802 0.778 -21.949 759 HB3 ARG 86 HB1 ARG 86 -13.417 -0.706 -21.242 760 HG2 ARG 86 HG2 ARG 86 -14.949 0.272 -22.888 761 HG3 ARG 86 HG1 ARG 86 -15.668 0.157 -21.281 762 HD2 ARG 86 HD2 ARG 86 -15.354 2.491 -20.896 763 HD3 ARG 86 HD1 ARG 86 -14.382 2.658 -22.356 764 HE ARG 86 HE ARG 86 -16.695 1.773 -23.355 765 HH11 ARG 86 HH11 ARG 86 -16.064 4.288 -21.001 766 HH12 ARG 86 HH12 ARG 86 -17.403 5.266 -21.504 767 HH21 ARG 86 HH21 ARG 86 -18.452 3.057 -24.019 768 HH22 ARG 86 HH22 ARG 86 -18.769 4.559 -23.213 769 H GLN 87 HN GLN 87 -13.055 0.999 -17.391 770 HA GLN 87 HA GLN 87 -14.059 0.179 -15.540 771 HB2 GLN 87 HB2 GLN 87 -16.510 0.292 -17.302 772 HB3 GLN 87 HB1 GLN 87 -16.537 0.038 -15.562 773 HG2 GLN 87 HG2 GLN 87 -15.407 2.470 -16.921 774 HG3 GLN 87 HG1 GLN 87 -17.025 2.361 -16.235 775 HE21 GLN 87 HE21 GLN 87 -16.121 0.736 -13.977 776 HE22 GLN 87 HE22 GLN 87 -15.309 1.826 -12.912 777 H LYS 88 HN LYS 88 -12.762 -1.703 -17.113 778 HA LYS 88 HA LYS 88 -14.450 -4.085 -16.735 779 HB2 LYS 88 HB2 LYS 88 -12.148 -3.631 -18.635 780 HB3 LYS 88 HB1 LYS 88 -12.862 -5.209 -18.334 781 HG2 LYS 88 HG2 LYS 88 -15.002 -4.416 -19.180 782 HG3 LYS 88 HG1 LYS 88 -14.308 -2.816 -19.457 783 HD2 LYS 88 HD2 LYS 88 -12.742 -3.751 -21.066 784 HD3 LYS 88 HD1 LYS 88 -13.360 -5.374 -20.752 785 HE2 LYS 88 HE2 LYS 88 -14.968 -3.083 -21.876 786 HE3 LYS 88 HE1 LYS 88 -14.265 -4.393 -22.824 787 HZ1 LYS 88 HZ1 LYS 88 -16.284 -4.736 -20.676 788 HZ2 LYS 88 HZ2 LYS 88 -15.641 -5.964 -21.641 789 HZ3 LYS 88 HZ3 LYS 88 -16.613 -4.767 -22.333 790 H LYS 89 HN LYS 89 -13.970 -4.564 -14.636 791 HA LYS 89 HA LYS 89 -11.286 -4.656 -13.643 792 HB2 LYS 89 HB2 LYS 89 -13.885 -5.760 -12.571 793 HB3 LYS 89 HB1 LYS 89 -12.353 -5.908 -11.727 794 HG2 LYS 89 HG2 LYS 89 -12.189 -3.484 -11.568 795 HG3 LYS 89 HG1 LYS 89 -13.714 -3.321 -12.447 796 HD2 LYS 89 HD2 LYS 89 -14.911 -4.439 -10.685 797 HD3 LYS 89 HD1 LYS 89 -13.407 -4.811 -9.842 798 HE2 LYS 89 HE2 LYS 89 -14.470 -2.037 -10.357 799 HE3 LYS 89 HE1 LYS 89 -14.629 -2.918 -8.839 800 HZ1 LYS 89 HZ1 LYS 89 -12.783 -1.457 -8.659 801 HZ2 LYS 89 HZ2 LYS 89 -12.122 -1.988 -10.116 802 HZ3 LYS 89 HZ3 LYS 89 -12.156 -3.022 -8.782 803 H ARG 90 HN ARG 90 -10.099 -5.995 -15.004 804 HA ARG 90 HA ARG 90 -11.003 -8.647 -15.615 805 HB2 ARG 90 HB2 ARG 90 -8.305 -7.344 -15.997 806 HB3 ARG 90 HB1 ARG 90 -8.742 -8.937 -16.603 807 HG2 ARG 90 HG2 ARG 90 -10.596 -7.826 -17.878 808 HG3 ARG 90 HG1 ARG 90 -9.883 -6.280 -17.420 809 HD2 ARG 90 HD2 ARG 90 -9.140 -6.968 -19.639 810 HD3 ARG 90 HD1 ARG 90 -7.793 -6.921 -18.503 811 HE ARG 90 HE ARG 90 -9.100 -9.495 -18.916 812 HH11 ARG 90 HH11 ARG 90 -6.396 -7.391 -19.623 813 HH12 ARG 90 HH12 ARG 90 -5.368 -8.681 -20.162 814 HH21 ARG 90 HH21 ARG 90 -7.755 -11.198 -19.614 815 HH22 ARG 90 HH22 ARG 90 -6.142 -10.854 -20.154 816 H LYS 91 HN LYS 91 -10.381 -10.556 -14.735 817 HA LYS 91 HA LYS 91 -9.874 -11.997 -13.062 818 HB2 LYS 91 HB2 LYS 91 -7.502 -10.148 -12.750 819 HB3 LYS 91 HB1 LYS 91 -7.660 -11.695 -11.937 820 HG2 LYS 91 HG2 LYS 91 -7.589 -11.301 -14.923 821 HG3 LYS 91 HG1 LYS 91 -6.227 -11.810 -13.926 822 HD2 LYS 91 HD2 LYS 91 -8.833 -13.309 -14.192 823 HD3 LYS 91 HD1 LYS 91 -7.351 -13.696 -15.065 824 HE2 LYS 91 HE2 LYS 91 -7.633 -13.674 -12.061 825 HE3 LYS 91 HE1 LYS 91 -7.712 -15.117 -13.069 826 HZ1 LYS 91 HZ1 LYS 91 -5.457 -14.772 -13.753 827 HZ2 LYS 91 HZ2 LYS 91 -5.514 -14.751 -12.063 828 HZ3 LYS 91 HZ3 LYS 91 -5.366 -13.302 -12.920 829 H ALA 92 HN ALA 92 -11.776 -10.157 -12.438 830 HA ALA 92 HA ALA 92 -11.166 -8.857 -9.940 831 HB1 ALA 92 HB1 ALA 92 -13.429 -8.041 -10.008 832 HB2 ALA 92 HB2 ALA 92 -13.839 -9.179 -11.291 833 HB3 ALA 92 HB3 ALA 92 -12.706 -7.867 -11.608 834 H ALA 93 HN ALA 93 -10.705 -10.410 -8.434 835 HA ALA 93 HA ALA 93 -12.567 -12.553 -7.880 836 HB1 ALA 93 HB1 ALA 93 -11.040 -13.100 -6.044 837 HB2 ALA 93 HB2 ALA 93 -10.133 -11.621 -6.354 838 HB3 ALA 93 HB3 ALA 93 -10.170 -12.904 -7.564 839 H GLN 94 HN GLN 94 -13.867 -10.174 -7.818 840 HA GLN 94 HA GLN 94 -14.382 -9.683 -4.963 841 HB2 GLN 94 HB2 GLN 94 -14.215 -7.629 -7.179 842 HB3 GLN 94 HB1 GLN 94 -14.763 -7.293 -5.544 843 HG2 GLN 94 HG2 GLN 94 -12.628 -7.631 -4.640 844 HG3 GLN 94 HG1 GLN 94 -12.045 -8.429 -6.100 845 HE21 GLN 94 HE21 GLN 94 -12.847 -5.378 -4.622 846 HE22 GLN 94 HE22 GLN 94 -12.057 -4.381 -5.793 847 H LYS 95 HN LYS 95 -15.729 -11.381 -6.996 848 HA LYS 95 HA LYS 95 -18.065 -10.095 -7.943 849 HB2 LYS 95 HB2 LYS 95 -17.297 -12.177 -8.938 850 HB3 LYS 95 HB1 LYS 95 -17.523 -13.023 -7.415 851 HG2 LYS 95 HG2 LYS 95 -19.338 -13.569 -8.877 852 HG3 LYS 95 HG1 LYS 95 -19.952 -12.562 -7.565 853 HD2 LYS 95 HD2 LYS 95 -20.955 -11.743 -9.541 854 HD3 LYS 95 HD1 LYS 95 -19.686 -10.590 -9.130 855 HE2 LYS 95 HE2 LYS 95 -19.640 -11.022 -11.505 856 HE3 LYS 95 HE1 LYS 95 -18.196 -11.703 -10.760 857 HZ1 LYS 95 HZ1 LYS 95 -20.634 -13.252 -11.440 858 HZ2 LYS 95 HZ2 LYS 95 -19.182 -13.878 -10.844 859 HZ3 LYS 95 HZ3 LYS 95 -19.237 -13.194 -12.388 860 H ARG 96 HN ARG 96 -17.409 -12.045 -5.068 861 HA ARG 96 HA ARG 96 -20.115 -11.636 -4.088 862 HB2 ARG 96 HB2 ARG 96 -18.968 -13.828 -3.844 863 HB3 ARG 96 HB1 ARG 96 -17.779 -13.063 -2.804 864 HG2 ARG 96 HG2 ARG 96 -19.540 -12.528 -1.194 865 HG3 ARG 96 HG1 ARG 96 -20.725 -13.317 -2.239 866 HD2 ARG 96 HD2 ARG 96 -19.509 -15.422 -2.029 867 HD3 ARG 96 HD1 ARG 96 -18.314 -14.635 -1.001 868 HE ARG 96 HE ARG 96 -20.876 -14.279 0.105 869 HH11 ARG 96 HH11 ARG 96 -18.490 -16.776 -0.451 870 HH12 ARG 96 HH12 ARG 96 -18.976 -17.718 0.924 871 HH21 ARG 96 HH21 ARG 96 -21.515 -15.512 1.919 872 HH22 ARG 96 HH22 ARG 96 -20.686 -16.996 2.274 873 H LYS 97 HN LYS 97 -17.001 -10.282 -3.810 874 HA LYS 97 HA LYS 97 -16.191 -8.440 -2.765 875 HB2 LYS 97 HB2 LYS 97 -19.087 -7.991 -2.036 876 HB3 LYS 97 HB1 LYS 97 -17.803 -6.818 -1.792 877 HG2 LYS 97 HG2 LYS 97 -17.445 -6.636 -4.162 878 HG3 LYS 97 HG1 LYS 97 -18.603 -7.930 -4.473 879 HD2 LYS 97 HD2 LYS 97 -19.283 -5.308 -3.146 880 HD3 LYS 97 HD1 LYS 97 -19.517 -5.651 -4.861 881 HE2 LYS 97 HE2 LYS 97 -21.031 -7.481 -4.289 882 HE3 LYS 97 HE1 LYS 97 -20.781 -7.158 -2.576 883 HZ1 LYS 97 HZ1 LYS 97 -21.966 -5.248 -4.512 884 HZ2 LYS 97 HZ2 LYS 97 -21.771 -4.992 -2.854 885 HZ3 LYS 97 HZ3 LYS 97 -22.838 -6.180 -3.405 886 H ASN 98 HN ASN 98 -16.601 -11.053 -1.377 887 HA ASN 98 HA ASN 98 -16.838 -10.172 1.409 888 HB2 ASN 98 HB2 ASN 98 -18.327 -12.014 0.664 889 HB3 ASN 98 HB1 ASN 98 -16.907 -12.978 0.280 890 HD21 ASN 98 HD21 ASN 98 -17.250 -10.861 3.072 891 HD22 ASN 98 HD22 ASN 98 -17.213 -12.125 4.253 Start of MODEL 5 1 H1 LYS 1 HT1 LYS 1 14.347 5.148 -8.776 2 H2 LYS 1 HT2 LYS 1 12.757 5.089 -8.215 3 H3 LYS 1 HT3 LYS 1 13.992 4.352 -7.330 4 HA LYS 1 HA LYS 1 15.008 6.476 -6.893 5 HB2 LYS 1 HB2 LYS 1 12.639 7.515 -8.454 6 HB3 LYS 1 HB1 LYS 1 13.681 8.525 -7.464 7 HG2 LYS 1 HG2 LYS 1 15.589 7.947 -8.867 8 HG3 LYS 1 HG1 LYS 1 14.554 6.914 -9.852 9 HD2 LYS 1 HD2 LYS 1 14.901 9.080 -10.917 10 HD3 LYS 1 HD1 LYS 1 13.208 8.854 -10.480 11 HE2 LYS 1 HE2 LYS 1 13.924 11.110 -9.947 12 HE3 LYS 1 HE1 LYS 1 13.559 10.223 -8.471 13 HZ1 LYS 1 HZ1 LYS 1 16.275 10.691 -9.576 14 HZ2 LYS 1 HZ2 LYS 1 15.926 9.848 -8.151 15 HZ3 LYS 1 HZ3 LYS 1 15.595 11.502 -8.257 16 HA PRO 2 HA PRO 2 12.025 5.962 -3.523 17 HB2 PRO 2 HB2 PRO 2 13.810 5.885 -1.537 18 HB3 PRO 2 HB1 PRO 2 13.575 4.490 -2.599 19 HG2 PRO 2 HG2 PRO 2 15.733 6.555 -2.635 20 HG3 PRO 2 HG1 PRO 2 15.858 4.806 -2.880 21 HD2 PRO 2 HD2 PRO 2 15.785 6.687 -4.908 22 HD3 PRO 2 HD1 PRO 2 15.365 4.975 -5.098 23 H VAL 3 HN VAL 3 11.327 7.444 -1.924 24 HA VAL 3 HA VAL 3 12.107 10.178 -2.439 25 HB VAL 3 HB VAL 3 10.119 9.188 -0.389 26 HG11 VAL 3 HG11 VAL 3 9.128 11.414 -0.652 27 HG12 VAL 3 HG12 VAL 3 10.408 11.845 -1.787 28 HG13 VAL 3 HG13 VAL 3 10.802 11.507 -0.101 29 HG21 VAL 3 HG21 VAL 3 9.640 9.905 -3.279 30 HG22 VAL 3 HG22 VAL 3 8.389 9.559 -2.084 31 HG23 VAL 3 HG23 VAL 3 9.520 8.295 -2.571 32 H SER 4 HN SER 4 13.913 10.918 -1.489 33 HA SER 4 HA SER 4 14.255 10.578 1.377 34 HB2 SER 4 HB2 SER 4 15.393 8.617 0.372 35 HB3 SER 4 HB1 SER 4 16.391 9.706 -0.589 36 HG SER 4 HG SER 4 17.168 10.581 1.407 37 H LEU 5 HN LEU 5 13.647 12.844 -0.249 38 HA LEU 5 HA LEU 5 16.092 14.449 0.143 39 HB2 LEU 5 HB2 LEU 5 13.820 14.948 -1.784 40 HB3 LEU 5 HB1 LEU 5 15.197 16.006 -1.548 41 HG LEU 5 HG LEU 5 15.295 13.204 -2.665 42 HD11 LEU 5 HD11 LEU 5 14.339 14.808 -4.221 43 HD12 LEU 5 HD12 LEU 5 15.949 14.313 -4.744 44 HD13 LEU 5 HD13 LEU 5 15.715 15.883 -3.976 45 HD21 LEU 5 HD21 LEU 5 17.489 15.217 -2.200 46 HD22 LEU 5 HD22 LEU 5 17.663 13.729 -3.128 47 HD23 LEU 5 HD23 LEU 5 17.301 13.654 -1.404 48 H SER 6 HN SER 6 15.575 14.834 2.303 49 HA SER 6 HA SER 6 14.652 15.875 4.081 50 HB2 SER 6 HB2 SER 6 14.573 17.924 2.731 51 HB3 SER 6 HB1 SER 6 13.020 17.421 2.067 52 HG SER 6 HG SER 6 13.064 18.945 3.946 53 H TYR 7 HN TYR 7 12.106 15.472 1.746 54 HA TYR 7 HA TYR 7 10.338 14.228 3.663 55 HB2 TYR 7 HB2 TYR 7 10.072 14.471 0.654 56 HB3 TYR 7 HB1 TYR 7 8.812 13.930 1.755 57 HD1 TYR 7 HD1 TYR 7 8.198 15.647 3.660 58 HD2 TYR 7 HD2 TYR 7 10.096 16.683 -0.001 59 HE1 TYR 7 HE1 TYR 7 7.432 17.966 3.923 60 HE2 TYR 7 HE2 TYR 7 9.337 19.007 0.257 61 HH TYR 7 HH TYR 7 7.396 20.178 1.471 62 H ARG 8 HN ARG 8 10.232 12.109 4.056 63 HA ARG 8 HA ARG 8 11.164 10.239 2.029 64 HB2 ARG 8 HB2 ARG 8 12.460 8.955 3.724 65 HB3 ARG 8 HB1 ARG 8 13.149 10.527 3.346 66 HG2 ARG 8 HG2 ARG 8 12.108 11.419 5.415 67 HG3 ARG 8 HG1 ARG 8 11.583 9.778 5.805 68 HD2 ARG 8 HD2 ARG 8 13.911 9.032 5.781 69 HD3 ARG 8 HD1 ARG 8 14.431 10.672 5.396 70 HE ARG 8 HE ARG 8 12.883 10.625 7.771 71 HH11 ARG 8 HH11 ARG 8 16.057 9.890 6.509 72 HH12 ARG 8 HH12 ARG 8 16.856 10.091 8.035 73 HH21 ARG 8 HH21 ARG 8 13.916 10.905 9.784 74 HH22 ARG 8 HH22 ARG 8 15.630 10.666 9.910 75 H CYS 9 HN CYS 9 9.921 8.488 1.901 76 HA CYS 9 HA CYS 9 7.579 8.418 3.555 77 HB2 CYS 9 HB2 CYS 9 8.432 6.655 1.258 78 HB3 CYS 9 HB1 CYS 9 6.845 6.686 1.991 79 HA PRO 10 HA PRO 10 8.324 5.525 6.721 80 HB2 PRO 10 HB2 PRO 10 6.393 3.768 5.288 81 HB3 PRO 10 HB1 PRO 10 6.472 4.181 7.002 82 HG2 PRO 10 HG2 PRO 10 4.746 5.371 5.310 83 HG3 PRO 10 HG1 PRO 10 5.450 6.192 6.707 84 HD2 PRO 10 HD2 PRO 10 5.944 6.642 3.862 85 HD3 PRO 10 HD1 PRO 10 6.342 7.672 5.244 86 H CYS 11 HN CYS 11 8.030 3.909 3.564 87 HA CYS 11 HA CYS 11 9.748 1.757 4.470 88 HB2 CYS 11 HB2 CYS 11 7.688 2.012 2.536 89 HB3 CYS 11 HB1 CYS 11 9.163 1.598 1.674 90 H ARG 12 HN ARG 12 11.761 1.385 3.826 91 HA ARG 12 HA ARG 12 13.326 3.424 2.591 92 HB2 ARG 12 HB2 ARG 12 14.043 0.527 3.072 93 HB3 ARG 12 HB1 ARG 12 15.164 1.833 2.730 94 HG2 ARG 12 HG2 ARG 12 13.462 1.559 5.193 95 HG3 ARG 12 HG1 ARG 12 15.191 1.245 5.080 96 HD2 ARG 12 HD2 ARG 12 15.084 3.378 5.997 97 HD3 ARG 12 HD1 ARG 12 15.364 3.683 4.286 98 HE ARG 12 HE ARG 12 12.736 3.852 4.342 99 HH11 ARG 12 HH11 ARG 12 15.098 5.144 6.569 100 HH12 ARG 12 HH12 ARG 12 14.082 6.449 7.095 101 HH21 ARG 12 HH21 ARG 12 11.395 5.600 5.003 102 HH22 ARG 12 HH22 ARG 12 11.979 6.703 6.210 103 H PHE 13 HN PHE 13 14.964 2.213 0.773 104 HA PHE 13 HA PHE 13 13.212 2.064 -1.480 105 HB2 PHE 13 HB2 PHE 13 15.279 1.738 -2.809 106 HB3 PHE 13 HB1 PHE 13 15.349 3.159 -1.775 107 HD1 PHE 13 HD1 PHE 13 16.704 -0.150 -2.430 108 HD2 PHE 13 HD2 PHE 13 16.777 3.205 0.171 109 HE1 PHE 13 HE1 PHE 13 18.780 -0.965 -1.443 110 HE2 PHE 13 HE2 PHE 13 18.851 2.400 1.163 111 HZ PHE 13 HZ PHE 13 19.877 0.306 0.365 112 H PHE 14 HN PHE 14 12.829 0.292 -2.785 113 HA PHE 14 HA PHE 14 12.412 -1.972 -1.061 114 HB2 PHE 14 HB2 PHE 14 11.334 -2.256 -3.729 115 HB3 PHE 14 HB1 PHE 14 10.507 -2.219 -2.183 116 HD1 PHE 14 HD1 PHE 14 9.586 -0.176 -1.294 117 HD2 PHE 14 HD2 PHE 14 11.624 -0.209 -5.031 118 HE1 PHE 14 HE1 PHE 14 8.680 2.053 -1.804 119 HE2 PHE 14 HE2 PHE 14 10.720 2.020 -5.547 120 HZ PHE 14 HZ PHE 14 9.247 3.153 -3.934 121 H GLU 15 HN GLU 15 12.509 -4.187 -1.964 122 HA GLU 15 HA GLU 15 15.076 -4.537 -3.282 123 HB2 GLU 15 HB2 GLU 15 15.191 -5.401 -1.129 124 HB3 GLU 15 HB1 GLU 15 13.538 -5.978 -1.163 125 HG2 GLU 15 HG2 GLU 15 14.889 -7.871 -1.244 126 HG3 GLU 15 HG1 GLU 15 14.258 -7.593 -2.864 127 H SER 16 HN SER 16 15.049 -5.382 -5.217 128 HA SER 16 HA SER 16 12.491 -6.355 -6.275 129 HB2 SER 16 HB2 SER 16 13.826 -4.389 -7.327 130 HB3 SER 16 HB1 SER 16 14.878 -5.652 -7.963 131 HG SER 16 HG SER 16 12.299 -4.948 -8.684 132 H HIS 17 HN HIS 17 14.139 -7.994 -4.648 133 HA HIS 17 HA HIS 17 14.545 -10.182 -6.569 134 HB2 HIS 17 HB2 HIS 17 16.161 -9.573 -4.089 135 HB3 HIS 17 HB1 HIS 17 16.220 -11.115 -4.931 136 HD1 HIS 17 HD1 HIS 17 17.422 -7.614 -5.093 137 HD2 HIS 17 HD2 HIS 17 17.508 -11.030 -7.466 138 HE1 HIS 17 HE1 HIS 17 19.162 -7.171 -6.860 139 HE2 HIS 17 HE2 HIS 17 19.028 -9.157 -8.403 140 H ILE 18 HN ILE 18 12.673 -8.953 -4.228 141 HA ILE 18 HA ILE 18 12.148 -11.241 -2.622 142 HB ILE 18 HB ILE 18 10.446 -8.806 -3.153 143 HG12 ILE 18 HG12 ILE 18 12.203 -9.500 -0.805 144 HG13 ILE 18 HG11 ILE 18 12.635 -8.376 -2.083 145 HG21 ILE 18 HG21 ILE 18 10.144 -10.925 -1.030 146 HG22 ILE 18 HG22 ILE 18 9.062 -10.658 -2.397 147 HG23 ILE 18 HG23 ILE 18 9.205 -9.435 -1.134 148 HD11 ILE 18 HD11 ILE 18 11.900 -7.180 -0.119 149 HD12 ILE 18 HD12 ILE 18 10.372 -8.067 -0.127 150 HD13 ILE 18 HD13 ILE 18 10.749 -6.951 -1.437 151 H ALA 19 HN ALA 19 10.679 -12.808 -2.848 152 HA ALA 19 HA ALA 19 9.333 -13.035 -5.456 153 HB1 ALA 19 HB1 ALA 19 10.405 -15.221 -3.670 154 HB2 ALA 19 HB2 ALA 19 11.156 -14.645 -5.160 155 HB3 ALA 19 HB3 ALA 19 9.591 -15.452 -5.219 156 H ARG 20 HN ARG 20 7.486 -14.692 -5.276 157 HA ARG 20 HA ARG 20 5.678 -13.721 -3.304 158 HB2 ARG 20 HB2 ARG 20 4.978 -16.060 -4.961 159 HB3 ARG 20 HB1 ARG 20 4.142 -14.568 -4.681 160 HG2 ARG 20 HG2 ARG 20 5.675 -13.418 -6.229 161 HG3 ARG 20 HG1 ARG 20 6.379 -14.990 -6.603 162 HD2 ARG 20 HD2 ARG 20 3.503 -14.205 -6.992 163 HD3 ARG 20 HD1 ARG 20 4.712 -14.322 -8.268 164 HE ARG 20 HE ARG 20 4.565 -16.775 -6.888 165 HH11 ARG 20 HH11 ARG 20 2.726 -14.822 -9.139 166 HH12 ARG 20 HH12 ARG 20 1.889 -16.177 -9.823 167 HH21 ARG 20 HH21 ARG 20 3.467 -18.557 -7.786 168 HH22 ARG 20 HH22 ARG 20 2.303 -18.298 -9.047 169 H ALA 21 HN ALA 21 7.540 -16.565 -3.918 170 HA ALA 21 HA ALA 21 6.233 -18.129 -1.856 171 HB1 ALA 21 HB1 ALA 21 8.582 -18.840 -3.597 172 HB2 ALA 21 HB2 ALA 21 6.892 -19.186 -3.965 173 HB3 ALA 21 HB3 ALA 21 7.665 -19.945 -2.573 174 H ASN 22 HN ASN 22 8.833 -15.964 -1.965 175 HA ASN 22 HA ASN 22 10.137 -17.265 0.271 176 HB2 ASN 22 HB2 ASN 22 12.012 -16.040 -0.227 177 HB3 ASN 22 HB1 ASN 22 11.346 -16.297 -1.813 178 HD21 ASN 22 HD21 ASN 22 13.226 -14.315 -0.981 179 HD22 ASN 22 HD22 ASN 22 12.496 -12.775 -1.265 180 H VAL 23 HN VAL 23 7.835 -15.003 -0.316 181 HA VAL 23 HA VAL 23 8.481 -13.357 1.979 182 HB VAL 23 HB VAL 23 7.786 -12.223 -0.083 183 HG11 VAL 23 HG11 VAL 23 5.145 -13.574 0.405 184 HG12 VAL 23 HG12 VAL 23 6.205 -13.797 -0.989 185 HG13 VAL 23 HG13 VAL 23 5.403 -12.246 -0.727 186 HG21 VAL 23 HG21 VAL 23 6.249 -10.686 0.938 187 HG22 VAL 23 HG22 VAL 23 7.483 -11.205 2.099 188 HG23 VAL 23 HG23 VAL 23 5.854 -11.879 2.176 189 H LYS 24 HN LYS 24 7.267 -13.063 3.663 190 HA LYS 24 HA LYS 24 5.163 -14.983 4.316 191 HB2 LYS 24 HB2 LYS 24 6.660 -13.042 6.087 192 HB3 LYS 24 HB1 LYS 24 5.470 -14.210 6.629 193 HG2 LYS 24 HG2 LYS 24 7.005 -16.000 5.718 194 HG3 LYS 24 HG1 LYS 24 8.202 -14.721 5.531 195 HD2 LYS 24 HD2 LYS 24 8.386 -14.363 7.777 196 HD3 LYS 24 HD1 LYS 24 6.815 -15.052 8.154 197 HE2 LYS 24 HE2 LYS 24 7.754 -17.288 7.604 198 HE3 LYS 24 HE1 LYS 24 9.330 -16.526 7.379 199 HZ1 LYS 24 HZ1 LYS 24 7.762 -16.568 9.896 200 HZ2 LYS 24 HZ2 LYS 24 9.238 -15.766 9.682 201 HZ3 LYS 24 HZ3 LYS 24 9.165 -17.453 9.575 202 H HIS 25 HN HIS 25 4.057 -13.270 6.337 203 HA HIS 25 HA HIS 25 1.820 -12.232 5.295 204 HB2 HIS 25 HB2 HIS 25 3.136 -10.397 7.235 205 HB3 HIS 25 HB1 HIS 25 1.485 -10.978 7.207 206 HD1 HIS 25 HD1 HIS 25 2.629 -10.856 9.842 207 HD2 HIS 25 HD2 HIS 25 3.342 -14.182 7.449 208 HE1 HIS 25 HE1 HIS 25 3.315 -12.681 11.408 209 HE2 HIS 25 HE2 HIS 25 3.487 -14.742 9.969 210 H LEU 26 HN LEU 26 1.527 -10.908 3.579 211 HA LEU 26 HA LEU 26 3.474 -8.761 3.171 212 HB2 LEU 26 HB2 LEU 26 3.075 -10.328 1.311 213 HB3 LEU 26 HB1 LEU 26 1.403 -9.805 1.236 214 HG LEU 26 HG LEU 26 2.009 -7.661 0.418 215 HD11 LEU 26 HD11 LEU 26 4.357 -6.934 0.265 216 HD12 LEU 26 HD12 LEU 26 4.837 -8.380 1.154 217 HD13 LEU 26 HD13 LEU 26 3.822 -7.167 1.923 218 HD21 LEU 26 HD21 LEU 26 4.026 -8.518 -1.273 219 HD22 LEU 26 HD22 LEU 26 2.283 -8.677 -1.562 220 HD23 LEU 26 HD23 LEU 26 3.181 -10.015 -0.843 221 H LYS 27 HN LYS 27 2.987 -6.737 3.398 222 HA LYS 27 HA LYS 27 0.214 -5.940 3.960 223 HB2 LYS 27 HB2 LYS 27 1.145 -6.281 6.115 224 HB3 LYS 27 HB1 LYS 27 2.670 -5.552 5.646 225 HG2 LYS 27 HG2 LYS 27 1.562 -4.028 7.081 226 HG3 LYS 27 HG1 LYS 27 1.495 -3.376 5.442 227 HD2 LYS 27 HD2 LYS 27 -0.645 -3.071 6.528 228 HD3 LYS 27 HD1 LYS 27 -0.808 -4.250 5.228 229 HE2 LYS 27 HE2 LYS 27 -0.728 -6.067 6.836 230 HE3 LYS 27 HE1 LYS 27 -0.475 -4.919 8.149 231 HZ1 LYS 27 HZ1 LYS 27 -2.889 -5.061 6.426 232 HZ2 LYS 27 HZ2 LYS 27 -2.645 -3.973 7.700 233 HZ3 LYS 27 HZ3 LYS 27 -2.776 -5.628 8.016 234 H ILE 28 HN ILE 28 -0.267 -3.759 3.514 235 HA ILE 28 HA ILE 28 1.813 -2.338 1.993 236 HB ILE 28 HB ILE 28 -1.138 -1.791 1.795 237 HG12 ILE 28 HG12 ILE 28 0.475 -3.433 -0.150 238 HG13 ILE 28 HG11 ILE 28 -0.444 -4.174 1.159 239 HG21 ILE 28 HG21 ILE 28 1.245 -1.120 0.053 240 HG22 ILE 28 HG22 ILE 28 0.304 0.004 1.042 241 HG23 ILE 28 HG23 ILE 28 -0.438 -0.770 -0.358 242 HD11 ILE 28 HD11 ILE 28 -1.569 -2.439 -1.014 243 HD12 ILE 28 HD12 ILE 28 -2.485 -3.224 0.271 244 HD13 ILE 28 HD13 ILE 28 -1.659 -4.198 -0.945 245 H LEU 29 HN LEU 29 2.583 -0.521 2.871 246 HA LEU 29 HA LEU 29 1.535 0.433 5.365 247 HB2 LEU 29 HB2 LEU 29 4.004 0.465 4.433 248 HB3 LEU 29 HB1 LEU 29 3.508 2.000 3.737 249 HG LEU 29 HG LEU 29 4.694 2.302 5.858 250 HD11 LEU 29 HD11 LEU 29 3.072 3.982 5.259 251 HD12 LEU 29 HD12 LEU 29 3.035 3.721 7.002 252 HD13 LEU 29 HD13 LEU 29 1.767 3.035 5.980 253 HD21 LEU 29 HD21 LEU 29 2.407 0.781 7.096 254 HD22 LEU 29 HD22 LEU 29 3.722 1.575 7.960 255 HD23 LEU 29 HD23 LEU 29 4.059 0.194 6.917 256 H ASN 30 HN ASN 30 -0.075 1.798 5.596 257 HA ASN 30 HA ASN 30 -1.158 3.342 3.456 258 HB2 ASN 30 HB2 ASN 30 -1.627 3.170 6.407 259 HB3 ASN 30 HB1 ASN 30 -2.330 4.489 5.490 260 HD21 ASN 30 HD21 ASN 30 -1.869 1.365 4.061 261 HD22 ASN 30 HD22 ASN 30 -3.538 0.917 4.014 262 H THR 31 HN THR 31 0.457 4.677 2.636 263 HA THR 31 HA THR 31 2.020 6.284 4.406 264 HB THR 31 HB THR 31 2.645 7.215 2.014 265 HG1 THR 31 HG1 THR 31 2.391 4.950 0.802 266 HG21 THR 31 HG21 THR 31 3.404 4.518 3.111 267 HG22 THR 31 HG22 THR 31 4.155 6.066 3.502 268 HG23 THR 31 HG23 THR 31 4.305 5.397 1.878 269 HA PRO 32 HA PRO 32 0.427 10.483 4.358 270 HB2 PRO 32 HB2 PRO 32 2.832 11.006 2.708 271 HB3 PRO 32 HB1 PRO 32 2.233 11.861 4.129 272 HG2 PRO 32 HG2 PRO 32 4.278 10.154 4.308 273 HG3 PRO 32 HG1 PRO 32 3.079 10.298 5.598 274 HD2 PRO 32 HD2 PRO 32 3.481 8.137 3.632 275 HD3 PRO 32 HD1 PRO 32 2.778 8.077 5.257 276 H ASN 33 HN ASN 33 0.214 8.615 1.707 277 HA ASN 33 HA ASN 33 -0.447 8.824 -0.457 278 HB2 ASN 33 HB2 ASN 33 -0.055 11.804 -0.119 279 HB3 ASN 33 HB1 ASN 33 -0.541 11.028 -1.618 280 HD21 ASN 33 HD21 ASN 33 -1.466 11.896 1.583 281 HD22 ASN 33 HD22 ASN 33 -3.158 11.624 1.404 282 H CYS 34 HN CYS 34 1.886 8.028 0.413 283 HA CYS 34 HA CYS 34 3.788 8.817 -1.647 284 HB2 CYS 34 HB2 CYS 34 3.875 6.891 0.682 285 HB3 CYS 34 HB1 CYS 34 5.140 6.953 -0.514 286 H ALA 35 HN ALA 35 4.689 6.776 -2.856 287 HA ALA 35 HA ALA 35 2.744 5.255 -4.114 288 HB1 ALA 35 HB1 ALA 35 5.581 4.431 -3.470 289 HB2 ALA 35 HB2 ALA 35 5.067 5.343 -4.888 290 HB3 ALA 35 HB3 ALA 35 4.538 3.674 -4.674 291 H LEU 36 HN LEU 36 1.682 3.366 -3.607 292 HA LEU 36 HA LEU 36 1.212 2.652 -0.960 293 HB2 LEU 36 HB2 LEU 36 0.850 1.208 -3.583 294 HB3 LEU 36 HB1 LEU 36 0.451 0.431 -2.072 295 HG LEU 36 HG LEU 36 -1.557 1.305 -3.045 296 HD11 LEU 36 HD11 LEU 36 -2.366 2.729 -1.267 297 HD12 LEU 36 HD12 LEU 36 -0.713 3.087 -0.771 298 HD13 LEU 36 HD13 LEU 36 -1.347 1.449 -0.610 299 HD21 LEU 36 HD21 LEU 36 -0.595 2.991 -4.500 300 HD22 LEU 36 HD22 LEU 36 -0.170 3.978 -3.103 301 HD23 LEU 36 HD23 LEU 36 -1.863 3.690 -3.496 302 H GLN 37 HN GLN 37 2.623 1.819 0.425 303 HA GLN 37 HA GLN 37 5.093 0.691 -0.560 304 HB2 GLN 37 HB2 GLN 37 4.194 1.051 2.291 305 HB3 GLN 37 HB1 GLN 37 5.841 0.855 1.714 306 HG2 GLN 37 HG2 GLN 37 4.194 3.180 0.805 307 HG3 GLN 37 HG1 GLN 37 4.980 3.194 2.382 308 HE21 GLN 37 HE21 GLN 37 6.219 4.898 1.752 309 HE22 GLN 37 HE22 GLN 37 7.578 4.712 0.704 310 H ILE 38 HN ILE 38 5.138 -1.387 -1.048 311 HA ILE 38 HA ILE 38 3.469 -3.307 0.304 312 HB ILE 38 HB ILE 38 5.549 -3.797 -1.834 313 HG12 ILE 38 HG12 ILE 38 3.268 -3.986 -3.199 314 HG13 ILE 38 HG11 ILE 38 2.743 -2.806 -2.012 315 HG21 ILE 38 HG21 ILE 38 5.056 -5.864 -0.972 316 HG22 ILE 38 HG22 ILE 38 3.873 -5.731 -2.274 317 HG23 ILE 38 HG23 ILE 38 3.384 -5.433 -0.605 318 HD11 ILE 38 HD11 ILE 38 3.569 -1.852 -4.150 319 HD12 ILE 38 HD12 ILE 38 5.174 -2.470 -3.753 320 HD13 ILE 38 HD13 ILE 38 4.409 -1.259 -2.724 321 H VAL 39 HN VAL 39 4.186 -3.697 2.332 322 HA VAL 39 HA VAL 39 7.068 -4.009 2.785 323 HB VAL 39 HB VAL 39 5.539 -2.425 4.169 324 HG11 VAL 39 HG11 VAL 39 4.916 -4.998 5.584 325 HG12 VAL 39 HG12 VAL 39 3.773 -4.005 4.680 326 HG13 VAL 39 HG13 VAL 39 4.523 -3.374 6.148 327 HG21 VAL 39 HG21 VAL 39 7.429 -4.336 5.524 328 HG22 VAL 39 HG22 VAL 39 6.906 -2.782 6.172 329 HG23 VAL 39 HG23 VAL 39 7.861 -2.843 4.690 330 H ALA 40 HN ALA 40 7.950 -5.976 3.292 331 HA ALA 40 HA ALA 40 6.054 -8.208 3.590 332 HB1 ALA 40 HB1 ALA 40 6.717 -7.900 1.222 333 HB2 ALA 40 HB2 ALA 40 7.167 -9.466 1.893 334 HB3 ALA 40 HB3 ALA 40 8.385 -8.207 1.692 335 H ARG 41 HN ARG 41 6.683 -9.761 4.971 336 HA ARG 41 HA ARG 41 9.347 -9.538 6.156 337 HB2 ARG 41 HB2 ARG 41 6.798 -10.903 6.946 338 HB3 ARG 41 HB1 ARG 41 8.330 -11.454 7.620 339 HG2 ARG 41 HG2 ARG 41 7.969 -8.562 7.752 340 HG3 ARG 41 HG1 ARG 41 6.767 -9.477 8.650 341 HD2 ARG 41 HD2 ARG 41 9.745 -9.772 8.914 342 HD3 ARG 41 HD1 ARG 41 8.697 -8.916 10.042 343 HE ARG 41 HE ARG 41 8.041 -11.702 9.560 344 HH11 ARG 41 HH11 ARG 41 9.700 -9.398 11.594 345 HH12 ARG 41 HH12 ARG 41 9.742 -10.447 12.972 346 HH21 ARG 41 HH21 ARG 41 8.082 -13.090 11.376 347 HH22 ARG 41 HH22 ARG 41 8.819 -12.552 12.848 348 H LEU 42 HN LEU 42 10.935 -10.918 5.611 349 HA LEU 42 HA LEU 42 10.450 -12.776 3.505 350 HB2 LEU 42 HB2 LEU 42 12.856 -12.062 5.141 351 HB3 LEU 42 HB1 LEU 42 12.894 -13.461 4.088 352 HG LEU 42 HG LEU 42 12.236 -10.681 3.129 353 HD11 LEU 42 HD11 LEU 42 14.517 -10.600 2.263 354 HD12 LEU 42 HD12 LEU 42 14.868 -12.149 3.026 355 HD13 LEU 42 HD13 LEU 42 14.513 -10.737 4.023 356 HD21 LEU 42 HD21 LEU 42 12.777 -11.676 0.919 357 HD22 LEU 42 HD22 LEU 42 11.370 -12.408 1.684 358 HD23 LEU 42 HD23 LEU 42 12.915 -13.255 1.694 359 H LYS 43 HN LYS 43 10.686 -14.976 3.486 360 HA LYS 43 HA LYS 43 9.369 -16.259 5.619 361 HB2 LYS 43 HB2 LYS 43 9.283 -16.845 3.177 362 HB3 LYS 43 HB1 LYS 43 10.891 -17.512 3.350 363 HG2 LYS 43 HG2 LYS 43 10.029 -19.141 4.969 364 HG3 LYS 43 HG1 LYS 43 8.405 -18.490 4.720 365 HD2 LYS 43 HD2 LYS 43 8.745 -18.970 2.248 366 HD3 LYS 43 HD1 LYS 43 10.174 -19.889 2.728 367 HE2 LYS 43 HE2 LYS 43 7.364 -20.408 3.688 368 HE3 LYS 43 HE1 LYS 43 8.198 -21.321 2.434 369 HZ1 LYS 43 HZ1 LYS 43 8.305 -22.455 4.549 370 HZ2 LYS 43 HZ2 LYS 43 9.030 -21.112 5.278 371 HZ3 LYS 43 HZ3 LYS 43 9.855 -21.971 4.077 372 H ASN 44 HN ASN 44 12.659 -16.741 4.322 373 HA ASN 44 HA ASN 44 13.380 -18.322 6.627 374 HB2 ASN 44 HB2 ASN 44 14.973 -17.442 4.233 375 HB3 ASN 44 HB1 ASN 44 15.607 -18.472 5.507 376 HD21 ASN 44 HD21 ASN 44 15.226 -18.960 2.644 377 HD22 ASN 44 HD22 ASN 44 14.223 -20.364 2.528 378 H ASN 45 HN ASN 45 14.543 -15.323 5.132 379 HA ASN 45 HA ASN 45 16.376 -14.731 7.190 380 HB2 ASN 45 HB2 ASN 45 16.424 -13.873 4.821 381 HB3 ASN 45 HB1 ASN 45 15.161 -12.764 5.304 382 HD21 ASN 45 HD21 ASN 45 16.681 -11.118 4.641 383 HD22 ASN 45 HD22 ASN 45 17.903 -10.599 5.751 384 H ASN 46 HN ASN 46 13.030 -13.973 6.688 385 HA ASN 46 HA ASN 46 11.380 -13.455 8.139 386 HB2 ASN 46 HB2 ASN 46 12.960 -14.912 9.659 387 HB3 ASN 46 HB1 ASN 46 13.220 -13.379 10.484 388 HD21 ASN 46 HD21 ASN 46 12.192 -14.002 12.353 389 HD22 ASN 46 HD22 ASN 46 10.483 -14.245 12.448 390 H ARG 47 HN ARG 47 13.688 -11.391 7.304 391 HA ARG 47 HA ARG 47 13.090 -9.257 9.134 392 HB2 ARG 47 HB2 ARG 47 14.608 -9.093 6.544 393 HB3 ARG 47 HB1 ARG 47 14.725 -8.017 7.932 394 HG2 ARG 47 HG2 ARG 47 15.559 -10.037 9.211 395 HG3 ARG 47 HG1 ARG 47 15.733 -10.822 7.647 396 HD2 ARG 47 HD2 ARG 47 17.117 -8.870 6.926 397 HD3 ARG 47 HD1 ARG 47 17.092 -8.322 8.606 398 HE ARG 47 HE ARG 47 18.085 -11.016 8.003 399 HH11 ARG 47 HH11 ARG 47 18.712 -7.751 9.118 400 HH12 ARG 47 HH12 ARG 47 20.312 -8.118 9.675 401 HH21 ARG 47 HH21 ARG 47 20.192 -11.492 8.737 402 HH22 ARG 47 HH22 ARG 47 21.152 -10.241 9.459 403 H GLN 48 HN GLN 48 12.055 -7.377 8.623 404 HA GLN 48 HA GLN 48 9.963 -7.563 6.662 405 HB2 GLN 48 HB2 GLN 48 9.584 -6.573 8.886 406 HB3 GLN 48 HB1 GLN 48 10.710 -5.281 8.499 407 HG2 GLN 48 HG2 GLN 48 9.261 -4.550 6.696 408 HG3 GLN 48 HG1 GLN 48 8.135 -5.855 7.066 409 HE21 GLN 48 HE21 GLN 48 9.413 -2.795 8.085 410 HE22 GLN 48 HE22 GLN 48 8.201 -2.455 9.269 411 H VAL 49 HN VAL 49 9.980 -6.694 4.698 412 HA VAL 49 HA VAL 49 12.172 -4.888 3.887 413 HB VAL 49 HB VAL 49 10.991 -6.707 1.902 414 HG11 VAL 49 HG11 VAL 49 13.755 -5.630 2.342 415 HG12 VAL 49 HG12 VAL 49 12.613 -5.202 1.069 416 HG13 VAL 49 HG13 VAL 49 13.358 -6.799 1.083 417 HG21 VAL 49 HG21 VAL 49 12.970 -7.666 3.920 418 HG22 VAL 49 HG22 VAL 49 12.500 -8.533 2.457 419 HG23 VAL 49 HG23 VAL 49 11.306 -8.213 3.719 420 H CYS 50 HN CYS 50 11.628 -3.921 1.732 421 HA CYS 50 HA CYS 50 8.755 -3.461 1.385 422 HB2 CYS 50 HB2 CYS 50 10.991 -1.615 0.511 423 HB3 CYS 50 HB1 CYS 50 9.274 -1.279 0.539 424 H ILE 51 HN ILE 51 7.973 -4.178 -0.552 425 HA ILE 51 HA ILE 51 9.892 -5.426 -2.351 426 HB ILE 51 HB ILE 51 6.969 -5.448 -2.960 427 HG12 ILE 51 HG12 ILE 51 8.260 -7.116 -0.782 428 HG13 ILE 51 HG11 ILE 51 6.966 -5.937 -0.566 429 HG21 ILE 51 HG21 ILE 51 7.449 -7.547 -3.919 430 HG22 ILE 51 HG22 ILE 51 8.969 -7.685 -3.044 431 HG23 ILE 51 HG23 ILE 51 8.814 -6.518 -4.354 432 HD11 ILE 51 HD11 ILE 51 5.532 -7.362 -2.038 433 HD12 ILE 51 HD12 ILE 51 5.999 -8.121 -0.520 434 HD13 ILE 51 HD13 ILE 51 6.811 -8.574 -2.016 435 H ASP 52 HN ASP 52 10.210 -4.939 -4.445 436 HA ASP 52 HA ASP 52 9.863 -2.243 -5.254 437 HB2 ASP 52 HB2 ASP 52 11.808 -3.433 -5.992 438 HB3 ASP 52 HB1 ASP 52 10.834 -4.713 -6.691 439 HA PRO 53 HA PRO 53 5.709 -2.722 -6.859 440 HB2 PRO 53 HB2 PRO 53 5.583 -0.254 -8.016 441 HB3 PRO 53 HB1 PRO 53 5.337 -0.539 -6.291 442 HG2 PRO 53 HG2 PRO 53 7.799 0.378 -7.712 443 HG3 PRO 53 HG1 PRO 53 7.085 0.985 -6.214 444 HD2 PRO 53 HD2 PRO 53 9.179 -0.666 -6.200 445 HD3 PRO 53 HD1 PRO 53 7.907 -0.768 -4.974 446 H LYS 54 HN LYS 54 8.604 -2.195 -8.589 447 HA LYS 54 HA LYS 54 7.348 -2.263 -11.207 448 HB2 LYS 54 HB2 LYS 54 10.173 -1.931 -10.281 449 HB3 LYS 54 HB1 LYS 54 9.777 -2.200 -11.976 450 HG2 LYS 54 HG2 LYS 54 8.384 -0.222 -11.992 451 HG3 LYS 54 HG1 LYS 54 8.702 0.034 -10.277 452 HD2 LYS 54 HD2 LYS 54 10.875 -0.093 -12.327 453 HD3 LYS 54 HD1 LYS 54 10.067 1.417 -11.910 454 HE2 LYS 54 HE2 LYS 54 10.707 0.996 -9.533 455 HE3 LYS 54 HE1 LYS 54 11.643 -0.386 -10.092 456 HZ1 LYS 54 HZ1 LYS 54 13.009 1.085 -11.404 457 HZ2 LYS 54 HZ2 LYS 54 13.010 1.598 -9.794 458 HZ3 LYS 54 HZ3 LYS 54 12.082 2.423 -10.944 459 H LEU 55 HN LEU 55 8.291 -4.486 -8.943 460 HA LEU 55 HA LEU 55 9.278 -6.610 -10.478 461 HB2 LEU 55 HB2 LEU 55 7.854 -6.270 -7.890 462 HB3 LEU 55 HB1 LEU 55 8.013 -7.896 -8.531 463 HG LEU 55 HG LEU 55 10.369 -6.060 -8.131 464 HD11 LEU 55 HD11 LEU 55 9.087 -7.970 -6.197 465 HD12 LEU 55 HD12 LEU 55 9.453 -6.256 -5.980 466 HD13 LEU 55 HD13 LEU 55 10.761 -7.433 -6.059 467 HD21 LEU 55 HD21 LEU 55 11.608 -8.176 -8.138 468 HD22 LEU 55 HD22 LEU 55 10.729 -7.903 -9.642 469 HD23 LEU 55 HD23 LEU 55 10.101 -9.041 -8.451 470 H LYS 56 HN LYS 56 8.309 -8.058 -11.758 471 HA LYS 56 HA LYS 56 5.954 -7.270 -13.063 472 HB2 LYS 56 HB2 LYS 56 7.661 -9.733 -13.200 473 HB3 LYS 56 HB1 LYS 56 6.148 -9.657 -14.085 474 HG2 LYS 56 HG2 LYS 56 7.899 -9.062 -15.573 475 HG3 LYS 56 HG1 LYS 56 6.985 -7.600 -15.212 476 HD2 LYS 56 HD2 LYS 56 8.691 -6.901 -13.628 477 HD3 LYS 56 HD1 LYS 56 9.587 -8.394 -13.910 478 HE2 LYS 56 HE2 LYS 56 9.887 -7.765 -16.259 479 HE3 LYS 56 HE1 LYS 56 9.000 -6.270 -15.970 480 HZ1 LYS 56 HZ1 LYS 56 11.394 -5.925 -15.930 481 HZ2 LYS 56 HZ2 LYS 56 11.554 -7.031 -14.664 482 HZ3 LYS 56 HZ3 LYS 56 10.712 -5.587 -14.422 483 H TRP 57 HN TRP 57 6.505 -9.540 -10.447 484 HA TRP 57 HA TRP 57 3.783 -10.541 -10.646 485 HB2 TRP 57 HB2 TRP 57 4.338 -12.057 -8.933 486 HB3 TRP 57 HB1 TRP 57 5.784 -11.943 -9.904 487 HD1 TRP 57 HD1 TRP 57 7.929 -10.998 -8.743 488 HE1 TRP 57 HE1 TRP 57 8.558 -10.558 -6.279 489 HE3 TRP 57 HE3 TRP 57 3.269 -11.190 -6.711 490 HZ2 TRP 57 HZ2 TRP 57 7.219 -10.326 -3.798 491 HZ3 TRP 57 HZ3 TRP 57 3.010 -10.836 -4.300 492 HH2 TRP 57 HH2 TRP 57 4.947 -10.421 -2.864 493 H ILE 58 HN ILE 58 5.529 -8.079 -9.067 494 HA ILE 58 HA ILE 58 3.719 -7.665 -6.902 495 HB ILE 58 HB ILE 58 6.024 -6.147 -8.038 496 HG12 ILE 58 HG12 ILE 58 6.396 -8.057 -6.528 497 HG13 ILE 58 HG11 ILE 58 6.969 -6.543 -5.836 498 HG21 ILE 58 HG21 ILE 58 5.721 -4.473 -6.239 499 HG22 ILE 58 HG22 ILE 58 4.111 -5.140 -5.960 500 HG23 ILE 58 HG23 ILE 58 4.502 -4.403 -7.518 501 HD11 ILE 58 HD11 ILE 58 5.106 -6.419 -4.377 502 HD12 ILE 58 HD12 ILE 58 5.758 -8.054 -4.264 503 HD13 ILE 58 HD13 ILE 58 4.303 -7.753 -5.198 504 H GLN 59 HN GLN 59 4.126 -6.294 -10.116 505 HA GLN 59 HA GLN 59 2.323 -4.192 -10.067 506 HB2 GLN 59 HB2 GLN 59 3.022 -6.223 -12.132 507 HB3 GLN 59 HB1 GLN 59 1.837 -4.979 -12.487 508 HG2 GLN 59 HG2 GLN 59 4.637 -4.424 -11.575 509 HG3 GLN 59 HG1 GLN 59 4.162 -4.520 -13.271 510 HE21 GLN 59 HE21 GLN 59 4.129 -2.611 -10.404 511 HE22 GLN 59 HE22 GLN 59 3.386 -1.205 -11.094 512 H GLU 60 HN GLU 60 1.778 -7.592 -10.150 513 HA GLU 60 HA GLU 60 -1.008 -7.548 -10.715 514 HB2 GLU 60 HB2 GLU 60 0.650 -9.662 -9.317 515 HB3 GLU 60 HB1 GLU 60 -0.963 -9.897 -9.976 516 HG2 GLU 60 HG2 GLU 60 1.482 -9.187 -11.577 517 HG3 GLU 60 HG1 GLU 60 0.808 -10.807 -11.410 518 H TYR 61 HN TYR 61 0.919 -7.592 -7.781 519 HA TYR 61 HA TYR 61 -1.328 -7.844 -6.005 520 HB2 TYR 61 HB2 TYR 61 0.885 -8.658 -5.342 521 HB3 TYR 61 HB1 TYR 61 1.553 -7.049 -5.512 522 HD1 TYR 61 HD1 TYR 61 -0.555 -9.204 -3.470 523 HD2 TYR 61 HD2 TYR 61 1.245 -5.373 -3.826 524 HE1 TYR 61 HE1 TYR 61 -1.014 -8.774 -1.114 525 HE2 TYR 61 HE2 TYR 61 0.784 -4.931 -1.448 526 HH TYR 61 HH TYR 61 -0.161 -7.361 0.720 527 H LEU 62 HN LEU 62 0.574 -5.374 -7.451 528 HA LEU 62 HA LEU 62 -0.116 -3.148 -5.958 529 HB2 LEU 62 HB2 LEU 62 1.196 -3.767 -8.374 530 HB3 LEU 62 HB1 LEU 62 0.098 -2.428 -8.688 531 HG LEU 62 HG LEU 62 1.127 -1.239 -6.726 532 HD11 LEU 62 HD11 LEU 62 3.450 -2.110 -6.176 533 HD12 LEU 62 HD12 LEU 62 2.902 -3.638 -6.879 534 HD13 LEU 62 HD13 LEU 62 2.071 -2.962 -5.478 535 HD21 LEU 62 HD21 LEU 62 3.134 -0.561 -7.937 536 HD22 LEU 62 HD22 LEU 62 1.745 -0.687 -9.017 537 HD23 LEU 62 HD23 LEU 62 2.968 -1.957 -9.002 538 H GLU 63 HN GLU 63 -1.721 -4.654 -8.698 539 HA GLU 63 HA GLU 63 -3.687 -2.811 -9.220 540 HB2 GLU 63 HB2 GLU 63 -3.819 -5.810 -9.163 541 HB3 GLU 63 HB1 GLU 63 -5.081 -4.801 -9.833 542 HG2 GLU 63 HG2 GLU 63 -3.464 -3.845 -11.383 543 HG3 GLU 63 HG1 GLU 63 -2.237 -4.928 -10.753 544 H LYS 64 HN LYS 64 -3.629 -5.266 -6.739 545 HA LYS 64 HA LYS 64 -6.152 -4.622 -5.582 546 HB2 LYS 64 HB2 LYS 64 -3.779 -6.116 -4.483 547 HB3 LYS 64 HB1 LYS 64 -5.322 -5.982 -3.650 548 HG2 LYS 64 HG2 LYS 64 -5.571 -8.023 -4.649 549 HG3 LYS 64 HG1 LYS 64 -6.260 -6.969 -5.885 550 HD2 LYS 64 HD2 LYS 64 -4.123 -6.969 -7.072 551 HD3 LYS 64 HD1 LYS 64 -3.449 -8.054 -5.851 552 HE2 LYS 64 HE2 LYS 64 -5.158 -9.727 -6.429 553 HE3 LYS 64 HE1 LYS 64 -5.779 -8.646 -7.674 554 HZ1 LYS 64 HZ1 LYS 64 -3.505 -8.731 -8.681 555 HZ2 LYS 64 HZ2 LYS 64 -4.361 -10.189 -8.733 556 HZ3 LYS 64 HZ3 LYS 64 -3.131 -9.974 -7.594 557 H ALA 65 HN ALA 65 -2.801 -3.867 -4.884 558 HA ALA 65 HA ALA 65 -3.094 -2.465 -2.503 559 HB1 ALA 65 HB1 ALA 65 -0.951 -3.217 -3.433 560 HB2 ALA 65 HB2 ALA 65 -0.922 -1.505 -3.000 561 HB3 ALA 65 HB3 ALA 65 -1.087 -1.988 -4.688 562 H LEU 66 HN LEU 66 -3.571 -1.494 -5.797 563 HA LEU 66 HA LEU 66 -3.822 1.317 -5.048 564 HB2 LEU 66 HB2 LEU 66 -3.728 -0.142 -7.644 565 HB3 LEU 66 HB1 LEU 66 -4.491 1.436 -7.595 566 HG LEU 66 HG LEU 66 -2.417 2.396 -6.698 567 HD11 LEU 66 HD11 LEU 66 -1.494 0.449 -5.617 568 HD12 LEU 66 HD12 LEU 66 -0.348 1.059 -6.815 569 HD13 LEU 66 HD13 LEU 66 -1.329 -0.367 -7.171 570 HD21 LEU 66 HD21 LEU 66 -2.877 2.447 -9.093 571 HD22 LEU 66 HD22 LEU 66 -2.075 0.888 -9.281 572 HD23 LEU 66 HD23 LEU 66 -1.149 2.301 -8.773 573 H ASN 67 HN ASN 67 -5.812 -1.377 -5.930 574 HA ASN 67 HA ASN 67 -8.213 0.145 -6.178 575 HB2 ASN 67 HB2 ASN 67 -7.619 -2.758 -6.022 576 HB3 ASN 67 HB1 ASN 67 -9.262 -2.202 -5.896 577 HD21 ASN 67 HD21 ASN 67 -6.890 -0.588 -7.857 578 HD22 ASN 67 HD22 ASN 67 -7.566 -1.034 -9.382 579 H LYS 68 HN LYS 68 -6.441 -1.210 -3.606 580 HA LYS 68 HA LYS 68 -8.548 -0.380 -1.727 581 HB2 LYS 68 HB2 LYS 68 -6.589 -2.660 -1.361 582 HB3 LYS 68 HB1 LYS 68 -7.773 -2.127 -0.177 583 HG2 LYS 68 HG2 LYS 68 -8.427 -3.248 -2.895 584 HG3 LYS 68 HG1 LYS 68 -8.471 -4.150 -1.380 585 HD2 LYS 68 HD2 LYS 68 -10.205 -2.685 -0.528 586 HD3 LYS 68 HD1 LYS 68 -10.119 -1.699 -1.987 587 HE2 LYS 68 HE2 LYS 68 -12.025 -3.238 -2.019 588 HE3 LYS 68 HE1 LYS 68 -10.885 -3.546 -3.327 589 HZ1 LYS 68 HZ1 LYS 68 -11.675 -5.583 -2.244 590 HZ2 LYS 68 HZ2 LYS 68 -10.990 -5.075 -0.785 591 HZ3 LYS 68 HZ3 LYS 68 -9.998 -5.404 -2.115 592 H GLY 69 HN GLY 69 -5.483 -1.537 -0.604 593 HA2 GLY 69 HA2 GLY 69 -3.681 -0.474 0.348 594 HA3 GLY 69 HA1 GLY 69 -4.140 0.978 -0.530 595 H ARG 70 HN ARG 70 -5.980 2.213 0.364 596 HA ARG 70 HA ARG 70 -5.676 2.520 3.223 597 HB2 ARG 70 HB2 ARG 70 -5.837 4.469 1.670 598 HB3 ARG 70 HB1 ARG 70 -7.489 3.999 1.301 599 HG2 ARG 70 HG2 ARG 70 -7.459 5.816 2.896 600 HG3 ARG 70 HG1 ARG 70 -8.108 4.357 3.647 601 HD2 ARG 70 HD2 ARG 70 -6.054 3.948 4.793 602 HD3 ARG 70 HD1 ARG 70 -5.234 5.222 3.894 603 HE ARG 70 HE ARG 70 -7.086 6.653 5.101 604 HH11 ARG 70 HH11 ARG 70 -5.156 4.042 6.413 605 HH12 ARG 70 HH12 ARG 70 -5.148 4.690 8.024 606 HH21 ARG 70 HH21 ARG 70 -7.041 7.524 7.219 607 HH22 ARG 70 HH22 ARG 70 -6.200 6.675 8.478 608 H ARG 71 HN ARG 71 -6.634 0.858 4.277 609 HA ARG 71 HA ARG 71 -9.531 0.555 3.926 610 HB2 ARG 71 HB2 ARG 71 -8.422 -1.310 2.764 611 HB3 ARG 71 HB1 ARG 71 -7.538 -1.703 4.231 612 HG2 ARG 71 HG2 ARG 71 -9.679 -2.197 5.353 613 HG3 ARG 71 HG1 ARG 71 -10.517 -1.885 3.831 614 HD2 ARG 71 HD2 ARG 71 -9.238 -3.677 2.763 615 HD3 ARG 71 HD1 ARG 71 -8.403 -3.986 4.281 616 HE ARG 71 HE ARG 71 -11.321 -4.231 4.196 617 HH11 ARG 71 HH11 ARG 71 -8.176 -5.709 4.560 618 HH12 ARG 71 HH12 ARG 71 -8.806 -7.255 5.019 619 HH21 ARG 71 HH21 ARG 71 -12.166 -6.262 4.812 620 HH22 ARG 71 HH22 ARG 71 -11.086 -7.570 5.166 621 H GLU 72 HN GLU 72 -9.951 1.722 5.785 622 HA GLU 72 HA GLU 72 -8.583 1.426 8.213 623 HB2 GLU 72 HB2 GLU 72 -11.450 2.290 7.808 624 HB3 GLU 72 HB1 GLU 72 -10.504 2.526 9.266 625 HG2 GLU 72 HG2 GLU 72 -10.266 4.572 8.339 626 HG3 GLU 72 HG1 GLU 72 -8.886 3.768 7.593 627 H GLU 73 HN GLU 73 -9.550 0.580 10.257 628 HA GLU 73 HA GLU 73 -9.850 -2.164 10.111 629 HB2 GLU 73 HB2 GLU 73 -10.608 -0.220 12.281 630 HB3 GLU 73 HB1 GLU 73 -10.774 -1.958 12.481 631 HG2 GLU 73 HG2 GLU 73 -8.721 -1.180 13.483 632 HG3 GLU 73 HG1 GLU 73 -8.374 -2.229 12.111 633 H LYS 74 HN LYS 74 -12.397 0.286 10.510 634 HA LYS 74 HA LYS 74 -14.329 -1.796 9.756 635 HB2 LYS 74 HB2 LYS 74 -16.074 -0.430 10.783 636 HB3 LYS 74 HB1 LYS 74 -14.811 -0.799 11.945 637 HG2 LYS 74 HG2 LYS 74 -13.956 1.401 11.859 638 HG3 LYS 74 HG1 LYS 74 -14.924 1.799 10.440 639 HD2 LYS 74 HD2 LYS 74 -15.935 2.808 12.373 640 HD3 LYS 74 HD1 LYS 74 -16.967 1.492 11.814 641 HE2 LYS 74 HE2 LYS 74 -16.829 1.402 14.209 642 HE3 LYS 74 HE1 LYS 74 -15.949 0.030 13.539 643 HZ1 LYS 74 HZ1 LYS 74 -14.757 2.549 14.558 644 HZ2 LYS 74 HZ2 LYS 74 -13.888 1.280 13.860 645 HZ3 LYS 74 HZ3 LYS 74 -14.705 1.040 15.317 646 H VAL 75 HN VAL 75 -15.073 -1.694 7.755 647 HA VAL 75 HA VAL 75 -14.991 0.774 6.231 648 HB VAL 75 HB VAL 75 -16.196 -1.915 5.515 649 HG11 VAL 75 HG11 VAL 75 -15.568 0.456 3.762 650 HG12 VAL 75 HG12 VAL 75 -17.178 -0.098 4.220 651 HG13 VAL 75 HG13 VAL 75 -16.152 -1.112 3.206 652 HG21 VAL 75 HG21 VAL 75 -14.185 -2.251 4.169 653 HG22 VAL 75 HG22 VAL 75 -13.788 -2.056 5.875 654 HG23 VAL 75 HG23 VAL 75 -13.534 -0.719 4.754 655 H GLY 76 HN GLY 76 -17.124 -1.107 8.140 656 HA2 GLY 76 HA2 GLY 76 -18.952 1.130 8.335 657 HA3 GLY 76 HA1 GLY 76 -19.651 -0.366 7.720 658 H LYS 77 HN LYS 77 -19.626 -2.231 9.049 659 HA LYS 77 HA LYS 77 -18.966 -1.778 11.880 660 HB2 LYS 77 HB2 LYS 77 -21.394 -3.229 10.811 661 HB3 LYS 77 HB1 LYS 77 -20.886 -3.265 12.489 662 HG2 LYS 77 HG2 LYS 77 -22.555 -1.679 12.496 663 HG3 LYS 77 HG1 LYS 77 -21.098 -0.696 12.371 664 HD2 LYS 77 HD2 LYS 77 -22.516 0.252 10.790 665 HD3 LYS 77 HD1 LYS 77 -21.497 -0.813 9.826 666 HE2 LYS 77 HE2 LYS 77 -24.231 -1.564 10.857 667 HE3 LYS 77 HE1 LYS 77 -23.937 -0.886 9.260 668 HZ1 LYS 77 HZ1 LYS 77 -22.976 -3.489 10.309 669 HZ2 LYS 77 HZ2 LYS 77 -22.451 -2.820 8.849 670 HZ3 LYS 77 HZ3 LYS 77 -24.075 -3.229 9.053 671 H LYS 78 HN LYS 78 -19.211 -3.913 9.162 672 HA LYS 78 HA LYS 78 -18.303 -5.886 8.601 673 HB2 LYS 78 HB2 LYS 78 -16.177 -4.846 9.330 674 HB3 LYS 78 HB1 LYS 78 -16.444 -5.474 10.949 675 HG2 LYS 78 HG2 LYS 78 -16.308 -7.744 10.129 676 HG3 LYS 78 HG1 LYS 78 -16.151 -7.162 8.475 677 HD2 LYS 78 HD2 LYS 78 -13.979 -7.794 9.282 678 HD3 LYS 78 HD1 LYS 78 -14.034 -6.041 9.121 679 HE2 LYS 78 HE2 LYS 78 -14.702 -7.258 11.758 680 HE3 LYS 78 HE1 LYS 78 -13.013 -7.200 11.260 681 HZ1 LYS 78 HZ1 LYS 78 -13.188 -4.815 11.014 682 HZ2 LYS 78 HZ2 LYS 78 -13.648 -5.267 12.579 683 HZ3 LYS 78 HZ3 LYS 78 -14.824 -4.852 11.441 684 H GLU 79 HN GLU 79 -17.602 -6.416 12.011 685 HA GLU 79 HA GLU 79 -19.674 -8.509 12.027 686 HB2 GLU 79 HB2 GLU 79 -16.892 -8.503 13.184 687 HB3 GLU 79 HB1 GLU 79 -18.127 -9.613 13.755 688 HG2 GLU 79 HG2 GLU 79 -17.203 -9.413 10.901 689 HG3 GLU 79 HG1 GLU 79 -16.604 -10.588 12.071 690 H LYS 80 HN LYS 80 -17.588 -6.982 14.451 691 HA LYS 80 HA LYS 80 -19.746 -5.636 15.755 692 HB2 LYS 80 HB2 LYS 80 -19.461 -6.858 17.932 693 HB3 LYS 80 HB1 LYS 80 -20.266 -7.780 16.673 694 HG2 LYS 80 HG2 LYS 80 -18.325 -9.098 16.282 695 HG3 LYS 80 HG1 LYS 80 -17.339 -8.053 17.310 696 HD2 LYS 80 HD2 LYS 80 -18.485 -8.761 19.270 697 HD3 LYS 80 HD1 LYS 80 -19.729 -9.576 18.324 698 HE2 LYS 80 HE2 LYS 80 -16.828 -10.376 18.276 699 HE3 LYS 80 HE1 LYS 80 -18.003 -11.073 19.392 700 HZ1 LYS 80 HZ1 LYS 80 -17.727 -12.446 17.429 701 HZ2 LYS 80 HZ2 LYS 80 -18.170 -11.162 16.425 702 HZ3 LYS 80 HZ3 LYS 80 -19.298 -11.827 17.494 703 H ILE 81 HN ILE 81 -19.014 -4.280 17.454 704 HA ILE 81 HA ILE 81 -16.473 -3.176 17.052 705 HB ILE 81 HB ILE 81 -18.290 -1.839 17.929 706 HG12 ILE 81 HG12 ILE 81 -16.065 -2.080 19.962 707 HG13 ILE 81 HG11 ILE 81 -15.980 -1.163 18.463 708 HG21 ILE 81 HG21 ILE 81 -19.098 -2.094 20.227 709 HG22 ILE 81 HG22 ILE 81 -18.111 -3.544 20.406 710 HG23 ILE 81 HG23 ILE 81 -19.440 -3.519 19.245 711 HD11 ILE 81 HD11 ILE 81 -17.843 -0.623 20.763 712 HD12 ILE 81 HD12 ILE 81 -17.765 0.297 19.261 713 HD13 ILE 81 HD13 ILE 81 -16.386 0.288 20.361 714 H GLY 82 HN GLY 82 -14.533 -3.600 17.868 715 HA2 GLY 82 HA2 GLY 82 -13.194 -4.331 19.811 716 HA3 GLY 82 HA1 GLY 82 -14.360 -5.633 20.007 717 H LYS 83 HN LYS 83 -14.494 -5.883 17.018 718 HA LYS 83 HA LYS 83 -12.085 -7.526 16.731 719 HB2 LYS 83 HB2 LYS 83 -14.763 -7.641 15.343 720 HB3 LYS 83 HB1 LYS 83 -13.378 -8.607 14.850 721 HG2 LYS 83 HG2 LYS 83 -14.757 -8.707 17.526 722 HG3 LYS 83 HG1 LYS 83 -14.873 -9.907 16.237 723 HD2 LYS 83 HD2 LYS 83 -12.431 -10.278 16.425 724 HD3 LYS 83 HD1 LYS 83 -12.397 -9.163 17.790 725 HE2 LYS 83 HE2 LYS 83 -14.010 -10.640 18.966 726 HE3 LYS 83 HE1 LYS 83 -13.875 -11.784 17.630 727 HZ1 LYS 83 HZ1 LYS 83 -12.413 -12.409 19.430 728 HZ2 LYS 83 HZ2 LYS 83 -11.661 -10.897 19.395 729 HZ3 LYS 83 HZ3 LYS 83 -11.495 -11.953 18.086 730 H LYS 84 HN LYS 84 -10.549 -6.272 15.917 731 HA LYS 84 HA LYS 84 -11.047 -5.082 13.280 732 HB2 LYS 84 HB2 LYS 84 -9.489 -3.227 13.901 733 HB3 LYS 84 HB1 LYS 84 -11.005 -3.215 14.790 734 HG2 LYS 84 HG2 LYS 84 -9.952 -4.066 16.749 735 HG3 LYS 84 HG1 LYS 84 -8.455 -4.386 15.872 736 HD2 LYS 84 HD2 LYS 84 -8.264 -2.368 17.234 737 HD3 LYS 84 HD1 LYS 84 -8.144 -1.988 15.516 738 HE2 LYS 84 HE2 LYS 84 -10.448 -1.238 15.492 739 HE3 LYS 84 HE1 LYS 84 -10.642 -1.699 17.182 740 HZ1 LYS 84 HZ1 LYS 84 -8.804 0.393 16.152 741 HZ2 LYS 84 HZ2 LYS 84 -8.965 -0.055 17.775 742 HZ3 LYS 84 HZ3 LYS 84 -10.260 0.669 16.966 743 H LYS 85 HN LYS 85 -10.029 -7.628 13.823 744 HA LYS 85 HA LYS 85 -7.136 -7.516 13.722 745 HB2 LYS 85 HB2 LYS 85 -8.485 -9.279 14.960 746 HB3 LYS 85 HB1 LYS 85 -8.914 -9.937 13.389 747 HG2 LYS 85 HG2 LYS 85 -6.543 -10.348 12.921 748 HG3 LYS 85 HG1 LYS 85 -6.128 -9.708 14.514 749 HD2 LYS 85 HD2 LYS 85 -7.553 -11.466 15.533 750 HD3 LYS 85 HD1 LYS 85 -7.819 -12.135 13.925 751 HE2 LYS 85 HE2 LYS 85 -5.144 -11.851 15.288 752 HE3 LYS 85 HE1 LYS 85 -6.072 -13.343 15.160 753 HZ1 LYS 85 HZ1 LYS 85 -4.905 -11.789 12.918 754 HZ2 LYS 85 HZ2 LYS 85 -5.890 -13.150 12.729 755 HZ3 LYS 85 HZ3 LYS 85 -4.386 -13.295 13.482 756 H ARG 86 HN ARG 86 -7.624 -6.117 11.690 757 HA ARG 86 HA ARG 86 -7.187 -5.816 9.489 758 HB2 ARG 86 HB2 ARG 86 -5.462 -7.544 9.731 759 HB3 ARG 86 HB1 ARG 86 -6.660 -8.791 9.424 760 HG2 ARG 86 HG2 ARG 86 -7.023 -7.849 7.175 761 HG3 ARG 86 HG1 ARG 86 -5.747 -6.672 7.492 762 HD2 ARG 86 HD2 ARG 86 -4.900 -8.560 6.201 763 HD3 ARG 86 HD1 ARG 86 -4.139 -8.482 7.788 764 HE ARG 86 HE ARG 86 -6.272 -10.184 8.094 765 HH11 ARG 86 HH11 ARG 86 -3.406 -10.080 6.086 766 HH12 ARG 86 HH12 ARG 86 -3.284 -11.803 5.947 767 HH21 ARG 86 HH21 ARG 86 -6.118 -12.455 7.913 768 HH22 ARG 86 HH22 ARG 86 -4.825 -13.155 6.995 769 H GLN 87 HN GLN 87 -8.846 -8.967 9.687 770 HA GLN 87 HA GLN 87 -11.128 -7.856 8.256 771 HB2 GLN 87 HB2 GLN 87 -11.138 -9.684 6.606 772 HB3 GLN 87 HB1 GLN 87 -9.699 -8.686 6.448 773 HG2 GLN 87 HG2 GLN 87 -8.342 -10.339 7.487 774 HG3 GLN 87 HG1 GLN 87 -9.752 -11.282 7.964 775 HE21 GLN 87 HE21 GLN 87 -8.954 -13.110 6.913 776 HE22 GLN 87 HE22 GLN 87 -8.973 -13.256 5.186 777 H LYS 88 HN LYS 88 -12.856 -9.656 8.059 778 HA LYS 88 HA LYS 88 -13.023 -11.065 10.589 779 HB2 LYS 88 HB2 LYS 88 -15.275 -11.734 9.812 780 HB3 LYS 88 HB1 LYS 88 -15.047 -9.994 9.773 781 HG2 LYS 88 HG2 LYS 88 -14.745 -10.052 7.376 782 HG3 LYS 88 HG1 LYS 88 -14.848 -11.814 7.380 783 HD2 LYS 88 HD2 LYS 88 -17.140 -11.680 8.221 784 HD3 LYS 88 HD1 LYS 88 -17.036 -9.920 8.238 785 HE2 LYS 88 HE2 LYS 88 -16.706 -11.607 5.764 786 HE3 LYS 88 HE1 LYS 88 -18.231 -10.880 6.262 787 HZ1 LYS 88 HZ1 LYS 88 -17.076 -9.536 4.614 788 HZ2 LYS 88 HZ2 LYS 88 -15.742 -9.381 5.642 789 HZ3 LYS 88 HZ3 LYS 88 -17.229 -8.703 6.077 790 H LYS 89 HN LYS 89 -13.526 -13.380 10.639 791 HA LYS 89 HA LYS 89 -11.576 -14.851 9.212 792 HB2 LYS 89 HB2 LYS 89 -12.391 -15.411 11.494 793 HB3 LYS 89 HB1 LYS 89 -13.929 -15.892 10.799 794 HG2 LYS 89 HG2 LYS 89 -12.752 -17.624 9.486 795 HG3 LYS 89 HG1 LYS 89 -11.254 -17.179 10.302 796 HD2 LYS 89 HD2 LYS 89 -13.701 -17.980 11.847 797 HD3 LYS 89 HD1 LYS 89 -12.593 -19.187 11.203 798 HE2 LYS 89 HE2 LYS 89 -11.981 -18.773 13.468 799 HE3 LYS 89 HE1 LYS 89 -10.748 -18.050 12.441 800 HZ1 LYS 89 HZ1 LYS 89 -12.988 -16.527 13.648 801 HZ2 LYS 89 HZ2 LYS 89 -11.636 -15.899 12.851 802 HZ3 LYS 89 HZ3 LYS 89 -11.456 -16.660 14.345 803 H ARG 90 HN ARG 90 -11.846 -14.905 7.043 804 HA ARG 90 HA ARG 90 -14.453 -15.647 5.961 805 HB2 ARG 90 HB2 ARG 90 -11.963 -14.601 4.609 806 HB3 ARG 90 HB1 ARG 90 -13.441 -15.038 3.761 807 HG2 ARG 90 HG2 ARG 90 -14.648 -13.344 5.123 808 HG3 ARG 90 HG1 ARG 90 -13.094 -12.848 5.794 809 HD2 ARG 90 HD2 ARG 90 -13.728 -12.867 2.852 810 HD3 ARG 90 HD1 ARG 90 -13.913 -11.455 3.886 811 HE ARG 90 HE ARG 90 -11.421 -11.820 4.338 812 HH11 ARG 90 HH11 ARG 90 -12.962 -12.662 1.311 813 HH12 ARG 90 HH12 ARG 90 -11.575 -12.261 0.350 814 HH21 ARG 90 HH21 ARG 90 -9.603 -11.277 3.082 815 HH22 ARG 90 HH22 ARG 90 -9.657 -11.477 1.356 816 H LYS 91 HN LYS 91 -11.112 -16.455 4.988 817 HA LYS 91 HA LYS 91 -11.823 -19.273 4.974 818 HB2 LYS 91 HB2 LYS 91 -11.107 -19.551 2.623 819 HB3 LYS 91 HB1 LYS 91 -12.552 -18.565 2.782 820 HG2 LYS 91 HG2 LYS 91 -11.160 -16.542 2.544 821 HG3 LYS 91 HG1 LYS 91 -9.753 -17.576 2.283 822 HD2 LYS 91 HD2 LYS 91 -10.934 -18.591 0.341 823 HD3 LYS 91 HD1 LYS 91 -12.233 -17.419 0.571 824 HE2 LYS 91 HE2 LYS 91 -10.727 -16.657 -1.163 825 HE3 LYS 91 HE1 LYS 91 -10.621 -15.593 0.238 826 HZ1 LYS 91 HZ1 LYS 91 -8.596 -16.691 0.900 827 HZ2 LYS 91 HZ2 LYS 91 -8.443 -16.141 -0.691 828 HZ3 LYS 91 HZ3 LYS 91 -8.715 -17.781 -0.386 829 H ALA 92 HN ALA 92 -9.839 -20.513 3.970 830 HA ALA 92 HA ALA 92 -7.701 -21.200 4.183 831 HB1 ALA 92 HB1 ALA 92 -5.880 -19.585 4.249 832 HB2 ALA 92 HB2 ALA 92 -7.029 -18.288 4.580 833 HB3 ALA 92 HB3 ALA 92 -7.080 -19.139 3.037 834 H ALA 93 HN ALA 93 -7.493 -18.488 6.462 835 HA ALA 93 HA ALA 93 -6.610 -20.356 8.518 836 HB1 ALA 93 HB1 ALA 93 -6.691 -17.338 8.530 837 HB2 ALA 93 HB2 ALA 93 -5.287 -18.332 8.142 838 HB3 ALA 93 HB3 ALA 93 -5.962 -18.359 9.771 839 H GLN 94 HN GLN 94 -8.848 -21.243 8.557 840 HA GLN 94 HA GLN 94 -10.774 -19.531 9.942 841 HB2 GLN 94 HB2 GLN 94 -11.196 -22.275 8.753 842 HB3 GLN 94 HB1 GLN 94 -12.442 -21.187 9.344 843 HG2 GLN 94 HG2 GLN 94 -11.936 -19.603 7.582 844 HG3 GLN 94 HG1 GLN 94 -10.622 -20.631 7.013 845 HE21 GLN 94 HE21 GLN 94 -13.726 -21.806 8.136 846 HE22 GLN 94 HE22 GLN 94 -14.264 -22.394 6.601 847 H LYS 95 HN LYS 95 -9.966 -23.005 10.147 848 HA LYS 95 HA LYS 95 -10.148 -22.728 13.073 849 HB2 LYS 95 HB2 LYS 95 -10.766 -25.139 11.357 850 HB3 LYS 95 HB1 LYS 95 -10.809 -25.112 13.113 851 HG2 LYS 95 HG2 LYS 95 -12.592 -23.432 13.035 852 HG3 LYS 95 HG1 LYS 95 -12.561 -23.496 11.272 853 HD2 LYS 95 HD2 LYS 95 -14.375 -24.865 12.126 854 HD3 LYS 95 HD1 LYS 95 -13.150 -25.887 11.370 855 HE2 LYS 95 HE2 LYS 95 -12.233 -26.425 13.561 856 HE3 LYS 95 HE1 LYS 95 -13.418 -25.372 14.330 857 HZ1 LYS 95 HZ1 LYS 95 -14.084 -27.684 14.449 858 HZ2 LYS 95 HZ2 LYS 95 -14.031 -27.819 12.765 859 HZ3 LYS 95 HZ3 LYS 95 -15.173 -26.810 13.497 860 H ARG 96 HN ARG 96 -9.006 -25.540 11.330 861 HA ARG 96 HA ARG 96 -6.222 -24.906 11.907 862 HB2 ARG 96 HB2 ARG 96 -7.006 -26.084 13.926 863 HB3 ARG 96 HB1 ARG 96 -7.569 -27.418 12.932 864 HG2 ARG 96 HG2 ARG 96 -5.285 -27.880 12.233 865 HG3 ARG 96 HG1 ARG 96 -4.707 -26.528 13.207 866 HD2 ARG 96 HD2 ARG 96 -5.511 -27.623 15.226 867 HD3 ARG 96 HD1 ARG 96 -6.147 -28.958 14.266 868 HE ARG 96 HE ARG 96 -3.541 -28.925 13.582 869 HH11 ARG 96 HH11 ARG 96 -5.171 -28.951 16.683 870 HH12 ARG 96 HH12 ARG 96 -3.894 -29.811 17.486 871 HH21 ARG 96 HH21 ARG 96 -1.867 -30.068 14.637 872 HH22 ARG 96 HH22 ARG 96 -2.019 -30.443 16.326 873 H LYS 97 HN LYS 97 -8.496 -27.340 10.714 874 HA LYS 97 HA LYS 97 -6.625 -28.020 8.570 875 HB2 LYS 97 HB2 LYS 97 -7.664 -29.862 9.890 876 HB3 LYS 97 HB1 LYS 97 -9.244 -29.337 9.328 877 HG2 LYS 97 HG2 LYS 97 -8.566 -31.209 8.021 878 HG3 LYS 97 HG1 LYS 97 -8.493 -29.774 7.001 879 HD2 LYS 97 HD2 LYS 97 -6.509 -30.833 6.482 880 HD3 LYS 97 HD1 LYS 97 -5.998 -29.703 7.733 881 HE2 LYS 97 HE2 LYS 97 -6.645 -32.619 8.148 882 HE3 LYS 97 HE1 LYS 97 -5.028 -31.937 8.036 883 HZ1 LYS 97 HZ1 LYS 97 -7.029 -31.442 10.171 884 HZ2 LYS 97 HZ2 LYS 97 -5.580 -30.586 10.026 885 HZ3 LYS 97 HZ3 LYS 97 -5.551 -32.250 10.315 886 H ASN 98 HN ASN 98 -6.815 -26.691 6.864 887 HA ASN 98 HA ASN 98 -9.305 -25.410 6.232 888 HB2 ASN 98 HB2 ASN 98 -8.116 -24.405 4.342 889 HB3 ASN 98 HB1 ASN 98 -7.194 -24.229 5.828 890 HD21 ASN 98 HD21 ASN 98 -7.327 -25.672 2.692 891 HD22 ASN 98 HD22 ASN 98 -5.710 -26.284 2.679 Start of MODEL 6 1 H1 LYS 1 HT1 LYS 1 0.693 17.246 -1.492 2 H2 LYS 1 HT2 LYS 1 0.490 16.069 -0.297 3 H3 LYS 1 HT3 LYS 1 1.880 16.066 -1.259 4 HA LYS 1 HA LYS 1 1.121 18.156 0.690 5 HB2 LYS 1 HB2 LYS 1 3.306 16.065 0.746 6 HB3 LYS 1 HB1 LYS 1 3.162 17.385 1.895 7 HG2 LYS 1 HG2 LYS 1 0.954 16.489 2.575 8 HG3 LYS 1 HG1 LYS 1 1.227 15.114 1.501 9 HD2 LYS 1 HD2 LYS 1 3.226 14.512 2.759 10 HD3 LYS 1 HD1 LYS 1 2.996 15.908 3.812 11 HE2 LYS 1 HE2 LYS 1 0.791 14.956 4.474 12 HE3 LYS 1 HE1 LYS 1 1.183 13.514 3.538 13 HZ1 LYS 1 HZ1 LYS 1 1.696 13.201 5.871 14 HZ2 LYS 1 HZ2 LYS 1 2.715 14.549 5.866 15 HZ3 LYS 1 HZ3 LYS 1 3.123 13.180 4.960 16 HA PRO 2 HA PRO 2 3.759 20.470 -2.144 17 HB2 PRO 2 HB2 PRO 2 3.273 22.901 -1.089 18 HB3 PRO 2 HB1 PRO 2 2.106 22.078 -2.131 19 HG2 PRO 2 HG2 PRO 2 2.180 22.252 0.852 20 HG3 PRO 2 HG1 PRO 2 0.798 22.453 -0.239 21 HD2 PRO 2 HD2 PRO 2 1.285 20.147 1.107 22 HD3 PRO 2 HD1 PRO 2 0.515 20.181 -0.492 23 H VAL 3 HN VAL 3 5.858 20.821 -1.965 24 HA VAL 3 HA VAL 3 7.952 20.814 -1.076 25 HB VAL 3 HB VAL 3 6.812 22.850 0.832 26 HG11 VAL 3 HG11 VAL 3 9.058 23.820 0.748 27 HG12 VAL 3 HG12 VAL 3 9.577 22.519 -0.325 28 HG13 VAL 3 HG13 VAL 3 9.095 22.156 1.332 29 HG21 VAL 3 HG21 VAL 3 7.803 23.282 -1.981 30 HG22 VAL 3 HG22 VAL 3 7.310 24.542 -0.851 31 HG23 VAL 3 HG23 VAL 3 6.123 23.382 -1.452 32 H SER 4 HN SER 4 7.361 18.603 -0.257 33 HA SER 4 HA SER 4 7.875 18.500 2.618 34 HB2 SER 4 HB2 SER 4 5.755 16.843 1.223 35 HB3 SER 4 HB1 SER 4 6.201 16.746 2.927 36 HG SER 4 HG SER 4 5.597 19.286 2.167 37 H LEU 5 HN LEU 5 7.524 15.529 2.506 38 HA LEU 5 HA LEU 5 10.198 14.967 1.655 39 HB2 LEU 5 HB2 LEU 5 8.075 13.098 2.712 40 HB3 LEU 5 HB1 LEU 5 9.756 12.681 2.463 41 HG LEU 5 HG LEU 5 9.657 13.045 4.745 42 HD11 LEU 5 HD11 LEU 5 10.843 15.100 5.216 43 HD12 LEU 5 HD12 LEU 5 10.373 15.754 3.647 44 HD13 LEU 5 HD13 LEU 5 11.453 14.361 3.736 45 HD21 LEU 5 HD21 LEU 5 8.455 14.866 5.831 46 HD22 LEU 5 HD22 LEU 5 7.377 13.887 4.841 47 HD23 LEU 5 HD23 LEU 5 7.920 15.460 4.261 48 H SER 6 HN SER 6 7.303 13.025 0.967 49 HA SER 6 HA SER 6 6.751 11.747 -0.831 50 HB2 SER 6 HB2 SER 6 6.246 14.070 -1.664 51 HB3 SER 6 HB1 SER 6 7.826 14.073 -2.446 52 HG SER 6 HG SER 6 7.164 12.347 -3.721 53 H TYR 7 HN TYR 7 9.264 11.244 0.282 54 HA TYR 7 HA TYR 7 10.545 9.747 -1.748 55 HB2 TYR 7 HB2 TYR 7 11.461 12.016 -2.239 56 HB3 TYR 7 HB1 TYR 7 12.103 12.059 -0.603 57 HD1 TYR 7 HD1 TYR 7 12.397 10.427 -3.899 58 HD2 TYR 7 HD2 TYR 7 14.121 10.916 -0.039 59 HE1 TYR 7 HE1 TYR 7 14.450 9.327 -4.683 60 HE2 TYR 7 HE2 TYR 7 16.178 9.821 -0.817 61 HH TYR 7 HH TYR 7 16.844 9.249 -4.085 62 H ARG 8 HN ARG 8 11.342 11.394 1.197 63 HA ARG 8 HA ARG 8 12.367 9.032 2.480 64 HB2 ARG 8 HB2 ARG 8 11.810 11.830 3.448 65 HB3 ARG 8 HB1 ARG 8 12.347 10.557 4.535 66 HG2 ARG 8 HG2 ARG 8 13.929 11.059 2.071 67 HG3 ARG 8 HG1 ARG 8 14.042 12.220 3.392 68 HD2 ARG 8 HD2 ARG 8 15.793 10.503 3.509 69 HD3 ARG 8 HD1 ARG 8 14.736 10.476 4.915 70 HE ARG 8 HE ARG 8 13.614 8.536 3.775 71 HH11 ARG 8 HH11 ARG 8 16.969 9.324 3.136 72 HH12 ARG 8 HH12 ARG 8 17.418 7.688 2.784 73 HH21 ARG 8 HH21 ARG 8 14.206 6.384 3.312 74 HH22 ARG 8 HH22 ARG 8 15.849 6.010 2.904 75 H CYS 9 HN CYS 9 10.231 8.054 1.767 76 HA CYS 9 HA CYS 9 7.965 8.508 3.508 77 HB2 CYS 9 HB2 CYS 9 8.472 6.565 1.253 78 HB3 CYS 9 HB1 CYS 9 6.941 6.813 2.063 79 HA PRO 10 HA PRO 10 8.164 5.455 6.665 80 HB2 PRO 10 HB2 PRO 10 6.280 3.851 5.004 81 HB3 PRO 10 HB1 PRO 10 6.241 4.180 6.738 82 HG2 PRO 10 HG2 PRO 10 4.712 5.542 5.012 83 HG3 PRO 10 HG1 PRO 10 5.395 6.274 6.466 84 HD2 PRO 10 HD2 PRO 10 6.085 6.759 3.660 85 HD3 PRO 10 HD1 PRO 10 6.442 7.740 5.090 86 H CYS 11 HN CYS 11 7.916 3.760 3.536 87 HA CYS 11 HA CYS 11 9.607 1.623 4.549 88 HB2 CYS 11 HB2 CYS 11 7.555 1.751 2.651 89 HB3 CYS 11 HB1 CYS 11 9.017 1.455 1.721 90 H ARG 12 HN ARG 12 11.592 1.096 3.819 91 HA ARG 12 HA ARG 12 13.214 3.176 2.712 92 HB2 ARG 12 HB2 ARG 12 13.975 0.289 3.186 93 HB3 ARG 12 HB1 ARG 12 15.065 1.655 2.973 94 HG2 ARG 12 HG2 ARG 12 13.208 1.181 5.295 95 HG3 ARG 12 HG1 ARG 12 14.969 1.055 5.300 96 HD2 ARG 12 HD2 ARG 12 15.141 3.438 4.804 97 HD3 ARG 12 HD1 ARG 12 13.385 3.565 4.771 98 HE ARG 12 HE ARG 12 14.675 2.629 7.226 99 HH11 ARG 12 HH11 ARG 12 12.962 5.146 5.501 100 HH12 ARG 12 HH12 ARG 12 12.570 6.037 6.934 101 HH21 ARG 12 HH21 ARG 12 14.159 3.807 9.120 102 HH22 ARG 12 HH22 ARG 12 13.239 5.274 8.990 103 H PHE 13 HN PHE 13 14.957 1.931 1.006 104 HA PHE 13 HA PHE 13 13.358 2.079 -1.371 105 HB2 PHE 13 HB2 PHE 13 16.308 1.443 -1.092 106 HB3 PHE 13 HB1 PHE 13 15.482 1.947 -2.564 107 HD1 PHE 13 HD1 PHE 13 14.988 4.251 -2.978 108 HD2 PHE 13 HD2 PHE 13 16.642 3.034 0.746 109 HE1 PHE 13 HE1 PHE 13 15.436 6.595 -2.415 110 HE2 PHE 13 HE2 PHE 13 17.092 5.364 1.320 111 HZ PHE 13 HZ PHE 13 16.493 7.166 -0.260 112 H PHE 14 HN PHE 14 13.148 0.443 -2.942 113 HA PHE 14 HA PHE 14 12.389 -1.923 -1.537 114 HB2 PHE 14 HB2 PHE 14 11.951 -1.213 -4.429 115 HB3 PHE 14 HB1 PHE 14 11.018 -2.301 -3.427 116 HD1 PHE 14 HD1 PHE 14 9.644 -1.384 -1.554 117 HD2 PHE 14 HD2 PHE 14 11.460 1.086 -4.498 118 HE1 PHE 14 HE1 PHE 14 8.111 0.437 -0.963 119 HE2 PHE 14 HE2 PHE 14 9.933 2.920 -3.907 120 HZ PHE 14 HZ PHE 14 8.294 2.628 -2.124 121 H GLU 15 HN GLU 15 12.846 -4.015 -2.078 122 HA GLU 15 HA GLU 15 15.340 -4.474 -3.548 123 HB2 GLU 15 HB2 GLU 15 13.698 -6.315 -1.791 124 HB3 GLU 15 HB1 GLU 15 15.230 -6.734 -2.538 125 HG2 GLU 15 HG2 GLU 15 14.905 -4.490 -0.572 126 HG3 GLU 15 HG1 GLU 15 15.317 -6.137 -0.110 127 H SER 16 HN SER 16 15.231 -5.198 -5.597 128 HA SER 16 HA SER 16 12.698 -6.283 -6.576 129 HB2 SER 16 HB2 SER 16 15.206 -5.412 -8.037 130 HB3 SER 16 HB1 SER 16 13.791 -6.096 -8.834 131 HG SER 16 HG SER 16 13.985 -3.666 -7.390 132 H HIS 17 HN HIS 17 14.236 -7.866 -4.795 133 HA HIS 17 HA HIS 17 14.822 -10.146 -6.561 134 HB2 HIS 17 HB2 HIS 17 16.908 -9.128 -5.591 135 HB3 HIS 17 HB1 HIS 17 16.296 -9.529 -3.993 136 HD1 HIS 17 HD1 HIS 17 17.540 -11.179 -7.153 137 HD2 HIS 17 HD2 HIS 17 16.741 -12.122 -3.185 138 HE1 HIS 17 HE1 HIS 17 18.422 -13.507 -6.820 139 HE2 HIS 17 HE2 HIS 17 18.011 -14.023 -4.390 140 H ILE 18 HN ILE 18 13.001 -8.850 -4.127 141 HA ILE 18 HA ILE 18 12.521 -11.121 -2.497 142 HB ILE 18 HB ILE 18 10.884 -8.644 -2.995 143 HG12 ILE 18 HG12 ILE 18 12.599 -9.407 -0.640 144 HG13 ILE 18 HG11 ILE 18 13.122 -8.348 -1.941 145 HG21 ILE 18 HG21 ILE 18 10.496 -10.765 -0.897 146 HG22 ILE 18 HG22 ILE 18 9.417 -10.418 -2.251 147 HG23 ILE 18 HG23 ILE 18 9.635 -9.225 -0.966 148 HD11 ILE 18 HD11 ILE 18 10.842 -7.824 -0.049 149 HD12 ILE 18 HD12 ILE 18 11.377 -6.756 -1.344 150 HD13 ILE 18 HD13 ILE 18 12.443 -7.082 0.024 151 H ALA 19 HN ALA 19 11.010 -12.697 -2.672 152 HA ALA 19 HA ALA 19 9.539 -12.838 -5.224 153 HB1 ALA 19 HB1 ALA 19 11.456 -14.411 -5.047 154 HB2 ALA 19 HB2 ALA 19 9.898 -15.213 -5.243 155 HB3 ALA 19 HB3 ALA 19 10.661 -15.154 -3.656 156 H ARG 20 HN ARG 20 7.513 -13.864 -5.213 157 HA ARG 20 HA ARG 20 5.851 -13.437 -2.993 158 HB2 ARG 20 HB2 ARG 20 5.309 -13.656 -5.511 159 HB3 ARG 20 HB1 ARG 20 5.277 -15.388 -5.201 160 HG2 ARG 20 HG2 ARG 20 3.491 -15.098 -3.599 161 HG3 ARG 20 HG1 ARG 20 3.562 -13.347 -3.819 162 HD2 ARG 20 HD2 ARG 20 1.768 -14.128 -5.166 163 HD3 ARG 20 HD1 ARG 20 3.110 -13.734 -6.247 164 HE ARG 20 HE ARG 20 3.196 -16.464 -5.514 165 HH11 ARG 20 HH11 ARG 20 1.459 -14.224 -7.557 166 HH12 ARG 20 HH12 ARG 20 0.990 -15.430 -8.710 167 HH21 ARG 20 HH21 ARG 20 2.592 -18.063 -7.035 168 HH22 ARG 20 HH22 ARG 20 1.630 -17.620 -8.409 169 H ALA 21 HN ALA 21 7.678 -16.151 -4.127 170 HA ALA 21 HA ALA 21 6.440 -18.040 -2.337 171 HB1 ALA 21 HB1 ALA 21 8.868 -18.347 -4.092 172 HB2 ALA 21 HB2 ALA 21 7.213 -18.742 -4.553 173 HB3 ALA 21 HB3 ALA 21 8.010 -19.648 -3.267 174 H ASN 22 HN ASN 22 8.650 -15.632 -1.952 175 HA ASN 22 HA ASN 22 9.935 -17.070 0.266 176 HB2 ASN 22 HB2 ASN 22 11.194 -15.674 -1.804 177 HB3 ASN 22 HB1 ASN 22 11.244 -14.595 -0.427 178 HD21 ASN 22 HD21 ASN 22 13.392 -16.076 -1.763 179 HD22 ASN 22 HD22 ASN 22 14.150 -17.005 -0.520 180 H VAL 23 HN VAL 23 7.490 -15.073 -0.300 181 HA VAL 23 HA VAL 23 8.143 -13.350 1.973 182 HB VAL 23 HB VAL 23 7.619 -12.107 -0.038 183 HG11 VAL 23 HG11 VAL 23 6.153 -13.697 -1.153 184 HG12 VAL 23 HG12 VAL 23 5.353 -12.128 -0.980 185 HG13 VAL 23 HG13 VAL 23 4.930 -13.458 0.103 186 HG21 VAL 23 HG21 VAL 23 5.410 -11.874 1.968 187 HG22 VAL 23 HG22 VAL 23 5.996 -10.617 0.879 188 HG23 VAL 23 HG23 VAL 23 7.036 -11.231 2.168 189 H LYS 24 HN LYS 24 6.886 -13.119 3.621 190 HA LYS 24 HA LYS 24 4.696 -14.991 4.057 191 HB2 LYS 24 HB2 LYS 24 6.148 -13.214 6.028 192 HB3 LYS 24 HB1 LYS 24 4.917 -14.401 6.422 193 HG2 LYS 24 HG2 LYS 24 6.535 -16.055 5.251 194 HG3 LYS 24 HG1 LYS 24 7.727 -14.798 5.594 195 HD2 LYS 24 HD2 LYS 24 5.919 -15.610 7.796 196 HD3 LYS 24 HD1 LYS 24 7.172 -16.743 7.321 197 HE2 LYS 24 HE2 LYS 24 8.855 -14.998 7.631 198 HE3 LYS 24 HE1 LYS 24 7.590 -13.879 8.142 199 HZ1 LYS 24 HZ1 LYS 24 8.377 -16.392 9.510 200 HZ2 LYS 24 HZ2 LYS 24 7.092 -15.403 9.983 201 HZ3 LYS 24 HZ3 LYS 24 8.679 -14.818 10.056 202 H HIS 25 HN HIS 25 3.549 -13.419 6.110 203 HA HIS 25 HA HIS 25 1.462 -12.099 5.127 204 HB2 HIS 25 HB2 HIS 25 2.821 -10.493 7.200 205 HB3 HIS 25 HB1 HIS 25 1.174 -11.102 7.172 206 HD1 HIS 25 HD1 HIS 25 2.835 -11.089 9.712 207 HD2 HIS 25 HD2 HIS 25 2.666 -14.377 7.165 208 HE1 HIS 25 HE1 HIS 25 3.463 -13.066 11.109 209 HE2 HIS 25 HE2 HIS 25 3.142 -15.062 9.610 210 H LEU 26 HN LEU 26 1.419 -10.729 3.439 211 HA LEU 26 HA LEU 26 3.519 -8.699 3.240 212 HB2 LEU 26 HB2 LEU 26 2.614 -10.445 1.360 213 HB3 LEU 26 HB1 LEU 26 1.672 -9.027 0.973 214 HG LEU 26 HG LEU 26 4.677 -9.231 1.066 215 HD11 LEU 26 HD11 LEU 26 4.591 -8.842 -1.321 216 HD12 LEU 26 HD12 LEU 26 2.825 -8.773 -1.265 217 HD13 LEU 26 HD13 LEU 26 3.659 -10.284 -0.898 218 HD21 LEU 26 HD21 LEU 26 4.447 -6.904 0.002 219 HD22 LEU 26 HD22 LEU 26 4.313 -7.079 1.752 220 HD23 LEU 26 HD23 LEU 26 2.856 -6.893 0.767 221 H LYS 27 HN LYS 27 3.018 -6.593 2.994 222 HA LYS 27 HA LYS 27 0.262 -5.724 3.451 223 HB2 LYS 27 HB2 LYS 27 1.075 -6.151 5.672 224 HB3 LYS 27 HB1 LYS 27 2.555 -5.271 5.351 225 HG2 LYS 27 HG2 LYS 27 1.169 -3.906 6.705 226 HG3 LYS 27 HG1 LYS 27 1.194 -3.220 5.073 227 HD2 LYS 27 HD2 LYS 27 -0.972 -4.086 4.595 228 HD3 LYS 27 HD1 LYS 27 -0.967 -5.087 6.046 229 HE2 LYS 27 HE2 LYS 27 -2.391 -3.162 6.375 230 HE3 LYS 27 HE1 LYS 27 -0.981 -3.054 7.424 231 HZ1 LYS 27 HZ1 LYS 27 -1.597 -0.953 6.282 232 HZ2 LYS 27 HZ2 LYS 27 -1.181 -1.673 4.806 233 HZ3 LYS 27 HZ3 LYS 27 -0.005 -1.451 6.004 234 H ILE 28 HN ILE 28 -0.115 -3.632 2.760 235 HA ILE 28 HA ILE 28 2.199 -2.254 1.579 236 HB ILE 28 HB ILE 28 -0.666 -1.629 0.906 237 HG12 ILE 28 HG12 ILE 28 0.205 -3.083 -1.220 238 HG13 ILE 28 HG11 ILE 28 0.969 -3.948 0.100 239 HG21 ILE 28 HG21 ILE 28 0.953 0.031 0.249 240 HG22 ILE 28 HG22 ILE 28 0.374 -0.810 -1.188 241 HG23 ILE 28 HG23 ILE 28 1.964 -1.198 -0.519 242 HD11 ILE 28 HD11 ILE 28 -1.189 -4.907 -0.498 243 HD12 ILE 28 HD12 ILE 28 -1.973 -3.370 -0.136 244 HD13 ILE 28 HD13 ILE 28 -1.190 -4.284 1.153 245 H LEU 29 HN LEU 29 2.824 -0.385 2.445 246 HA LEU 29 HA LEU 29 1.575 0.562 4.822 247 HB2 LEU 29 HB2 LEU 29 4.071 0.738 4.008 248 HB3 LEU 29 HB1 LEU 29 3.514 2.221 3.256 249 HG LEU 29 HG LEU 29 4.549 2.723 5.381 250 HD11 LEU 29 HD11 LEU 29 2.656 3.830 6.574 251 HD12 LEU 29 HD12 LEU 29 1.549 3.054 5.434 252 HD13 LEU 29 HD13 LEU 29 2.759 4.200 4.857 253 HD21 LEU 29 HD21 LEU 29 3.660 1.874 7.486 254 HD22 LEU 29 HD22 LEU 29 4.249 0.569 6.459 255 HD23 LEU 29 HD23 LEU 29 2.517 0.866 6.603 256 H ASN 30 HN ASN 30 -0.160 1.807 4.943 257 HA ASN 30 HA ASN 30 -1.089 3.384 2.741 258 HB2 ASN 30 HB2 ASN 30 -1.887 3.311 5.649 259 HB3 ASN 30 HB1 ASN 30 -2.692 4.282 4.438 260 HD21 ASN 30 HD21 ASN 30 -2.459 2.196 2.364 261 HD22 ASN 30 HD22 ASN 30 -3.594 0.973 2.794 262 H THR 31 HN THR 31 0.445 4.833 2.159 263 HA THR 31 HA THR 31 1.967 6.217 4.142 264 HB THR 31 HB THR 31 2.803 7.277 1.864 265 HG1 THR 31 HG1 THR 31 2.066 4.745 0.907 266 HG21 THR 31 HG21 THR 31 3.369 4.573 3.021 267 HG22 THR 31 HG22 THR 31 4.281 6.075 3.222 268 HG23 THR 31 HG23 THR 31 4.295 5.228 1.675 269 HA PRO 32 HA PRO 32 0.621 10.537 4.117 270 HB2 PRO 32 HB2 PRO 32 3.115 10.853 2.545 271 HB3 PRO 32 HB1 PRO 32 2.516 11.804 3.904 272 HG2 PRO 32 HG2 PRO 32 4.429 9.963 4.240 273 HG3 PRO 32 HG1 PRO 32 3.192 10.247 5.471 274 HD2 PRO 32 HD2 PRO 32 3.537 7.972 3.640 275 HD3 PRO 32 HD1 PRO 32 2.707 8.053 5.202 276 H ASN 33 HN ASN 33 0.528 8.628 1.463 277 HA ASN 33 HA ASN 33 -0.143 8.803 -0.688 278 HB2 ASN 33 HB2 ASN 33 0.067 11.801 -0.343 279 HB3 ASN 33 HB1 ASN 33 -0.432 10.994 -1.825 280 HD21 ASN 33 HD21 ASN 33 -1.255 11.689 1.470 281 HD22 ASN 33 HD22 ASN 33 -2.931 11.317 1.350 282 H CYS 34 HN CYS 34 2.115 7.990 -0.014 283 HA CYS 34 HA CYS 34 4.122 9.090 -1.827 284 HB2 CYS 34 HB2 CYS 34 4.124 6.976 0.336 285 HB3 CYS 34 HB1 CYS 34 5.453 7.126 -0.786 286 H ALA 35 HN ALA 35 5.182 7.252 -3.184 287 HA ALA 35 HA ALA 35 3.332 5.678 -4.589 288 HB1 ALA 35 HB1 ALA 35 5.289 4.395 -5.361 289 HB2 ALA 35 HB2 ALA 35 6.282 5.188 -4.140 290 HB3 ALA 35 HB3 ALA 35 5.576 6.133 -5.452 291 H LEU 36 HN LEU 36 2.048 4.179 -3.669 292 HA LEU 36 HA LEU 36 2.111 3.157 -1.227 293 HB2 LEU 36 HB2 LEU 36 0.814 1.160 -2.098 294 HB3 LEU 36 HB1 LEU 36 0.187 2.761 -2.398 295 HG LEU 36 HG LEU 36 -0.195 1.273 -4.281 296 HD11 LEU 36 HD11 LEU 36 0.197 3.732 -4.564 297 HD12 LEU 36 HD12 LEU 36 0.438 2.737 -6.005 298 HD13 LEU 36 HD13 LEU 36 1.829 3.323 -5.091 299 HD21 LEU 36 HD21 LEU 36 1.656 -0.222 -4.120 300 HD22 LEU 36 HD22 LEU 36 2.797 1.090 -4.410 301 HD23 LEU 36 HD23 LEU 36 1.706 0.569 -5.697 302 H GLN 37 HN GLN 37 3.136 1.735 -0.032 303 HA GLN 37 HA GLN 37 5.536 0.623 -1.290 304 HB2 GLN 37 HB2 GLN 37 5.054 1.701 1.476 305 HB3 GLN 37 HB1 GLN 37 6.519 0.837 1.020 306 HG2 GLN 37 HG2 GLN 37 7.320 2.557 -0.197 307 HG3 GLN 37 HG1 GLN 37 5.720 3.069 -0.734 308 HE21 GLN 37 HE21 GLN 37 6.031 5.153 -0.334 309 HE22 GLN 37 HE22 GLN 37 6.123 5.813 1.251 310 H ILE 38 HN ILE 38 5.866 -1.405 -1.287 311 HA ILE 38 HA ILE 38 3.965 -3.218 -0.083 312 HB ILE 38 HB ILE 38 6.367 -4.079 -1.661 313 HG12 ILE 38 HG12 ILE 38 5.442 -2.197 -2.949 314 HG13 ILE 38 HG11 ILE 38 5.198 -3.727 -3.775 315 HG21 ILE 38 HG21 ILE 38 5.308 -5.992 -1.246 316 HG22 ILE 38 HG22 ILE 38 4.256 -5.501 -2.580 317 HG23 ILE 38 HG23 ILE 38 3.768 -5.191 -0.913 318 HD11 ILE 38 HD11 ILE 38 3.121 -2.205 -2.222 319 HD12 ILE 38 HD12 ILE 38 2.870 -3.746 -3.045 320 HD13 ILE 38 HD13 ILE 38 3.264 -2.298 -3.978 321 H VAL 39 HN VAL 39 4.416 -3.515 2.098 322 HA VAL 39 HA VAL 39 7.211 -3.988 2.863 323 HB VAL 39 HB VAL 39 5.490 -2.376 4.113 324 HG11 VAL 39 HG11 VAL 39 3.804 -3.982 4.631 325 HG12 VAL 39 HG12 VAL 39 4.560 -3.418 6.120 326 HG13 VAL 39 HG13 VAL 39 4.976 -5.001 5.466 327 HG21 VAL 39 HG21 VAL 39 7.480 -4.161 5.509 328 HG22 VAL 39 HG22 VAL 39 6.835 -2.649 6.156 329 HG23 VAL 39 HG23 VAL 39 7.824 -2.634 4.694 330 H ALA 40 HN ALA 40 7.905 -6.006 3.413 331 HA ALA 40 HA ALA 40 5.867 -8.095 3.691 332 HB1 ALA 40 HB1 ALA 40 8.094 -8.185 1.668 333 HB2 ALA 40 HB2 ALA 40 6.387 -7.913 1.321 334 HB3 ALA 40 HB3 ALA 40 6.915 -9.460 1.979 335 H ARG 41 HN ARG 41 6.437 -9.767 4.957 336 HA ARG 41 HA ARG 41 9.128 -9.668 6.132 337 HB2 ARG 41 HB2 ARG 41 6.550 -10.964 7.001 338 HB3 ARG 41 HB1 ARG 41 8.097 -11.374 7.742 339 HG2 ARG 41 HG2 ARG 41 7.667 -8.506 7.576 340 HG3 ARG 41 HG1 ARG 41 6.428 -9.332 8.506 341 HD2 ARG 41 HD2 ARG 41 9.362 -9.751 8.956 342 HD3 ARG 41 HD1 ARG 41 8.428 -8.523 9.808 343 HE ARG 41 HE ARG 41 7.188 -11.058 10.037 344 HH11 ARG 41 HH11 ARG 41 9.900 -9.211 11.265 345 HH12 ARG 41 HH12 ARG 41 9.925 -10.031 12.792 346 HH21 ARG 41 HH21 ARG 41 7.224 -12.141 12.029 347 HH22 ARG 41 HH22 ARG 41 8.402 -11.706 13.227 348 H LEU 42 HN LEU 42 10.629 -11.016 5.386 349 HA LEU 42 HA LEU 42 9.990 -12.846 3.320 350 HB2 LEU 42 HB2 LEU 42 12.495 -12.196 4.812 351 HB3 LEU 42 HB1 LEU 42 12.453 -13.576 3.733 352 HG LEU 42 HG LEU 42 11.757 -10.775 2.856 353 HD11 LEU 42 HD11 LEU 42 14.060 -10.805 3.627 354 HD12 LEU 42 HD12 LEU 42 14.001 -10.705 1.865 355 HD13 LEU 42 HD13 LEU 42 14.385 -12.238 2.649 356 HD21 LEU 42 HD21 LEU 42 12.144 -11.689 0.609 357 HD22 LEU 42 HD22 LEU 42 10.850 -12.549 1.440 358 HD23 LEU 42 HD23 LEU 42 12.447 -13.281 1.306 359 H LYS 43 HN LYS 43 10.094 -15.041 3.218 360 HA LYS 43 HA LYS 43 8.717 -16.381 5.211 361 HB2 LYS 43 HB2 LYS 43 8.796 -16.957 2.820 362 HB3 LYS 43 HB1 LYS 43 10.436 -17.520 3.039 363 HG2 LYS 43 HG2 LYS 43 9.655 -19.278 4.525 364 HG3 LYS 43 HG1 LYS 43 7.995 -18.701 4.330 365 HD2 LYS 43 HD2 LYS 43 8.255 -20.515 2.818 366 HD3 LYS 43 HD1 LYS 43 8.304 -19.038 1.846 367 HE2 LYS 43 HE2 LYS 43 10.831 -19.168 2.059 368 HE3 LYS 43 HE1 LYS 43 10.592 -20.801 2.675 369 HZ1 LYS 43 HZ1 LYS 43 9.474 -21.390 0.631 370 HZ2 LYS 43 HZ2 LYS 43 11.021 -20.793 0.294 371 HZ3 LYS 43 HZ3 LYS 43 9.659 -19.820 0.032 372 H ASN 44 HN ASN 44 12.054 -17.066 4.223 373 HA ASN 44 HA ASN 44 12.502 -18.579 6.640 374 HB2 ASN 44 HB2 ASN 44 14.283 -17.951 4.304 375 HB3 ASN 44 HB1 ASN 44 14.773 -18.949 5.662 376 HD21 ASN 44 HD21 ASN 44 14.578 -19.632 2.852 377 HD22 ASN 44 HD22 ASN 44 13.466 -20.952 2.747 378 H ASN 45 HN ASN 45 13.443 -15.533 5.238 379 HA ASN 45 HA ASN 45 15.596 -15.068 7.041 380 HB2 ASN 45 HB2 ASN 45 15.264 -14.124 4.675 381 HB3 ASN 45 HB1 ASN 45 14.216 -12.950 5.439 382 HD21 ASN 45 HD21 ASN 45 15.707 -11.376 4.624 383 HD22 ASN 45 HD22 ASN 45 17.167 -11.048 5.486 384 H ASN 46 HN ASN 46 12.213 -14.398 7.023 385 HA ASN 46 HA ASN 46 10.770 -13.589 8.555 386 HB2 ASN 46 HB2 ASN 46 12.183 -15.171 10.003 387 HB3 ASN 46 HB1 ASN 46 12.958 -13.711 10.611 388 HD21 ASN 46 HD21 ASN 46 12.205 -13.969 12.683 389 HD22 ASN 46 HD22 ASN 46 10.542 -13.754 13.107 390 H ARG 47 HN ARG 47 12.906 -11.793 7.222 391 HA ARG 47 HA ARG 47 12.778 -9.537 9.071 392 HB2 ARG 47 HB2 ARG 47 14.341 -9.967 6.531 393 HB3 ARG 47 HB1 ARG 47 14.298 -8.435 7.391 394 HG2 ARG 47 HG2 ARG 47 15.225 -9.567 9.379 395 HG3 ARG 47 HG1 ARG 47 15.353 -11.051 8.431 396 HD2 ARG 47 HD2 ARG 47 17.476 -9.965 8.420 397 HD3 ARG 47 HD1 ARG 47 16.764 -9.842 6.812 398 HE ARG 47 HE ARG 47 16.119 -7.546 8.330 399 HH11 ARG 47 HH11 ARG 47 18.806 -9.050 6.667 400 HH12 ARG 47 HH12 ARG 47 19.594 -7.547 6.313 401 HH21 ARG 47 HH21 ARG 47 17.153 -5.567 7.876 402 HH22 ARG 47 HH22 ARG 47 18.663 -5.563 7.019 403 H GLN 48 HN GLN 48 11.830 -7.666 8.609 404 HA GLN 48 HA GLN 48 9.763 -7.651 6.595 405 HB2 GLN 48 HB2 GLN 48 9.455 -6.746 8.913 406 HB3 GLN 48 HB1 GLN 48 10.548 -5.438 8.492 407 HG2 GLN 48 HG2 GLN 48 9.030 -4.765 6.703 408 HG3 GLN 48 HG1 GLN 48 7.925 -6.057 7.170 409 HE21 GLN 48 HE21 GLN 48 9.200 -2.946 7.974 410 HE22 GLN 48 HE22 GLN 48 8.068 -2.577 9.231 411 H VAL 49 HN VAL 49 9.890 -6.665 4.706 412 HA VAL 49 HA VAL 49 12.177 -4.906 4.091 413 HB VAL 49 HB VAL 49 11.222 -6.598 1.916 414 HG11 VAL 49 HG11 VAL 49 13.712 -6.828 1.535 415 HG12 VAL 49 HG12 VAL 49 13.907 -5.672 2.854 416 HG13 VAL 49 HG13 VAL 49 13.026 -5.210 1.396 417 HG21 VAL 49 HG21 VAL 49 12.514 -8.559 2.563 418 HG22 VAL 49 HG22 VAL 49 11.158 -8.242 3.649 419 HG23 VAL 49 HG23 VAL 49 12.800 -7.823 4.139 420 H CYS 50 HN CYS 50 11.779 -4.049 1.776 421 HA CYS 50 HA CYS 50 8.941 -3.514 1.325 422 HB2 CYS 50 HB2 CYS 50 11.228 -1.663 0.612 423 HB3 CYS 50 HB1 CYS 50 9.515 -1.324 0.537 424 H ILE 51 HN ILE 51 8.270 -4.384 -0.531 425 HA ILE 51 HA ILE 51 10.208 -5.485 -2.398 426 HB ILE 51 HB ILE 51 7.278 -5.571 -2.954 427 HG12 ILE 51 HG12 ILE 51 8.635 -7.223 -0.810 428 HG13 ILE 51 HG11 ILE 51 7.336 -6.057 -0.565 429 HG21 ILE 51 HG21 ILE 51 9.237 -7.827 -3.082 430 HG22 ILE 51 HG22 ILE 51 9.193 -6.601 -4.346 431 HG23 ILE 51 HG23 ILE 51 7.763 -7.580 -4.017 432 HD11 ILE 51 HD11 ILE 51 7.197 -8.714 -1.958 433 HD12 ILE 51 HD12 ILE 51 5.922 -7.507 -2.070 434 HD13 ILE 51 HD13 ILE 51 6.342 -8.199 -0.506 435 H ASP 52 HN ASP 52 10.378 -4.903 -4.578 436 HA ASP 52 HA ASP 52 9.925 -2.149 -5.120 437 HB2 ASP 52 HB2 ASP 52 11.783 -3.647 -6.038 438 HB3 ASP 52 HB1 ASP 52 10.586 -4.245 -7.176 439 HA PRO 53 HA PRO 53 5.661 -2.586 -6.322 440 HB2 PRO 53 HB2 PRO 53 5.403 -0.080 -7.380 441 HB3 PRO 53 HB1 PRO 53 5.309 -0.447 -5.655 442 HG2 PRO 53 HG2 PRO 53 7.605 0.605 -7.248 443 HG3 PRO 53 HG1 PRO 53 7.042 1.091 -5.638 444 HD2 PRO 53 HD2 PRO 53 9.157 -0.519 -5.959 445 HD3 PRO 53 HD1 PRO 53 8.031 -0.728 -4.609 446 H LYS 54 HN LYS 54 8.314 -2.090 -8.406 447 HA LYS 54 HA LYS 54 6.639 -2.138 -10.804 448 HB2 LYS 54 HB2 LYS 54 9.627 -1.738 -10.598 449 HB3 LYS 54 HB1 LYS 54 8.658 -1.589 -12.058 450 HG2 LYS 54 HG2 LYS 54 7.961 0.099 -9.722 451 HG3 LYS 54 HG1 LYS 54 9.389 0.521 -10.666 452 HD2 LYS 54 HD2 LYS 54 7.575 1.768 -11.557 453 HD3 LYS 54 HD1 LYS 54 7.896 0.466 -12.702 454 HE2 LYS 54 HE2 LYS 54 6.048 -0.789 -11.892 455 HE3 LYS 54 HE1 LYS 54 5.775 0.342 -10.571 456 HZ1 LYS 54 HZ1 LYS 54 5.204 2.037 -12.191 457 HZ2 LYS 54 HZ2 LYS 54 4.212 0.681 -12.386 458 HZ3 LYS 54 HZ3 LYS 54 5.486 0.955 -13.462 459 H LEU 55 HN LEU 55 8.029 -4.297 -8.776 460 HA LEU 55 HA LEU 55 9.042 -6.279 -10.468 461 HB2 LEU 55 HB2 LEU 55 7.868 -6.119 -7.751 462 HB3 LEU 55 HB1 LEU 55 7.979 -7.716 -8.470 463 HG LEU 55 HG LEU 55 10.339 -5.857 -8.240 464 HD11 LEU 55 HD11 LEU 55 9.648 -6.186 -6.014 465 HD12 LEU 55 HD12 LEU 55 10.973 -7.317 -6.290 466 HD13 LEU 55 HD13 LEU 55 9.307 -7.894 -6.288 467 HD21 LEU 55 HD21 LEU 55 10.093 -8.824 -8.676 468 HD22 LEU 55 HD22 LEU 55 11.607 -7.934 -8.504 469 HD23 LEU 55 HD23 LEU 55 10.548 -7.620 -9.878 470 H LYS 56 HN LYS 56 8.068 -7.897 -11.606 471 HA LYS 56 HA LYS 56 5.548 -7.154 -12.689 472 HB2 LYS 56 HB2 LYS 56 7.464 -9.395 -13.245 473 HB3 LYS 56 HB1 LYS 56 5.880 -9.360 -14.004 474 HG2 LYS 56 HG2 LYS 56 7.562 -8.407 -15.471 475 HG3 LYS 56 HG1 LYS 56 6.394 -7.179 -14.987 476 HD2 LYS 56 HD2 LYS 56 8.008 -6.455 -13.224 477 HD3 LYS 56 HD1 LYS 56 9.179 -7.579 -13.909 478 HE2 LYS 56 HE2 LYS 56 9.162 -6.385 -16.002 479 HE3 LYS 56 HE1 LYS 56 7.877 -5.323 -15.422 480 HZ1 LYS 56 HZ1 LYS 56 9.379 -4.484 -13.730 481 HZ2 LYS 56 HZ2 LYS 56 10.043 -4.264 -15.270 482 HZ3 LYS 56 HZ3 LYS 56 10.610 -5.510 -14.276 483 H TRP 57 HN TRP 57 6.571 -9.545 -10.351 484 HA TRP 57 HA TRP 57 3.953 -10.765 -10.320 485 HB2 TRP 57 HB2 TRP 57 4.755 -12.192 -8.622 486 HB3 TRP 57 HB1 TRP 57 6.117 -11.962 -9.696 487 HD1 TRP 57 HD1 TRP 57 8.260 -10.824 -8.698 488 HE1 TRP 57 HE1 TRP 57 9.006 -10.280 -6.284 489 HE3 TRP 57 HE3 TRP 57 3.762 -11.326 -6.353 490 HZ2 TRP 57 HZ2 TRP 57 7.817 -10.088 -3.733 491 HZ3 TRP 57 HZ3 TRP 57 3.637 -10.929 -3.933 492 HH2 TRP 57 HH2 TRP 57 5.626 -10.331 -2.645 493 H ILE 58 HN ILE 58 5.563 -8.110 -8.896 494 HA ILE 58 HA ILE 58 3.806 -7.789 -6.665 495 HB ILE 58 HB ILE 58 5.918 -6.073 -7.917 496 HG12 ILE 58 HG12 ILE 58 6.558 -7.953 -6.446 497 HG13 ILE 58 HG11 ILE 58 7.027 -6.389 -5.786 498 HG21 ILE 58 HG21 ILE 58 4.088 -4.597 -7.234 499 HG22 ILE 58 HG22 ILE 58 5.541 -4.379 -6.247 500 HG23 ILE 58 HG23 ILE 58 4.169 -5.278 -5.606 501 HD11 ILE 58 HD11 ILE 58 6.038 -8.057 -4.177 502 HD12 ILE 58 HD12 ILE 58 4.501 -7.780 -4.983 503 HD13 ILE 58 HD13 ILE 58 5.324 -6.448 -4.179 504 H GLN 59 HN GLN 59 4.015 -6.406 -9.917 505 HA GLN 59 HA GLN 59 2.019 -4.487 -9.782 506 HB2 GLN 59 HB2 GLN 59 2.843 -6.389 -11.928 507 HB3 GLN 59 HB1 GLN 59 1.598 -5.186 -12.217 508 HG2 GLN 59 HG2 GLN 59 4.368 -4.534 -11.273 509 HG3 GLN 59 HG1 GLN 59 3.913 -4.591 -12.977 510 HE21 GLN 59 HE21 GLN 59 3.694 -2.820 -10.010 511 HE22 GLN 59 HE22 GLN 59 2.917 -1.420 -10.668 512 H GLU 60 HN GLU 60 1.792 -7.934 -10.015 513 HA GLU 60 HA GLU 60 -1.025 -8.127 -10.345 514 HB2 GLU 60 HB2 GLU 60 0.901 -10.114 -9.120 515 HB3 GLU 60 HB1 GLU 60 -0.701 -10.470 -9.737 516 HG2 GLU 60 HG2 GLU 60 1.538 -9.407 -11.433 517 HG3 GLU 60 HG1 GLU 60 1.198 -11.121 -11.225 518 H TYR 61 HN TYR 61 1.143 -7.954 -7.608 519 HA TYR 61 HA TYR 61 -0.859 -8.520 -5.613 520 HB2 TYR 61 HB2 TYR 61 1.478 -9.058 -5.145 521 HB3 TYR 61 HB1 TYR 61 1.936 -7.384 -5.407 522 HD1 TYR 61 HD1 TYR 61 0.154 -9.652 -3.144 523 HD2 TYR 61 HD2 TYR 61 1.718 -5.748 -3.745 524 HE1 TYR 61 HE1 TYR 61 -0.173 -9.154 -0.781 525 HE2 TYR 61 HE2 TYR 61 1.393 -5.242 -1.364 526 HH TYR 61 HH TYR 61 0.727 -7.623 0.939 527 H LEU 62 HN LEU 62 0.594 -5.776 -7.134 528 HA LEU 62 HA LEU 62 -0.329 -3.702 -5.574 529 HB2 LEU 62 HB2 LEU 62 0.742 -4.104 -8.170 530 HB3 LEU 62 HB1 LEU 62 -0.614 -2.978 -8.300 531 HG LEU 62 HG LEU 62 0.615 -1.779 -6.306 532 HD11 LEU 62 HD11 LEU 62 3.025 -2.003 -6.431 533 HD12 LEU 62 HD12 LEU 62 2.856 -3.244 -7.677 534 HD13 LEU 62 HD13 LEU 62 2.279 -3.556 -6.040 535 HD21 LEU 62 HD21 LEU 62 1.599 -1.643 -9.155 536 HD22 LEU 62 HD22 LEU 62 1.810 -0.396 -7.926 537 HD23 LEU 62 HD23 LEU 62 0.194 -0.799 -8.505 538 H GLU 63 HN GLU 63 -1.883 -5.456 -8.201 539 HA GLU 63 HA GLU 63 -4.298 -4.142 -8.325 540 HB2 GLU 63 HB2 GLU 63 -3.647 -7.042 -8.666 541 HB3 GLU 63 HB1 GLU 63 -5.195 -6.335 -9.082 542 HG2 GLU 63 HG2 GLU 63 -3.947 -4.736 -10.519 543 HG3 GLU 63 HG1 GLU 63 -2.529 -5.733 -10.264 544 H LYS 64 HN LYS 64 -3.112 -6.326 -5.948 545 HA LYS 64 HA LYS 64 -5.598 -6.821 -4.608 546 HB2 LYS 64 HB2 LYS 64 -2.842 -6.944 -3.403 547 HB3 LYS 64 HB1 LYS 64 -4.287 -7.772 -2.833 548 HG2 LYS 64 HG2 LYS 64 -2.805 -8.312 -5.389 549 HG3 LYS 64 HG1 LYS 64 -2.807 -9.328 -3.947 550 HD2 LYS 64 HD2 LYS 64 -5.213 -9.702 -4.236 551 HD3 LYS 64 HD1 LYS 64 -5.186 -8.674 -5.672 552 HE2 LYS 64 HE2 LYS 64 -3.572 -10.228 -6.711 553 HE3 LYS 64 HE1 LYS 64 -3.711 -11.278 -5.303 554 HZ1 LYS 64 HZ1 LYS 64 -5.950 -10.528 -7.101 555 HZ2 LYS 64 HZ2 LYS 64 -6.036 -11.593 -5.787 556 HZ3 LYS 64 HZ3 LYS 64 -5.116 -11.999 -7.145 557 H ALA 65 HN ALA 65 -2.829 -4.726 -4.059 558 HA ALA 65 HA ALA 65 -3.718 -3.348 -1.798 559 HB1 ALA 65 HB1 ALA 65 -2.041 -1.664 -2.422 560 HB2 ALA 65 HB2 ALA 65 -1.916 -2.402 -4.021 561 HB3 ALA 65 HB3 ALA 65 -1.408 -3.303 -2.594 562 H LEU 66 HN LEU 66 -4.134 -2.769 -5.197 563 HA LEU 66 HA LEU 66 -5.536 -0.276 -4.866 564 HB2 LEU 66 HB2 LEU 66 -4.895 -2.058 -7.179 565 HB3 LEU 66 HB1 LEU 66 -6.134 -0.834 -7.364 566 HG LEU 66 HG LEU 66 -4.491 0.898 -6.778 567 HD11 LEU 66 HD11 LEU 66 -2.991 -0.497 -5.432 568 HD12 LEU 66 HD12 LEU 66 -2.126 0.370 -6.702 569 HD13 LEU 66 HD13 LEU 66 -2.489 -1.350 -6.894 570 HD21 LEU 66 HD21 LEU 66 -3.231 0.791 -8.876 571 HD22 LEU 66 HD22 LEU 66 -4.930 0.379 -9.102 572 HD23 LEU 66 HD23 LEU 66 -3.711 -0.895 -9.067 573 H ASN 67 HN ASN 67 -6.356 -3.569 -5.671 574 HA ASN 67 HA ASN 67 -8.215 -4.735 -5.924 575 HB2 ASN 67 HB2 ASN 67 -9.471 -4.957 -3.920 576 HB3 ASN 67 HB1 ASN 67 -7.782 -4.819 -3.570 577 HD21 ASN 67 HD21 ASN 67 -7.032 -3.079 -2.432 578 HD22 ASN 67 HD22 ASN 67 -8.087 -1.975 -1.617 579 H LYS 68 HN LYS 68 -9.900 -4.827 -7.053 580 HA LYS 68 HA LYS 68 -11.241 -2.451 -7.901 581 HB2 LYS 68 HB2 LYS 68 -11.657 -5.365 -8.551 582 HB3 LYS 68 HB1 LYS 68 -12.608 -4.073 -9.267 583 HG2 LYS 68 HG2 LYS 68 -10.583 -3.097 -10.212 584 HG3 LYS 68 HG1 LYS 68 -9.622 -4.388 -9.493 585 HD2 LYS 68 HD2 LYS 68 -11.866 -4.853 -11.452 586 HD3 LYS 68 HD1 LYS 68 -10.170 -4.715 -11.914 587 HE2 LYS 68 HE2 LYS 68 -11.291 -6.749 -9.992 588 HE3 LYS 68 HE1 LYS 68 -10.920 -7.049 -11.688 589 HZ1 LYS 68 HZ1 LYS 68 -9.143 -7.780 -10.204 590 HZ2 LYS 68 HZ2 LYS 68 -8.949 -6.200 -9.640 591 HZ3 LYS 68 HZ3 LYS 68 -8.612 -6.564 -11.252 592 H GLY 69 HN GLY 69 -13.816 -3.074 -8.293 593 HA2 GLY 69 HA2 GLY 69 -15.684 -3.875 -6.783 594 HA3 GLY 69 HA1 GLY 69 -14.815 -3.023 -5.510 595 H ARG 70 HN ARG 70 -14.250 -0.695 -6.130 596 HA ARG 70 HA ARG 70 -16.508 0.525 -7.574 597 HB2 ARG 70 HB2 ARG 70 -15.982 2.592 -6.350 598 HB3 ARG 70 HB1 ARG 70 -16.345 1.266 -5.256 599 HG2 ARG 70 HG2 ARG 70 -13.934 0.937 -4.901 600 HG3 ARG 70 HG1 ARG 70 -13.611 2.325 -5.941 601 HD2 ARG 70 HD2 ARG 70 -14.852 3.761 -4.420 602 HD3 ARG 70 HD1 ARG 70 -15.224 2.377 -3.397 603 HE ARG 70 HE ARG 70 -12.469 3.333 -3.852 604 HH11 ARG 70 HH11 ARG 70 -15.015 2.202 -1.722 605 HH12 ARG 70 HH12 ARG 70 -14.005 2.210 -0.312 606 HH21 ARG 70 HH21 ARG 70 -11.153 3.346 -2.002 607 HH22 ARG 70 HH22 ARG 70 -11.812 2.876 -0.467 608 H ARG 71 HN ARG 71 -13.338 -0.334 -7.861 609 HA ARG 71 HA ARG 71 -12.528 1.922 -9.534 610 HB2 ARG 71 HB2 ARG 71 -10.988 -0.557 -8.721 611 HB3 ARG 71 HB1 ARG 71 -10.328 0.831 -9.571 612 HG2 ARG 71 HG2 ARG 71 -11.458 0.876 -6.781 613 HG3 ARG 71 HG1 ARG 71 -9.744 0.829 -7.196 614 HD2 ARG 71 HD2 ARG 71 -11.693 3.019 -7.903 615 HD3 ARG 71 HD1 ARG 71 -10.449 3.097 -6.656 616 HE ARG 71 HE ARG 71 -9.034 2.531 -8.886 617 HH11 ARG 71 HH11 ARG 71 -11.398 4.987 -8.105 618 HH12 ARG 71 HH12 ARG 71 -10.736 6.157 -9.201 619 HH21 ARG 71 HH21 ARG 71 -8.149 4.071 -10.336 620 HH22 ARG 71 HH22 ARG 71 -8.895 5.631 -10.477 621 H GLU 72 HN GLU 72 -14.661 0.482 -10.526 622 HA GLU 72 HA GLU 72 -13.781 -1.662 -12.214 623 HB2 GLU 72 HB2 GLU 72 -16.438 -0.228 -12.131 624 HB3 GLU 72 HB1 GLU 72 -16.110 -1.738 -12.970 625 HG2 GLU 72 HG2 GLU 72 -16.074 -1.257 -10.003 626 HG3 GLU 72 HG1 GLU 72 -17.216 -2.239 -10.920 627 H GLU 73 HN GLU 73 -13.966 -1.731 -14.483 628 HA GLU 73 HA GLU 73 -13.504 -1.031 -16.577 629 HB2 GLU 73 HB2 GLU 73 -15.073 1.392 -15.692 630 HB3 GLU 73 HB1 GLU 73 -14.603 1.060 -17.354 631 HG2 GLU 73 HG2 GLU 73 -15.904 -1.022 -17.286 632 HG3 GLU 73 HG1 GLU 73 -16.410 -0.631 -15.642 633 H LYS 74 HN LYS 74 -11.351 -0.872 -15.164 634 HA LYS 74 HA LYS 74 -10.187 1.772 -15.263 635 HB2 LYS 74 HB2 LYS 74 -9.587 0.152 -13.486 636 HB3 LYS 74 HB1 LYS 74 -8.893 -0.904 -14.708 637 HG2 LYS 74 HG2 LYS 74 -7.203 0.735 -15.225 638 HG3 LYS 74 HG1 LYS 74 -7.939 1.887 -14.107 639 HD2 LYS 74 HD2 LYS 74 -7.516 0.319 -12.257 640 HD3 LYS 74 HD1 LYS 74 -6.726 -0.780 -13.389 641 HE2 LYS 74 HE2 LYS 74 -5.021 0.856 -13.852 642 HE3 LYS 74 HE1 LYS 74 -5.847 2.053 -12.854 643 HZ1 LYS 74 HZ1 LYS 74 -5.471 0.650 -10.931 644 HZ2 LYS 74 HZ2 LYS 74 -4.005 1.042 -11.678 645 HZ3 LYS 74 HZ3 LYS 74 -4.674 -0.497 -11.886 646 H VAL 75 HN VAL 75 -10.426 2.240 -17.448 647 HA VAL 75 HA VAL 75 -9.079 0.539 -19.397 648 HB VAL 75 HB VAL 75 -10.750 3.032 -19.789 649 HG11 VAL 75 HG11 VAL 75 -10.791 2.395 -22.156 650 HG12 VAL 75 HG12 VAL 75 -9.670 1.079 -21.814 651 HG13 VAL 75 HG13 VAL 75 -9.155 2.750 -21.600 652 HG21 VAL 75 HG21 VAL 75 -12.058 1.176 -18.923 653 HG22 VAL 75 HG22 VAL 75 -11.430 0.121 -20.189 654 HG23 VAL 75 HG23 VAL 75 -12.467 1.484 -20.610 655 H GLY 76 HN GLY 76 -8.868 3.730 -17.945 656 HA2 GLY 76 HA2 GLY 76 -6.961 5.062 -17.752 657 HA3 GLY 76 HA1 GLY 76 -6.122 3.981 -18.858 658 H LYS 77 HN LYS 77 -6.165 4.370 -21.039 659 HA LYS 77 HA LYS 77 -7.470 6.880 -21.869 660 HB2 LYS 77 HB2 LYS 77 -5.065 5.453 -23.029 661 HB3 LYS 77 HB1 LYS 77 -5.846 6.825 -23.794 662 HG2 LYS 77 HG2 LYS 77 -3.978 7.703 -22.694 663 HG3 LYS 77 HG1 LYS 77 -5.349 8.114 -21.667 664 HD2 LYS 77 HD2 LYS 77 -4.823 6.241 -20.195 665 HD3 LYS 77 HD1 LYS 77 -3.477 5.782 -21.240 666 HE2 LYS 77 HE2 LYS 77 -3.731 8.415 -19.794 667 HE3 LYS 77 HE1 LYS 77 -2.766 7.047 -19.240 668 HZ1 LYS 77 HZ1 LYS 77 -1.413 8.676 -20.399 669 HZ2 LYS 77 HZ2 LYS 77 -2.365 8.524 -21.787 670 HZ3 LYS 77 HZ3 LYS 77 -1.438 7.217 -21.251 671 H LYS 78 HN LYS 78 -6.412 3.815 -23.282 672 HA LYS 78 HA LYS 78 -8.994 3.033 -24.151 673 HB2 LYS 78 HB2 LYS 78 -8.504 4.845 -25.807 674 HB3 LYS 78 HB1 LYS 78 -7.076 3.954 -26.309 675 HG2 LYS 78 HG2 LYS 78 -8.471 2.114 -27.070 676 HG3 LYS 78 HG1 LYS 78 -9.915 2.972 -26.527 677 HD2 LYS 78 HD2 LYS 78 -9.448 4.777 -28.094 678 HD3 LYS 78 HD1 LYS 78 -7.977 3.957 -28.616 679 HE2 LYS 78 HE2 LYS 78 -9.802 3.609 -30.199 680 HE3 LYS 78 HE1 LYS 78 -9.299 2.095 -29.454 681 HZ1 LYS 78 HZ1 LYS 78 -11.637 3.694 -28.574 682 HZ2 LYS 78 HZ2 LYS 78 -11.194 2.162 -28.014 683 HZ3 LYS 78 HZ3 LYS 78 -11.726 2.359 -29.604 684 H GLU 79 HN GLU 79 -8.474 1.082 -23.242 685 HA GLU 79 HA GLU 79 -5.929 -0.159 -23.842 686 HB2 GLU 79 HB2 GLU 79 -6.869 -0.186 -21.547 687 HB3 GLU 79 HB1 GLU 79 -8.207 -1.163 -22.127 688 HG2 GLU 79 HG2 GLU 79 -6.543 -2.523 -21.003 689 HG3 GLU 79 HG1 GLU 79 -6.668 -2.954 -22.707 690 H LYS 80 HN LYS 80 -9.000 -1.908 -23.596 691 HA LYS 80 HA LYS 80 -8.705 -2.741 -26.387 692 HB2 LYS 80 HB2 LYS 80 -8.998 -4.614 -24.037 693 HB3 LYS 80 HB1 LYS 80 -9.230 -5.099 -25.710 694 HG2 LYS 80 HG2 LYS 80 -6.892 -4.395 -26.173 695 HG3 LYS 80 HG1 LYS 80 -6.691 -4.099 -24.447 696 HD2 LYS 80 HD2 LYS 80 -7.216 -6.450 -23.990 697 HD3 LYS 80 HD1 LYS 80 -7.409 -6.740 -25.720 698 HE2 LYS 80 HE2 LYS 80 -5.049 -5.982 -26.026 699 HE3 LYS 80 HE1 LYS 80 -4.894 -5.926 -24.273 700 HZ1 LYS 80 HZ1 LYS 80 -5.530 -8.337 -25.884 701 HZ2 LYS 80 HZ2 LYS 80 -5.405 -8.294 -24.201 702 HZ3 LYS 80 HZ3 LYS 80 -4.043 -7.996 -25.156 703 H ILE 81 HN ILE 81 -10.813 -3.813 -23.740 704 HA ILE 81 HA ILE 81 -13.039 -2.282 -24.489 705 HB ILE 81 HB ILE 81 -12.847 -3.844 -26.492 706 HG12 ILE 81 HG12 ILE 81 -14.935 -2.591 -25.798 707 HG13 ILE 81 HG11 ILE 81 -15.189 -4.006 -26.806 708 HG21 ILE 81 HG21 ILE 81 -12.271 -5.890 -25.374 709 HG22 ILE 81 HG22 ILE 81 -13.783 -6.098 -26.255 710 HG23 ILE 81 HG23 ILE 81 -13.805 -5.890 -24.504 711 HD11 ILE 81 HD11 ILE 81 -15.593 -3.861 -23.830 712 HD12 ILE 81 HD12 ILE 81 -15.849 -5.284 -24.836 713 HD13 ILE 81 HD13 ILE 81 -16.857 -3.856 -25.061 714 H GLY 82 HN GLY 82 -11.837 -5.290 -23.082 715 HA2 GLY 82 HA2 GLY 82 -12.344 -4.934 -20.507 716 HA3 GLY 82 HA1 GLY 82 -13.964 -5.288 -21.090 717 H LYS 83 HN LYS 83 -14.535 -7.335 -21.566 718 HA LYS 83 HA LYS 83 -14.526 -9.593 -21.639 719 HB2 LYS 83 HB2 LYS 83 -11.563 -9.238 -22.070 720 HB3 LYS 83 HB1 LYS 83 -12.364 -10.801 -22.089 721 HG2 LYS 83 HG2 LYS 83 -13.811 -9.967 -23.931 722 HG3 LYS 83 HG1 LYS 83 -12.834 -8.498 -23.964 723 HD2 LYS 83 HD2 LYS 83 -10.852 -9.804 -24.482 724 HD3 LYS 83 HD1 LYS 83 -11.787 -11.297 -24.379 725 HE2 LYS 83 HE2 LYS 83 -13.192 -10.512 -26.241 726 HE3 LYS 83 HE1 LYS 83 -12.196 -9.064 -26.364 727 HZ1 LYS 83 HZ1 LYS 83 -11.515 -10.682 -27.984 728 HZ2 LYS 83 HZ2 LYS 83 -11.294 -11.858 -26.791 729 HZ3 LYS 83 HZ3 LYS 83 -10.288 -10.501 -26.836 730 H LYS 84 HN LYS 84 -11.666 -8.591 -19.759 731 HA LYS 84 HA LYS 84 -12.053 -10.670 -17.812 732 HB2 LYS 84 HB2 LYS 84 -9.817 -9.755 -18.403 733 HB3 LYS 84 HB1 LYS 84 -10.284 -8.215 -17.699 734 HG2 LYS 84 HG2 LYS 84 -10.595 -9.393 -15.517 735 HG3 LYS 84 HG1 LYS 84 -9.910 -10.836 -16.267 736 HD2 LYS 84 HD2 LYS 84 -8.507 -8.171 -16.138 737 HD3 LYS 84 HD1 LYS 84 -8.276 -9.464 -14.962 738 HE2 LYS 84 HE2 LYS 84 -7.784 -9.744 -17.923 739 HE3 LYS 84 HE1 LYS 84 -6.534 -9.374 -16.738 740 HZ1 LYS 84 HZ1 LYS 84 -8.198 -11.833 -16.813 741 HZ2 LYS 84 HZ2 LYS 84 -7.055 -11.472 -15.625 742 HZ3 LYS 84 HZ3 LYS 84 -6.561 -11.720 -17.221 743 H LYS 85 HN LYS 85 -14.385 -9.832 -17.657 744 HA LYS 85 HA LYS 85 -14.556 -7.966 -15.389 745 HB2 LYS 85 HB2 LYS 85 -16.311 -7.991 -17.850 746 HB3 LYS 85 HB1 LYS 85 -16.670 -7.078 -16.392 747 HG2 LYS 85 HG2 LYS 85 -14.743 -5.707 -16.688 748 HG3 LYS 85 HG1 LYS 85 -14.155 -6.724 -18.000 749 HD2 LYS 85 HD2 LYS 85 -15.106 -4.720 -18.930 750 HD3 LYS 85 HD1 LYS 85 -16.146 -6.082 -19.331 751 HE2 LYS 85 HE2 LYS 85 -16.703 -4.390 -16.922 752 HE3 LYS 85 HE1 LYS 85 -17.210 -3.860 -18.523 753 HZ1 LYS 85 HZ1 LYS 85 -18.021 -6.363 -17.150 754 HZ2 LYS 85 HZ2 LYS 85 -18.432 -5.972 -18.741 755 HZ3 LYS 85 HZ3 LYS 85 -18.996 -5.020 -17.462 756 H ARG 86 HN ARG 86 -15.000 -11.021 -16.358 757 HA ARG 86 HA ARG 86 -17.444 -11.396 -14.756 758 HB2 ARG 86 HB2 ARG 86 -16.186 -13.309 -16.737 759 HB3 ARG 86 HB1 ARG 86 -17.645 -13.612 -15.812 760 HG2 ARG 86 HG2 ARG 86 -18.490 -13.018 -17.861 761 HG3 ARG 86 HG1 ARG 86 -18.528 -11.476 -17.004 762 HD2 ARG 86 HD2 ARG 86 -16.454 -10.805 -18.063 763 HD3 ARG 86 HD1 ARG 86 -16.324 -12.376 -18.853 764 HE ARG 86 HE ARG 86 -18.688 -10.761 -19.420 765 HH11 ARG 86 HH11 ARG 86 -15.573 -11.977 -20.473 766 HH12 ARG 86 HH12 ARG 86 -15.861 -11.618 -22.148 767 HH21 ARG 86 HH21 ARG 86 -19.067 -10.287 -21.615 768 HH22 ARG 86 HH22 ARG 86 -17.842 -10.641 -22.794 769 H GLN 87 HN GLN 87 -17.182 -12.185 -12.795 770 HA GLN 87 HA GLN 87 -16.302 -13.178 -10.958 771 HB2 GLN 87 HB2 GLN 87 -15.148 -15.068 -13.012 772 HB3 GLN 87 HB1 GLN 87 -15.218 -15.375 -11.282 773 HG2 GLN 87 HG2 GLN 87 -17.678 -15.234 -11.393 774 HG3 GLN 87 HG1 GLN 87 -17.559 -15.041 -13.142 775 HE21 GLN 87 HE21 GLN 87 -16.949 -16.785 -14.405 776 HE22 GLN 87 HE22 GLN 87 -16.947 -18.404 -13.802 777 H LYS 88 HN LYS 88 -14.971 -11.070 -11.110 778 HA LYS 88 HA LYS 88 -12.112 -11.728 -11.269 779 HB2 LYS 88 HB2 LYS 88 -11.686 -9.319 -11.400 780 HB3 LYS 88 HB1 LYS 88 -12.765 -9.839 -12.682 781 HG2 LYS 88 HG2 LYS 88 -13.920 -8.737 -10.166 782 HG3 LYS 88 HG1 LYS 88 -13.223 -7.639 -11.356 783 HD2 LYS 88 HD2 LYS 88 -14.733 -8.508 -13.063 784 HD3 LYS 88 HD1 LYS 88 -15.405 -9.655 -11.904 785 HE2 LYS 88 HE2 LYS 88 -16.189 -7.795 -10.522 786 HE3 LYS 88 HE1 LYS 88 -15.512 -6.649 -11.677 787 HZ1 LYS 88 HZ1 LYS 88 -17.659 -8.611 -12.268 788 HZ2 LYS 88 HZ2 LYS 88 -17.033 -7.470 -13.346 789 HZ3 LYS 88 HZ3 LYS 88 -17.892 -6.961 -11.983 790 H LYS 89 HN LYS 89 -14.204 -12.146 -9.094 791 HA LYS 89 HA LYS 89 -13.284 -10.498 -6.918 792 HB2 LYS 89 HB2 LYS 89 -15.642 -11.320 -7.148 793 HB3 LYS 89 HB1 LYS 89 -15.057 -12.947 -6.839 794 HG2 LYS 89 HG2 LYS 89 -16.004 -12.022 -4.830 795 HG3 LYS 89 HG1 LYS 89 -14.266 -12.227 -4.626 796 HD2 LYS 89 HD2 LYS 89 -14.979 -10.100 -3.701 797 HD3 LYS 89 HD1 LYS 89 -13.945 -9.839 -5.102 798 HE2 LYS 89 HE2 LYS 89 -15.834 -8.321 -5.141 799 HE3 LYS 89 HE1 LYS 89 -15.928 -9.450 -6.487 800 HZ1 LYS 89 HZ1 LYS 89 -18.069 -9.140 -5.421 801 HZ2 LYS 89 HZ2 LYS 89 -17.443 -9.666 -3.945 802 HZ3 LYS 89 HZ3 LYS 89 -17.548 -10.739 -5.248 803 H ARG 90 HN ARG 90 -11.059 -11.008 -6.887 804 HA ARG 90 HA ARG 90 -10.154 -13.703 -6.461 805 HB2 ARG 90 HB2 ARG 90 -8.679 -11.086 -6.096 806 HB3 ARG 90 HB1 ARG 90 -7.945 -12.682 -6.148 807 HG2 ARG 90 HG2 ARG 90 -9.410 -11.342 -8.413 808 HG3 ARG 90 HG1 ARG 90 -7.660 -11.496 -8.255 809 HD2 ARG 90 HD2 ARG 90 -9.636 -13.758 -8.515 810 HD3 ARG 90 HD1 ARG 90 -8.552 -13.176 -9.776 811 HE ARG 90 HE ARG 90 -6.790 -13.820 -7.912 812 HH11 ARG 90 HH11 ARG 90 -9.614 -15.561 -9.020 813 HH12 ARG 90 HH12 ARG 90 -8.961 -17.125 -8.641 814 HH21 ARG 90 HH21 ARG 90 -5.926 -15.871 -7.406 815 HH22 ARG 90 HH22 ARG 90 -6.857 -17.299 -7.721 816 H LYS 91 HN LYS 91 -10.555 -10.810 -4.487 817 HA LYS 91 HA LYS 91 -10.425 -12.501 -2.079 818 HB2 LYS 91 HB2 LYS 91 -9.756 -9.565 -2.370 819 HB3 LYS 91 HB1 LYS 91 -9.815 -10.424 -0.840 820 HG2 LYS 91 HG2 LYS 91 -8.009 -11.899 -1.636 821 HG3 LYS 91 HG1 LYS 91 -7.920 -10.949 -3.119 822 HD2 LYS 91 HD2 LYS 91 -7.524 -9.797 -0.358 823 HD3 LYS 91 HD1 LYS 91 -6.206 -10.370 -1.377 824 HE2 LYS 91 HE2 LYS 91 -6.195 -8.120 -1.852 825 HE3 LYS 91 HE1 LYS 91 -7.234 -8.734 -3.135 826 HZ1 LYS 91 HZ1 LYS 91 -8.131 -7.454 -0.608 827 HZ2 LYS 91 HZ2 LYS 91 -9.163 -8.099 -1.781 828 HZ3 LYS 91 HZ3 LYS 91 -8.191 -6.773 -2.152 829 H ALA 92 HN ALA 92 -12.332 -12.754 -1.120 830 HA ALA 92 HA ALA 92 -14.584 -11.104 -1.848 831 HB1 ALA 92 HB1 ALA 92 -14.390 -13.365 0.144 832 HB2 ALA 92 HB2 ALA 92 -14.864 -13.515 -1.547 833 HB3 ALA 92 HB3 ALA 92 -15.881 -12.612 -0.426 834 H ALA 93 HN ALA 93 -13.197 -9.250 -0.946 835 HA ALA 93 HA ALA 93 -13.008 -7.528 0.510 836 HB1 ALA 93 HB1 ALA 93 -15.042 -8.988 2.192 837 HB2 ALA 93 HB2 ALA 93 -15.399 -7.794 0.944 838 HB3 ALA 93 HB3 ALA 93 -14.527 -7.315 2.401 839 H GLN 94 HN GLN 94 -11.290 -7.150 1.720 840 HA GLN 94 HA GLN 94 -10.024 -9.339 3.117 841 HB2 GLN 94 HB2 GLN 94 -8.761 -7.646 1.747 842 HB3 GLN 94 HB1 GLN 94 -9.144 -6.448 2.976 843 HG2 GLN 94 HG2 GLN 94 -6.923 -7.267 3.332 844 HG3 GLN 94 HG1 GLN 94 -7.959 -7.826 4.642 845 HE21 GLN 94 HE21 GLN 94 -6.050 -8.735 1.916 846 HE22 GLN 94 HE22 GLN 94 -6.118 -10.445 2.174 847 H LYS 95 HN LYS 95 -11.804 -9.589 4.611 848 HA LYS 95 HA LYS 95 -12.176 -7.521 6.618 849 HB2 LYS 95 HB2 LYS 95 -13.479 -10.226 6.255 850 HB3 LYS 95 HB1 LYS 95 -13.917 -9.063 7.497 851 HG2 LYS 95 HG2 LYS 95 -14.748 -7.527 5.899 852 HG3 LYS 95 HG1 LYS 95 -14.044 -8.437 4.562 853 HD2 LYS 95 HD2 LYS 95 -16.442 -8.817 4.690 854 HD3 LYS 95 HD1 LYS 95 -15.560 -10.301 5.039 855 HE2 LYS 95 HE2 LYS 95 -15.888 -9.917 7.442 856 HE3 LYS 95 HE1 LYS 95 -16.792 -8.448 7.075 857 HZ1 LYS 95 HZ1 LYS 95 -17.558 -11.202 6.259 858 HZ2 LYS 95 HZ2 LYS 95 -18.427 -9.794 5.906 859 HZ3 LYS 95 HZ3 LYS 95 -18.267 -10.310 7.512 860 H ARG 96 HN ARG 96 -11.323 -7.536 8.581 861 HA ARG 96 HA ARG 96 -10.277 -8.162 10.484 862 HB2 ARG 96 HB2 ARG 96 -12.040 -9.956 10.444 863 HB3 ARG 96 HB1 ARG 96 -10.872 -11.014 9.671 864 HG2 ARG 96 HG2 ARG 96 -9.445 -10.927 11.611 865 HG3 ARG 96 HG1 ARG 96 -10.510 -9.749 12.378 866 HD2 ARG 96 HD2 ARG 96 -11.311 -12.549 11.599 867 HD3 ARG 96 HD1 ARG 96 -10.832 -12.055 13.221 868 HE ARG 96 HE ARG 96 -13.083 -10.675 11.955 869 HH11 ARG 96 HH11 ARG 96 -11.925 -12.922 14.384 870 HH12 ARG 96 HH12 ARG 96 -13.417 -12.925 15.267 871 HH21 ARG 96 HH21 ARG 96 -15.034 -10.675 13.121 872 HH22 ARG 96 HH22 ARG 96 -15.184 -11.645 14.553 873 H LYS 97 HN LYS 97 -8.779 -7.707 8.146 874 HA LYS 97 HA LYS 97 -6.291 -8.808 9.034 875 HB2 LYS 97 HB2 LYS 97 -7.094 -10.643 7.593 876 HB3 LYS 97 HB1 LYS 97 -7.240 -9.517 6.254 877 HG2 LYS 97 HG2 LYS 97 -5.230 -10.814 6.010 878 HG3 LYS 97 HG1 LYS 97 -4.809 -9.135 6.335 879 HD2 LYS 97 HD2 LYS 97 -5.027 -10.934 8.678 880 HD3 LYS 97 HD1 LYS 97 -3.663 -11.207 7.595 881 HE2 LYS 97 HE2 LYS 97 -4.344 -8.524 8.788 882 HE3 LYS 97 HE1 LYS 97 -3.211 -9.658 9.519 883 HZ1 LYS 97 HZ1 LYS 97 -2.186 -7.896 8.109 884 HZ2 LYS 97 HZ2 LYS 97 -2.914 -8.612 6.763 885 HZ3 LYS 97 HZ3 LYS 97 -1.775 -9.476 7.662 886 H ASN 98 HN ASN 98 -5.537 -6.767 9.278 887 HA ASN 98 HA ASN 98 -5.158 -5.260 6.778 888 HB2 ASN 98 HB2 ASN 98 -5.426 -4.138 9.581 889 HB3 ASN 98 HB1 ASN 98 -5.049 -3.195 8.143 890 HD21 ASN 98 HD21 ASN 98 -7.495 -4.814 9.943 891 HD22 ASN 98 HD22 ASN 98 -8.843 -4.265 9.012 Start of MODEL 7 1 H1 LYS 1 HT1 LYS 1 26.712 10.349 5.676 2 H2 LYS 1 HT2 LYS 1 25.748 11.721 5.502 3 H3 LYS 1 HT3 LYS 1 25.160 10.382 6.350 4 HA LYS 1 HA LYS 1 26.968 10.673 7.970 5 HB2 LYS 1 HB2 LYS 1 27.357 13.242 6.441 6 HB3 LYS 1 HB1 LYS 1 28.026 12.937 8.037 7 HG2 LYS 1 HG2 LYS 1 29.250 11.004 7.116 8 HG3 LYS 1 HG1 LYS 1 28.635 11.415 5.516 9 HD2 LYS 1 HD2 LYS 1 29.748 13.576 5.628 10 HD3 LYS 1 HD1 LYS 1 30.330 13.205 7.252 11 HE2 LYS 1 HE2 LYS 1 31.015 11.682 4.743 12 HE3 LYS 1 HE1 LYS 1 32.060 12.841 5.558 13 HZ1 LYS 1 HZ1 LYS 1 31.064 10.300 6.731 14 HZ2 LYS 1 HZ2 LYS 1 32.087 11.403 7.496 15 HZ3 LYS 1 HZ3 LYS 1 32.624 10.560 6.136 16 HA PRO 2 HA PRO 2 24.134 14.225 9.470 17 HB2 PRO 2 HB2 PRO 2 22.183 15.175 7.853 18 HB3 PRO 2 HB1 PRO 2 23.810 15.863 7.890 19 HG2 PRO 2 HG2 PRO 2 22.620 13.928 5.951 20 HG3 PRO 2 HG1 PRO 2 23.644 15.340 5.634 21 HD2 PRO 2 HD2 PRO 2 24.597 12.807 5.662 22 HD3 PRO 2 HD1 PRO 2 25.576 14.204 6.141 23 H VAL 3 HN VAL 3 22.263 13.920 10.642 24 HA VAL 3 HA VAL 3 21.083 11.316 10.375 25 HB VAL 3 HB VAL 3 19.861 11.945 12.466 26 HG11 VAL 3 HG11 VAL 3 22.855 12.281 12.450 27 HG12 VAL 3 HG12 VAL 3 21.964 10.764 12.579 28 HG13 VAL 3 HG13 VAL 3 21.881 11.950 13.882 29 HG21 VAL 3 HG21 VAL 3 19.745 14.359 12.129 30 HG22 VAL 3 HG22 VAL 3 21.501 14.468 12.253 31 HG23 VAL 3 HG23 VAL 3 20.548 13.976 13.651 32 H SER 4 HN SER 4 20.328 12.441 8.160 33 HA SER 4 HA SER 4 17.601 13.469 8.548 34 HB2 SER 4 HB2 SER 4 19.140 14.876 7.195 35 HB3 SER 4 HB1 SER 4 19.347 13.531 6.073 36 HG SER 4 HG SER 4 17.011 13.642 5.775 37 H LEU 5 HN LEU 5 18.507 10.653 8.766 38 HA LEU 5 HA LEU 5 17.644 9.318 6.371 39 HB2 LEU 5 HB2 LEU 5 18.142 8.160 9.110 40 HB3 LEU 5 HB1 LEU 5 18.006 7.261 7.613 41 HG LEU 5 HG LEU 5 20.224 9.148 8.396 42 HD11 LEU 5 HD11 LEU 5 21.611 7.138 8.214 43 HD12 LEU 5 HD12 LEU 5 20.170 6.182 7.875 44 HD13 LEU 5 HD13 LEU 5 20.358 6.967 9.443 45 HD21 LEU 5 HD21 LEU 5 19.779 9.450 6.044 46 HD22 LEU 5 HD22 LEU 5 19.755 7.703 5.792 47 HD23 LEU 5 HD23 LEU 5 21.258 8.508 6.244 48 H SER 6 HN SER 6 16.187 10.464 9.256 49 HA SER 6 HA SER 6 13.818 8.841 9.046 50 HB2 SER 6 HB2 SER 6 14.271 11.357 10.670 51 HB3 SER 6 HB1 SER 6 12.995 10.163 10.908 52 HG SER 6 HG SER 6 14.615 9.714 12.364 53 H TYR 7 HN TYR 7 14.939 11.060 7.079 54 HA TYR 7 HA TYR 7 12.479 12.570 6.658 55 HB2 TYR 7 HB2 TYR 7 14.708 13.699 6.522 56 HB3 TYR 7 HB1 TYR 7 15.104 12.678 5.148 57 HD1 TYR 7 HD1 TYR 7 14.836 13.598 3.047 58 HD2 TYR 7 HD2 TYR 7 12.392 15.011 6.226 59 HE1 TYR 7 HE1 TYR 7 13.827 15.250 1.530 60 HE2 TYR 7 HE2 TYR 7 11.375 16.666 4.720 61 HH TYR 7 HH TYR 7 11.929 17.842 2.639 62 H ARG 8 HN ARG 8 11.729 12.698 4.324 63 HA ARG 8 HA ARG 8 10.943 11.774 2.415 64 HB2 ARG 8 HB2 ARG 8 13.083 9.713 2.901 65 HB3 ARG 8 HB1 ARG 8 12.031 9.715 1.496 66 HG2 ARG 8 HG2 ARG 8 12.894 11.992 0.948 67 HG3 ARG 8 HG1 ARG 8 14.054 11.803 2.264 68 HD2 ARG 8 HD2 ARG 8 15.081 11.226 0.139 69 HD3 ARG 8 HD1 ARG 8 14.954 9.801 1.172 70 HE ARG 8 HE ARG 8 12.681 9.817 -0.390 71 HH11 ARG 8 HH11 ARG 8 16.130 9.645 -0.912 72 HH12 ARG 8 HH12 ARG 8 15.993 8.763 -2.400 73 HH21 ARG 8 HH21 ARG 8 12.480 8.637 -2.339 74 HH22 ARG 8 HH22 ARG 8 13.908 8.169 -3.208 75 H CYS 9 HN CYS 9 10.170 9.428 1.631 76 HA CYS 9 HA CYS 9 7.926 8.894 3.169 77 HB2 CYS 9 HB2 CYS 9 9.249 7.162 1.086 78 HB3 CYS 9 HB1 CYS 9 7.605 7.009 1.654 79 HA PRO 10 HA PRO 10 8.642 6.278 6.550 80 HB2 PRO 10 HB2 PRO 10 6.970 4.281 5.111 81 HB3 PRO 10 HB1 PRO 10 6.869 4.835 6.784 82 HG2 PRO 10 HG2 PRO 10 5.209 5.743 4.886 83 HG3 PRO 10 HG1 PRO 10 5.756 6.742 6.235 84 HD2 PRO 10 HD2 PRO 10 6.465 6.916 3.388 85 HD3 PRO 10 HD1 PRO 10 6.605 8.138 4.660 86 H CYS 11 HN CYS 11 8.483 4.162 3.683 87 HA CYS 11 HA CYS 11 10.565 2.518 4.852 88 HB2 CYS 11 HB2 CYS 11 8.411 1.668 3.659 89 HB3 CYS 11 HB1 CYS 11 9.342 1.941 2.193 90 H ARG 12 HN ARG 12 12.532 2.182 4.083 91 HA ARG 12 HA ARG 12 13.712 4.008 2.237 92 HB2 ARG 12 HB2 ARG 12 14.758 1.550 3.633 93 HB3 ARG 12 HB1 ARG 12 15.694 2.400 2.425 94 HG2 ARG 12 HG2 ARG 12 16.390 3.166 4.565 95 HG3 ARG 12 HG1 ARG 12 15.494 4.467 3.777 96 HD2 ARG 12 HD2 ARG 12 13.469 3.509 4.996 97 HD3 ARG 12 HD1 ARG 12 14.638 2.668 6.008 98 HE ARG 12 HE ARG 12 15.146 5.487 5.793 99 HH11 ARG 12 HH11 ARG 12 13.323 3.032 7.496 100 HH12 ARG 12 HH12 ARG 12 13.081 4.008 8.907 101 HH21 ARG 12 HH21 ARG 12 14.805 6.789 7.647 102 HH22 ARG 12 HH22 ARG 12 13.922 6.140 8.995 103 H PHE 13 HN PHE 13 15.372 2.367 0.658 104 HA PHE 13 HA PHE 13 13.462 2.141 -1.454 105 HB2 PHE 13 HB2 PHE 13 16.400 1.403 -1.456 106 HB3 PHE 13 HB1 PHE 13 15.393 1.668 -2.875 107 HD1 PHE 13 HD1 PHE 13 15.009 3.842 -3.711 108 HD2 PHE 13 HD2 PHE 13 16.956 3.322 0.032 109 HE1 PHE 13 HE1 PHE 13 15.617 6.211 -3.707 110 HE2 PHE 13 HE2 PHE 13 17.565 5.695 0.045 111 HZ PHE 13 HZ PHE 13 16.906 7.149 -1.810 112 H PHE 14 HN PHE 14 12.835 0.364 -2.550 113 HA PHE 14 HA PHE 14 12.482 -1.901 -0.802 114 HB2 PHE 14 HB2 PHE 14 11.150 -2.156 -3.338 115 HB3 PHE 14 HB1 PHE 14 10.461 -1.959 -1.738 116 HD1 PHE 14 HD1 PHE 14 9.742 0.176 -0.930 117 HD2 PHE 14 HD2 PHE 14 11.562 -0.198 -4.762 118 HE1 PHE 14 HE1 PHE 14 8.990 2.443 -1.506 119 HE2 PHE 14 HE2 PHE 14 10.813 2.070 -5.343 120 HZ PHE 14 HZ PHE 14 9.524 3.397 -3.715 121 H GLU 15 HN GLU 15 12.339 -4.180 -1.959 122 HA GLU 15 HA GLU 15 14.971 -4.469 -3.182 123 HB2 GLU 15 HB2 GLU 15 15.221 -6.280 -1.870 124 HB3 GLU 15 HB1 GLU 15 13.881 -5.612 -0.975 125 HG2 GLU 15 HG2 GLU 15 13.561 -7.508 -3.187 126 HG3 GLU 15 HG1 GLU 15 13.742 -8.016 -1.534 127 H SER 16 HN SER 16 15.187 -5.784 -5.050 128 HA SER 16 HA SER 16 12.614 -6.284 -6.402 129 HB2 SER 16 HB2 SER 16 15.235 -5.543 -7.735 130 HB3 SER 16 HB1 SER 16 13.666 -5.737 -8.517 131 HG SER 16 HG SER 16 13.176 -4.007 -6.704 132 H HIS 17 HN HIS 17 13.903 -8.103 -4.728 133 HA HIS 17 HA HIS 17 14.783 -10.141 -6.642 134 HB2 HIS 17 HB2 HIS 17 16.753 -9.169 -5.494 135 HB3 HIS 17 HB1 HIS 17 16.053 -9.625 -3.948 136 HD1 HIS 17 HD1 HIS 17 17.646 -11.127 -7.016 137 HD2 HIS 17 HD2 HIS 17 16.412 -12.272 -3.215 138 HE1 HIS 17 HE1 HIS 17 18.574 -13.435 -6.669 139 HE2 HIS 17 HE2 HIS 17 17.688 -14.165 -4.427 140 H ILE 18 HN ILE 18 12.934 -9.248 -3.856 141 HA ILE 18 HA ILE 18 12.621 -11.967 -2.947 142 HB ILE 18 HB ILE 18 11.340 -9.385 -2.157 143 HG12 ILE 18 HG12 ILE 18 12.976 -11.390 -0.625 144 HG13 ILE 18 HG11 ILE 18 13.666 -10.018 -1.472 145 HG21 ILE 18 HG21 ILE 18 9.585 -11.084 -2.014 146 HG22 ILE 18 HG22 ILE 18 10.101 -10.553 -0.413 147 HG23 ILE 18 HG23 ILE 18 10.656 -12.102 -1.050 148 HD11 ILE 18 HD11 ILE 18 13.416 -9.651 0.938 149 HD12 ILE 18 HD12 ILE 18 11.669 -9.830 0.766 150 HD13 ILE 18 HD13 ILE 18 12.504 -8.491 -0.029 151 H ALA 19 HN ALA 19 10.980 -13.328 -3.192 152 HA ALA 19 HA ALA 19 9.141 -12.786 -5.421 153 HB1 ALA 19 HB1 ALA 19 10.101 -15.443 -4.376 154 HB2 ALA 19 HB2 ALA 19 10.775 -14.601 -5.772 155 HB3 ALA 19 HB3 ALA 19 9.107 -15.172 -5.807 156 H ARG 20 HN ARG 20 7.029 -13.839 -5.314 157 HA ARG 20 HA ARG 20 5.605 -13.302 -2.980 158 HB2 ARG 20 HB2 ARG 20 4.758 -13.549 -5.365 159 HB3 ARG 20 HB1 ARG 20 4.817 -15.287 -5.101 160 HG2 ARG 20 HG2 ARG 20 3.202 -15.111 -3.328 161 HG3 ARG 20 HG1 ARG 20 3.186 -13.352 -3.478 162 HD2 ARG 20 HD2 ARG 20 2.414 -13.584 -5.798 163 HD3 ARG 20 HD1 ARG 20 2.370 -15.334 -5.594 164 HE ARG 20 HE ARG 20 0.804 -14.214 -3.578 165 HH11 ARG 20 HH11 ARG 20 0.810 -14.455 -7.071 166 HH12 ARG 20 HH12 ARG 20 -0.921 -14.455 -7.202 167 HH21 ARG 20 HH21 ARG 20 -1.481 -14.200 -3.748 168 HH22 ARG 20 HH22 ARG 20 -2.221 -14.301 -5.316 169 H ALA 21 HN ALA 21 7.012 -16.272 -4.231 170 HA ALA 21 HA ALA 21 5.869 -17.921 -2.182 171 HB1 ALA 21 HB1 ALA 21 6.347 -18.787 -4.434 172 HB2 ALA 21 HB2 ALA 21 7.139 -19.725 -3.168 173 HB3 ALA 21 HB3 ALA 21 8.070 -18.574 -4.126 174 H ASN 22 HN ASN 22 8.411 -15.799 -2.251 175 HA ASN 22 HA ASN 22 9.897 -17.282 -0.226 176 HB2 ASN 22 HB2 ASN 22 10.639 -15.341 -2.321 177 HB3 ASN 22 HB1 ASN 22 11.467 -15.136 -0.784 178 HD21 ASN 22 HD21 ASN 22 13.447 -15.766 -1.513 179 HD22 ASN 22 HD22 ASN 22 13.813 -17.386 -1.982 180 H VAL 23 HN VAL 23 7.612 -14.895 -0.538 181 HA VAL 23 HA VAL 23 8.583 -13.440 1.808 182 HB VAL 23 HB VAL 23 8.060 -12.014 -0.093 183 HG11 VAL 23 HG11 VAL 23 5.697 -11.731 -0.800 184 HG12 VAL 23 HG12 VAL 23 5.286 -13.154 0.165 185 HG13 VAL 23 HG13 VAL 23 6.370 -13.308 -1.223 186 HG21 VAL 23 HG21 VAL 23 7.783 -11.131 2.105 187 HG22 VAL 23 HG22 VAL 23 6.132 -11.749 2.173 188 HG23 VAL 23 HG23 VAL 23 6.547 -10.478 1.022 189 H LYS 24 HN LYS 24 7.389 -13.099 3.535 190 HA LYS 24 HA LYS 24 5.173 -14.888 4.085 191 HB2 LYS 24 HB2 LYS 24 6.709 -13.038 5.922 192 HB3 LYS 24 HB1 LYS 24 5.457 -14.157 6.423 193 HG2 LYS 24 HG2 LYS 24 7.022 -15.901 5.257 194 HG3 LYS 24 HG1 LYS 24 8.237 -14.678 5.612 195 HD2 LYS 24 HD2 LYS 24 6.326 -15.552 7.736 196 HD3 LYS 24 HD1 LYS 24 7.744 -16.522 7.372 197 HE2 LYS 24 HE2 LYS 24 9.191 -14.645 7.829 198 HE3 LYS 24 HE1 LYS 24 7.796 -13.598 8.089 199 HZ1 LYS 24 HZ1 LYS 24 8.495 -15.969 9.732 200 HZ2 LYS 24 HZ2 LYS 24 7.185 -14.934 9.994 201 HZ3 LYS 24 HZ3 LYS 24 8.763 -14.357 10.176 202 H HIS 25 HN HIS 25 4.085 -13.240 6.124 203 HA HIS 25 HA HIS 25 1.872 -12.122 5.203 204 HB2 HIS 25 HB2 HIS 25 3.380 -10.382 7.107 205 HB3 HIS 25 HB1 HIS 25 1.688 -10.842 7.141 206 HD1 HIS 25 HD1 HIS 25 3.017 -10.887 9.721 207 HD2 HIS 25 HD2 HIS 25 3.263 -14.190 7.210 208 HE1 HIS 25 HE1 HIS 25 3.588 -12.823 11.201 209 HE2 HIS 25 HE2 HIS 25 3.614 -14.829 9.689 210 H LEU 26 HN LEU 26 1.295 -10.507 3.822 211 HA LEU 26 HA LEU 26 3.353 -8.500 3.207 212 HB2 LEU 26 HB2 LEU 26 2.972 -10.174 1.413 213 HB3 LEU 26 HB1 LEU 26 1.322 -9.600 1.267 214 HG LEU 26 HG LEU 26 2.035 -7.490 0.432 215 HD11 LEU 26 HD11 LEU 26 3.868 -7.125 1.983 216 HD12 LEU 26 HD12 LEU 26 4.390 -6.857 0.326 217 HD13 LEU 26 HD13 LEU 26 4.824 -8.349 1.159 218 HD21 LEU 26 HD21 LEU 26 2.169 -8.757 -1.462 219 HD22 LEU 26 HD22 LEU 26 3.302 -9.900 -0.744 220 HD23 LEU 26 HD23 LEU 26 3.887 -8.332 -1.322 221 H LYS 27 HN LYS 27 2.817 -6.455 3.244 222 HA LYS 27 HA LYS 27 0.025 -5.619 3.590 223 HB2 LYS 27 HB2 LYS 27 0.691 -5.882 5.841 224 HB3 LYS 27 HB1 LYS 27 2.300 -5.266 5.522 225 HG2 LYS 27 HG2 LYS 27 1.128 -3.635 6.784 226 HG3 LYS 27 HG1 LYS 27 1.313 -3.032 5.133 227 HD2 LYS 27 HD2 LYS 27 -0.923 -2.546 5.932 228 HD3 LYS 27 HD1 LYS 27 -1.007 -3.757 4.656 229 HE2 LYS 27 HE2 LYS 27 -1.273 -5.518 6.294 230 HE3 LYS 27 HE1 LYS 27 -1.070 -4.360 7.608 231 HZ1 LYS 27 HZ1 LYS 27 -3.300 -4.402 5.645 232 HZ2 LYS 27 HZ2 LYS 27 -3.094 -3.240 6.854 233 HZ3 LYS 27 HZ3 LYS 27 -3.391 -4.850 7.274 234 H ILE 28 HN ILE 28 -0.301 -3.338 3.135 235 HA ILE 28 HA ILE 28 1.962 -2.104 1.712 236 HB ILE 28 HB ILE 28 -0.915 -1.385 1.235 237 HG12 ILE 28 HG12 ILE 28 0.560 -3.147 -0.656 238 HG13 ILE 28 HG11 ILE 28 -0.097 -3.890 0.799 239 HG21 ILE 28 HG21 ILE 28 0.032 -0.580 -0.917 240 HG22 ILE 28 HG22 ILE 28 1.645 -1.024 -0.343 241 HG23 ILE 28 HG23 ILE 28 0.722 0.234 0.487 242 HD11 ILE 28 HD11 ILE 28 -2.304 -3.060 0.209 243 HD12 ILE 28 HD12 ILE 28 -1.627 -4.090 -1.054 244 HD13 ILE 28 HD13 ILE 28 -1.637 -2.336 -1.251 245 H LEU 29 HN LEU 29 2.706 -0.225 2.494 246 HA LEU 29 HA LEU 29 1.536 0.883 4.875 247 HB2 LEU 29 HB2 LEU 29 4.054 0.753 4.128 248 HB3 LEU 29 HB1 LEU 29 3.683 2.251 3.299 249 HG LEU 29 HG LEU 29 4.739 2.678 5.455 250 HD11 LEU 29 HD11 LEU 29 1.829 3.488 5.365 251 HD12 LEU 29 HD12 LEU 29 3.211 4.372 4.711 252 HD13 LEU 29 HD13 LEU 29 3.039 4.178 6.454 253 HD21 LEU 29 HD21 LEU 29 3.997 0.646 6.600 254 HD22 LEU 29 HD22 LEU 29 2.357 1.291 6.676 255 HD23 LEU 29 HD23 LEU 29 3.662 2.094 7.546 256 H ASN 30 HN ASN 30 -0.025 2.334 4.917 257 HA ASN 30 HA ASN 30 -0.820 3.824 2.602 258 HB2 ASN 30 HB2 ASN 30 -1.622 3.816 5.493 259 HB3 ASN 30 HB1 ASN 30 -2.193 5.073 4.413 260 HD21 ASN 30 HD21 ASN 30 -1.628 1.784 3.383 261 HD22 ASN 30 HD22 ASN 30 -3.288 1.372 3.130 262 H THR 31 HN THR 31 0.901 5.070 1.923 263 HA THR 31 HA THR 31 2.403 6.621 3.794 264 HB THR 31 HB THR 31 3.427 7.319 1.481 265 HG1 THR 31 HG1 THR 31 2.543 4.789 0.701 266 HG21 THR 31 HG21 THR 31 3.647 4.634 2.804 267 HG22 THR 31 HG22 THR 31 4.608 6.078 3.129 268 HG23 THR 31 HG23 THR 31 4.776 5.230 1.592 269 HA PRO 32 HA PRO 32 1.351 10.963 3.314 270 HB2 PRO 32 HB2 PRO 32 3.870 10.924 1.694 271 HB3 PRO 32 HB1 PRO 32 3.337 12.090 2.911 272 HG2 PRO 32 HG2 PRO 32 5.089 10.186 3.526 273 HG3 PRO 32 HG1 PRO 32 3.843 10.679 4.674 274 HD2 PRO 32 HD2 PRO 32 4.085 8.196 3.123 275 HD3 PRO 32 HD1 PRO 32 3.227 8.504 4.639 276 H ASN 33 HN ASN 33 1.071 8.869 0.764 277 HA ASN 33 HA ASN 33 0.462 8.954 -1.407 278 HB2 ASN 33 HB2 ASN 33 -0.446 10.790 -2.351 279 HB3 ASN 33 HB1 ASN 33 -0.262 11.508 -0.764 280 HD21 ASN 33 HD21 ASN 33 1.526 12.937 -0.420 281 HD22 ASN 33 HD22 ASN 33 2.227 13.787 -1.757 282 H CYS 34 HN CYS 34 2.713 8.165 -0.441 283 HA CYS 34 HA CYS 34 4.780 8.813 -2.390 284 HB2 CYS 34 HB2 CYS 34 4.656 6.914 -0.029 285 HB3 CYS 34 HB1 CYS 34 6.051 7.085 -1.066 286 H ALA 35 HN ALA 35 5.709 6.744 -3.490 287 HA ALA 35 HA ALA 35 3.785 5.144 -4.707 288 HB1 ALA 35 HB1 ALA 35 5.604 3.591 -5.240 289 HB2 ALA 35 HB2 ALA 35 6.650 4.413 -4.079 290 HB3 ALA 35 HB3 ALA 35 6.092 5.264 -5.521 291 H LEU 36 HN LEU 36 2.523 3.592 -3.932 292 HA LEU 36 HA LEU 36 2.114 2.921 -1.383 293 HB2 LEU 36 HB2 LEU 36 1.356 0.684 -2.636 294 HB3 LEU 36 HB1 LEU 36 0.460 2.183 -2.636 295 HG LEU 36 HG LEU 36 2.439 1.791 -4.805 296 HD11 LEU 36 HD11 LEU 36 0.787 0.586 -6.143 297 HD12 LEU 36 HD12 LEU 36 -0.276 0.479 -4.740 298 HD13 LEU 36 HD13 LEU 36 1.278 -0.355 -4.736 299 HD21 LEU 36 HD21 LEU 36 -0.356 2.848 -4.974 300 HD22 LEU 36 HD22 LEU 36 1.063 3.286 -5.930 301 HD23 LEU 36 HD23 LEU 36 0.925 3.819 -4.248 302 H GLN 37 HN GLN 37 3.749 2.311 -0.041 303 HA GLN 37 HA GLN 37 5.833 0.563 -0.952 304 HB2 GLN 37 HB2 GLN 37 5.252 1.794 1.735 305 HB3 GLN 37 HB1 GLN 37 6.666 0.805 1.393 306 HG2 GLN 37 HG2 GLN 37 7.668 2.421 0.155 307 HG3 GLN 37 HG1 GLN 37 6.136 3.103 -0.399 308 HE21 GLN 37 HE21 GLN 37 6.638 5.153 0.072 309 HE22 GLN 37 HE22 GLN 37 6.708 5.739 1.692 310 H ILE 38 HN ILE 38 5.561 -1.458 -1.087 311 HA ILE 38 HA ILE 38 3.580 -2.884 0.443 312 HB ILE 38 HB ILE 38 5.394 -3.707 -1.827 313 HG12 ILE 38 HG12 ILE 38 2.423 -3.195 -1.898 314 HG13 ILE 38 HG11 ILE 38 3.595 -1.912 -2.168 315 HG21 ILE 38 HG21 ILE 38 4.891 -5.747 -0.938 316 HG22 ILE 38 HG22 ILE 38 3.492 -5.513 -1.990 317 HG23 ILE 38 HG23 ILE 38 3.355 -5.200 -0.259 318 HD11 ILE 38 HD11 ILE 38 3.339 -4.419 -3.804 319 HD12 ILE 38 HD12 ILE 38 4.469 -3.093 -4.092 320 HD13 ILE 38 HD13 ILE 38 2.732 -2.821 -4.247 321 H VAL 39 HN VAL 39 4.200 -3.412 2.443 322 HA VAL 39 HA VAL 39 7.012 -3.949 2.982 323 HB VAL 39 HB VAL 39 5.602 -2.357 4.402 324 HG11 VAL 39 HG11 VAL 39 4.546 -4.923 5.544 325 HG12 VAL 39 HG12 VAL 39 3.617 -3.716 4.657 326 HG13 VAL 39 HG13 VAL 39 4.319 -3.312 6.226 327 HG21 VAL 39 HG21 VAL 39 7.140 -4.591 5.727 328 HG22 VAL 39 HG22 VAL 39 6.728 -3.052 6.487 329 HG23 VAL 39 HG23 VAL 39 7.800 -3.084 5.087 330 H ALA 40 HN ALA 40 7.804 -5.863 3.463 331 HA ALA 40 HA ALA 40 5.961 -8.141 3.713 332 HB1 ALA 40 HB1 ALA 40 7.378 -9.368 2.113 333 HB2 ALA 40 HB2 ALA 40 8.328 -7.905 1.861 334 HB3 ALA 40 HB3 ALA 40 6.631 -7.945 1.391 335 H ARG 41 HN ARG 41 6.923 -10.034 4.648 336 HA ARG 41 HA ARG 41 9.516 -9.580 5.980 337 HB2 ARG 41 HB2 ARG 41 7.041 -11.007 6.902 338 HB3 ARG 41 HB1 ARG 41 8.618 -11.433 7.559 339 HG2 ARG 41 HG2 ARG 41 7.974 -8.563 7.531 340 HG3 ARG 41 HG1 ARG 41 7.023 -9.559 8.615 341 HD2 ARG 41 HD2 ARG 41 9.061 -10.431 9.628 342 HD3 ARG 41 HD1 ARG 41 10.023 -9.449 8.528 343 HE ARG 41 HE ARG 41 8.279 -7.749 9.897 344 HH11 ARG 41 HH11 ARG 41 11.009 -9.831 10.614 345 HH12 ARG 41 HH12 ARG 41 11.549 -8.863 11.949 346 HH21 ARG 41 HH21 ARG 41 9.002 -6.476 11.642 347 HH22 ARG 41 HH22 ARG 41 10.409 -6.957 12.535 348 H LEU 42 HN LEU 42 11.116 -10.971 5.447 349 HA LEU 42 HA LEU 42 10.742 -12.832 3.363 350 HB2 LEU 42 HB2 LEU 42 12.971 -12.148 5.206 351 HB3 LEU 42 HB1 LEU 42 13.077 -13.665 4.335 352 HG LEU 42 HG LEU 42 12.588 -11.060 2.920 353 HD11 LEU 42 HD11 LEU 42 15.219 -12.350 3.635 354 HD12 LEU 42 HD12 LEU 42 14.656 -10.743 4.094 355 HD13 LEU 42 HD13 LEU 42 15.030 -11.098 2.409 356 HD21 LEU 42 HD21 LEU 42 13.549 -12.328 1.032 357 HD22 LEU 42 HD22 LEU 42 12.079 -13.066 1.663 358 HD23 LEU 42 HD23 LEU 42 13.654 -13.750 2.067 359 H LYS 43 HN LYS 43 10.591 -15.006 3.271 360 HA LYS 43 HA LYS 43 9.071 -16.291 5.188 361 HB2 LYS 43 HB2 LYS 43 9.406 -16.887 2.755 362 HB3 LYS 43 HB1 LYS 43 10.880 -17.687 3.261 363 HG2 LYS 43 HG2 LYS 43 9.630 -19.209 4.654 364 HG3 LYS 43 HG1 LYS 43 8.127 -18.368 4.262 365 HD2 LYS 43 HD2 LYS 43 8.185 -20.269 2.864 366 HD3 LYS 43 HD1 LYS 43 8.627 -18.904 1.834 367 HE2 LYS 43 HE2 LYS 43 10.163 -20.591 1.287 368 HE3 LYS 43 HE1 LYS 43 11.041 -19.504 2.364 369 HZ1 LYS 43 HZ1 LYS 43 11.353 -21.891 2.855 370 HZ2 LYS 43 HZ2 LYS 43 9.718 -21.997 3.268 371 HZ3 LYS 43 HZ3 LYS 43 10.756 -21.003 4.164 372 H ASN 44 HN ASN 44 12.457 -17.049 4.437 373 HA ASN 44 HA ASN 44 12.713 -18.505 6.909 374 HB2 ASN 44 HB2 ASN 44 14.573 -17.970 4.625 375 HB3 ASN 44 HB1 ASN 44 15.108 -18.785 6.084 376 HD21 ASN 44 HD21 ASN 44 15.595 -20.590 4.867 377 HD22 ASN 44 HD22 ASN 44 14.372 -21.684 4.319 378 H ASN 45 HN ASN 45 14.393 -15.776 5.412 379 HA ASN 45 HA ASN 45 16.079 -15.130 7.515 380 HB2 ASN 45 HB2 ASN 45 15.871 -14.208 5.051 381 HB3 ASN 45 HB1 ASN 45 14.981 -12.929 5.852 382 HD21 ASN 45 HD21 ASN 45 16.052 -11.590 7.310 383 HD22 ASN 45 HD22 ASN 45 17.767 -11.468 7.328 384 H ASN 46 HN ASN 46 12.740 -14.226 7.006 385 HA ASN 46 HA ASN 46 11.153 -13.441 8.413 386 HB2 ASN 46 HB2 ASN 46 12.272 -14.985 10.048 387 HB3 ASN 46 HB1 ASN 46 13.196 -13.605 10.622 388 HD21 ASN 46 HD21 ASN 46 12.333 -13.725 12.680 389 HD22 ASN 46 HD22 ASN 46 10.700 -13.287 13.031 390 H ARG 47 HN ARG 47 13.647 -11.672 7.415 391 HA ARG 47 HA ARG 47 13.313 -9.389 9.126 392 HB2 ARG 47 HB2 ARG 47 14.862 -8.254 7.700 393 HB3 ARG 47 HB1 ARG 47 15.459 -9.887 7.924 394 HG2 ARG 47 HG2 ARG 47 15.070 -10.498 5.792 395 HG3 ARG 47 HG1 ARG 47 13.777 -9.317 5.562 396 HD2 ARG 47 HD2 ARG 47 16.655 -8.571 5.954 397 HD3 ARG 47 HD1 ARG 47 15.945 -8.848 4.362 398 HE ARG 47 HE ARG 47 14.570 -6.923 6.046 399 HH11 ARG 47 HH11 ARG 47 16.931 -7.416 3.502 400 HH12 ARG 47 HH12 ARG 47 16.800 -5.793 2.901 401 HH21 ARG 47 HH21 ARG 47 14.394 -4.808 5.261 402 HH22 ARG 47 HH22 ARG 47 15.357 -4.305 3.906 403 H GLN 48 HN GLN 48 12.443 -7.444 8.538 404 HA GLN 48 HA GLN 48 10.214 -7.592 6.701 405 HB2 GLN 48 HB2 GLN 48 10.122 -6.520 9.019 406 HB3 GLN 48 HB1 GLN 48 11.042 -5.192 8.323 407 HG2 GLN 48 HG2 GLN 48 9.297 -4.797 6.703 408 HG3 GLN 48 HG1 GLN 48 8.380 -6.163 7.336 409 HE21 GLN 48 HE21 GLN 48 9.379 -2.895 7.850 410 HE22 GLN 48 HE22 GLN 48 8.330 -2.569 9.185 411 H VAL 49 HN VAL 49 10.059 -6.415 4.855 412 HA VAL 49 HA VAL 49 12.192 -4.624 4.007 413 HB VAL 49 HB VAL 49 13.043 -6.868 3.417 414 HG11 VAL 49 HG11 VAL 49 11.867 -8.310 1.889 415 HG12 VAL 49 HG12 VAL 49 10.550 -7.150 1.751 416 HG13 VAL 49 HG13 VAL 49 10.845 -7.972 3.283 417 HG21 VAL 49 HG21 VAL 49 13.681 -5.114 1.906 418 HG22 VAL 49 HG22 VAL 49 12.140 -5.221 1.053 419 HG23 VAL 49 HG23 VAL 49 13.301 -6.547 0.943 420 H CYS 50 HN CYS 50 11.530 -3.493 1.992 421 HA CYS 50 HA CYS 50 8.659 -3.733 1.486 422 HB2 CYS 50 HB2 CYS 50 10.586 -1.445 1.152 423 HB3 CYS 50 HB1 CYS 50 9.011 -1.436 0.387 424 H ILE 51 HN ILE 51 7.976 -4.344 -0.460 425 HA ILE 51 HA ILE 51 9.924 -5.468 -2.280 426 HB ILE 51 HB ILE 51 7.044 -5.378 -2.994 427 HG12 ILE 51 HG12 ILE 51 8.111 -7.040 -0.703 428 HG13 ILE 51 HG11 ILE 51 6.872 -5.786 -0.603 429 HG21 ILE 51 HG21 ILE 51 7.431 -7.539 -3.865 430 HG22 ILE 51 HG22 ILE 51 8.932 -7.712 -2.956 431 HG23 ILE 51 HG23 ILE 51 8.841 -6.573 -4.299 432 HD11 ILE 51 HD11 ILE 51 6.643 -8.433 -2.023 433 HD12 ILE 51 HD12 ILE 51 5.418 -7.168 -2.042 434 HD13 ILE 51 HD13 ILE 51 5.844 -7.961 -0.527 435 H ASP 52 HN ASP 52 10.337 -4.805 -4.376 436 HA ASP 52 HA ASP 52 9.875 -2.069 -5.003 437 HB2 ASP 52 HB2 ASP 52 11.781 -3.561 -5.830 438 HB3 ASP 52 HB1 ASP 52 10.636 -4.192 -7.003 439 HA PRO 53 HA PRO 53 5.684 -2.518 -6.352 440 HB2 PRO 53 HB2 PRO 53 5.448 -0.072 -7.532 441 HB3 PRO 53 HB1 PRO 53 5.353 -0.345 -5.789 442 HG2 PRO 53 HG2 PRO 53 7.664 0.596 -7.438 443 HG3 PRO 53 HG1 PRO 53 7.097 1.185 -5.864 444 HD2 PRO 53 HD2 PRO 53 9.197 -0.465 -6.080 445 HD3 PRO 53 HD1 PRO 53 8.069 -0.571 -4.719 446 H LYS 54 HN LYS 54 8.366 -2.180 -8.402 447 HA LYS 54 HA LYS 54 6.718 -2.323 -10.818 448 HB2 LYS 54 HB2 LYS 54 9.694 -1.857 -10.581 449 HB3 LYS 54 HB1 LYS 54 8.745 -1.793 -12.060 450 HG2 LYS 54 HG2 LYS 54 7.731 -0.039 -9.971 451 HG3 LYS 54 HG1 LYS 54 9.376 0.343 -10.478 452 HD2 LYS 54 HD2 LYS 54 7.483 1.490 -11.728 453 HD3 LYS 54 HD1 LYS 54 8.716 0.704 -12.713 454 HE2 LYS 54 HE2 LYS 54 7.276 -1.128 -13.161 455 HE3 LYS 54 HE1 LYS 54 6.140 -0.598 -11.932 456 HZ1 LYS 54 HZ1 LYS 54 6.757 0.910 -14.407 457 HZ2 LYS 54 HZ2 LYS 54 5.577 1.302 -13.263 458 HZ3 LYS 54 HZ3 LYS 54 5.408 -0.089 -14.210 459 H LEU 55 HN LEU 55 8.120 -4.392 -8.689 460 HA LEU 55 HA LEU 55 9.250 -6.401 -10.247 461 HB2 LEU 55 HB2 LEU 55 7.932 -6.166 -7.613 462 HB3 LEU 55 HB1 LEU 55 8.064 -7.789 -8.269 463 HG LEU 55 HG LEU 55 10.415 -5.925 -7.977 464 HD11 LEU 55 HD11 LEU 55 9.236 -7.881 -6.038 465 HD12 LEU 55 HD12 LEU 55 9.743 -6.208 -5.776 466 HD13 LEU 55 HD13 LEU 55 10.951 -7.468 -6.014 467 HD21 LEU 55 HD21 LEU 55 10.188 -8.895 -8.418 468 HD22 LEU 55 HD22 LEU 55 11.695 -8.012 -8.166 469 HD23 LEU 55 HD23 LEU 55 10.711 -7.691 -9.594 470 H LYS 56 HN LYS 56 8.406 -8.121 -11.352 471 HA LYS 56 HA LYS 56 6.034 -7.472 -12.739 472 HB2 LYS 56 HB2 LYS 56 7.687 -9.994 -12.824 473 HB3 LYS 56 HB1 LYS 56 6.414 -9.586 -13.964 474 HG2 LYS 56 HG2 LYS 56 9.005 -8.116 -13.543 475 HG3 LYS 56 HG1 LYS 56 8.547 -9.088 -14.940 476 HD2 LYS 56 HD2 LYS 56 7.189 -6.542 -14.051 477 HD3 LYS 56 HD1 LYS 56 8.338 -6.679 -15.380 478 HE2 LYS 56 HE2 LYS 56 5.688 -8.112 -15.219 479 HE3 LYS 56 HE1 LYS 56 5.990 -6.641 -16.140 480 HZ1 LYS 56 HZ1 LYS 56 7.297 -9.268 -16.583 481 HZ2 LYS 56 HZ2 LYS 56 7.627 -7.855 -17.450 482 HZ3 LYS 56 HZ3 LYS 56 6.103 -8.574 -17.555 483 H TRP 57 HN TRP 57 6.698 -9.711 -10.116 484 HA TRP 57 HA TRP 57 4.039 -10.832 -10.312 485 HB2 TRP 57 HB2 TRP 57 4.594 -12.186 -8.450 486 HB3 TRP 57 HB1 TRP 57 6.051 -12.097 -9.420 487 HD1 TRP 57 HD1 TRP 57 8.162 -10.916 -8.333 488 HE1 TRP 57 HE1 TRP 57 8.729 -10.249 -5.906 489 HE3 TRP 57 HE3 TRP 57 3.485 -11.225 -6.315 490 HZ2 TRP 57 HZ2 TRP 57 7.356 -9.911 -3.463 491 HZ3 TRP 57 HZ3 TRP 57 3.187 -10.698 -3.936 492 HH2 TRP 57 HH2 TRP 57 5.086 -10.064 -2.535 493 H ILE 58 HN ILE 58 5.616 -8.192 -8.817 494 HA ILE 58 HA ILE 58 3.713 -7.717 -6.757 495 HB ILE 58 HB ILE 58 5.977 -6.172 -7.947 496 HG12 ILE 58 HG12 ILE 58 6.394 -7.916 -6.259 497 HG13 ILE 58 HG11 ILE 58 6.854 -6.316 -5.684 498 HG21 ILE 58 HG21 ILE 58 4.136 -4.581 -7.568 499 HG22 ILE 58 HG22 ILE 58 5.544 -4.297 -6.538 500 HG23 ILE 58 HG23 ILE 58 4.108 -5.070 -5.871 501 HD11 ILE 58 HD11 ILE 58 4.244 -7.640 -5.030 502 HD12 ILE 58 HD12 ILE 58 4.911 -6.173 -4.321 503 HD13 ILE 58 HD13 ILE 58 5.673 -7.731 -4.016 504 H GLN 59 HN GLN 59 4.169 -6.565 -10.046 505 HA GLN 59 HA GLN 59 2.224 -4.600 -10.197 506 HB2 GLN 59 HB2 GLN 59 3.118 -6.680 -12.147 507 HB3 GLN 59 HB1 GLN 59 1.975 -5.425 -12.598 508 HG2 GLN 59 HG2 GLN 59 4.702 -4.877 -11.472 509 HG3 GLN 59 HG1 GLN 59 4.380 -5.012 -13.202 510 HE21 GLN 59 HE21 GLN 59 4.019 -3.063 -10.361 511 HE22 GLN 59 HE22 GLN 59 3.398 -1.661 -11.159 512 H GLU 60 HN GLU 60 1.875 -8.069 -10.221 513 HA GLU 60 HA GLU 60 -0.916 -8.121 -10.753 514 HB2 GLU 60 HB2 GLU 60 0.900 -10.122 -9.398 515 HB3 GLU 60 HB1 GLU 60 -0.782 -10.438 -9.794 516 HG2 GLU 60 HG2 GLU 60 1.387 -9.784 -11.773 517 HG3 GLU 60 HG1 GLU 60 0.753 -11.396 -11.435 518 H TYR 61 HN TYR 61 1.032 -7.857 -7.852 519 HA TYR 61 HA TYR 61 -1.169 -8.206 -6.035 520 HB2 TYR 61 HB2 TYR 61 1.096 -8.772 -5.322 521 HB3 TYR 61 HB1 TYR 61 1.635 -7.138 -5.639 522 HD1 TYR 61 HD1 TYR 61 -0.229 -9.275 -3.373 523 HD2 TYR 61 HD2 TYR 61 1.160 -5.333 -4.116 524 HE1 TYR 61 HE1 TYR 61 -0.702 -8.675 -1.057 525 HE2 TYR 61 HE2 TYR 61 0.686 -4.722 -1.782 526 HH TYR 61 HH TYR 61 0.114 -6.981 0.619 527 H LEU 62 HN LEU 62 0.509 -5.663 -7.635 528 HA LEU 62 HA LEU 62 -0.352 -3.404 -6.323 529 HB2 LEU 62 HB2 LEU 62 0.911 -4.083 -8.751 530 HB3 LEU 62 HB1 LEU 62 -0.363 -2.920 -9.121 531 HG LEU 62 HG LEU 62 0.723 -1.591 -7.121 532 HD11 LEU 62 HD11 LEU 62 3.023 -3.215 -8.166 533 HD12 LEU 62 HD12 LEU 62 2.273 -3.420 -6.582 534 HD13 LEU 62 HD13 LEU 62 3.104 -1.912 -6.976 535 HD21 LEU 62 HD21 LEU 62 2.135 -0.411 -8.743 536 HD22 LEU 62 HD22 LEU 62 0.540 -0.770 -9.405 537 HD23 LEU 62 HD23 LEU 62 1.932 -1.742 -9.881 538 H GLU 63 HN GLU 63 -1.887 -5.223 -8.914 539 HA GLU 63 HA GLU 63 -4.020 -3.599 -9.484 540 HB2 GLU 63 HB2 GLU 63 -4.011 -6.590 -9.267 541 HB3 GLU 63 HB1 GLU 63 -5.212 -5.638 -10.108 542 HG2 GLU 63 HG2 GLU 63 -3.444 -4.754 -11.553 543 HG3 GLU 63 HG1 GLU 63 -2.309 -5.833 -10.767 544 H LYS 64 HN LYS 64 -3.690 -5.925 -6.903 545 HA LYS 64 HA LYS 64 -6.262 -5.448 -5.742 546 HB2 LYS 64 HB2 LYS 64 -3.802 -6.750 -4.590 547 HB3 LYS 64 HB1 LYS 64 -5.379 -6.738 -3.816 548 HG2 LYS 64 HG2 LYS 64 -5.437 -8.798 -4.802 549 HG3 LYS 64 HG1 LYS 64 -6.137 -7.820 -6.091 550 HD2 LYS 64 HD2 LYS 64 -3.883 -7.625 -7.095 551 HD3 LYS 64 HD1 LYS 64 -3.279 -8.741 -5.871 552 HE2 LYS 64 HE2 LYS 64 -3.682 -10.051 -7.791 553 HE3 LYS 64 HE1 LYS 64 -5.031 -10.376 -6.704 554 HZ1 LYS 64 HZ1 LYS 64 -5.081 -8.506 -9.011 555 HZ2 LYS 64 HZ2 LYS 64 -6.376 -8.814 -7.970 556 HZ3 LYS 64 HZ3 LYS 64 -5.787 -10.041 -8.970 557 H ALA 65 HN ALA 65 -2.962 -4.416 -5.125 558 HA ALA 65 HA ALA 65 -3.353 -2.962 -2.768 559 HB1 ALA 65 HB1 ALA 65 -1.237 -1.906 -3.284 560 HB2 ALA 65 HB2 ALA 65 -1.372 -2.413 -4.968 561 HB3 ALA 65 HB3 ALA 65 -1.164 -3.621 -3.702 562 H LEU 66 HN LEU 66 -4.217 -2.282 -5.992 563 HA LEU 66 HA LEU 66 -4.384 0.607 -5.623 564 HB2 LEU 66 HB2 LEU 66 -4.470 -1.273 -7.873 565 HB3 LEU 66 HB1 LEU 66 -5.507 0.130 -8.035 566 HG LEU 66 HG LEU 66 -3.575 1.592 -7.706 567 HD11 LEU 66 HD11 LEU 66 -1.351 0.743 -7.565 568 HD12 LEU 66 HD12 LEU 66 -1.917 -0.913 -7.817 569 HD13 LEU 66 HD13 LEU 66 -2.319 -0.063 -6.323 570 HD21 LEU 66 HD21 LEU 66 -2.472 1.143 -9.848 571 HD22 LEU 66 HD22 LEU 66 -4.224 0.975 -9.969 572 HD23 LEU 66 HD23 LEU 66 -3.205 -0.461 -9.882 573 H ASN 67 HN ASN 67 -6.253 -1.980 -5.021 574 HA ASN 67 HA ASN 67 -8.777 -1.643 -5.918 575 HB2 ASN 67 HB2 ASN 67 -9.546 -2.957 -4.157 576 HB3 ASN 67 HB1 ASN 67 -7.872 -3.410 -4.299 577 HD21 ASN 67 HD21 ASN 67 -6.421 -2.786 -2.692 578 HD22 ASN 67 HD22 ASN 67 -6.964 -2.243 -1.139 579 H LYS 68 HN LYS 68 -7.311 0.326 -3.461 580 HA LYS 68 HA LYS 68 -9.613 1.456 -2.330 581 HB2 LYS 68 HB2 LYS 68 -6.925 2.786 -2.688 582 HB3 LYS 68 HB1 LYS 68 -8.189 3.301 -1.585 583 HG2 LYS 68 HG2 LYS 68 -6.963 2.154 -0.092 584 HG3 LYS 68 HG1 LYS 68 -7.869 0.783 -0.730 585 HD2 LYS 68 HD2 LYS 68 -5.523 0.218 -0.622 586 HD3 LYS 68 HD1 LYS 68 -6.017 0.343 -2.309 587 HE2 LYS 68 HE2 LYS 68 -3.821 1.393 -1.831 588 HE3 LYS 68 HE1 LYS 68 -5.005 2.501 -2.517 589 HZ1 LYS 68 HZ1 LYS 68 -4.397 2.283 0.383 590 HZ2 LYS 68 HZ2 LYS 68 -5.395 3.433 -0.355 591 HZ3 LYS 68 HZ3 LYS 68 -3.731 3.448 -0.648 592 H GLY 69 HN GLY 69 -7.894 2.178 -5.272 593 HA2 GLY 69 HA2 GLY 69 -10.031 3.874 -6.193 594 HA3 GLY 69 HA1 GLY 69 -8.536 4.741 -5.860 595 H ARG 70 HN ARG 70 -9.506 1.703 -7.433 596 HA ARG 70 HA ARG 70 -7.287 1.891 -9.260 597 HB2 ARG 70 HB2 ARG 70 -8.014 -0.284 -8.362 598 HB3 ARG 70 HB1 ARG 70 -9.572 -0.091 -9.154 599 HG2 ARG 70 HG2 ARG 70 -8.587 -0.262 -11.312 600 HG3 ARG 70 HG1 ARG 70 -6.959 -0.162 -10.640 601 HD2 ARG 70 HD2 ARG 70 -7.599 -2.459 -11.276 602 HD3 ARG 70 HD1 ARG 70 -7.220 -2.299 -9.563 603 HE ARG 70 HE ARG 70 -9.911 -1.979 -9.643 604 HH11 ARG 70 HH11 ARG 70 -7.761 -4.425 -10.924 605 HH12 ARG 70 HH12 ARG 70 -8.904 -5.715 -10.730 606 HH21 ARG 70 HH21 ARG 70 -11.426 -3.664 -9.396 607 HH22 ARG 70 HH22 ARG 70 -10.990 -5.283 -9.846 608 H ARG 71 HN ARG 71 -7.409 3.349 -10.796 609 HA ARG 71 HA ARG 71 -9.861 3.510 -12.404 610 HB2 ARG 71 HB2 ARG 71 -8.895 6.001 -12.727 611 HB3 ARG 71 HB1 ARG 71 -10.069 5.576 -11.492 612 HG2 ARG 71 HG2 ARG 71 -8.403 6.923 -10.469 613 HG3 ARG 71 HG1 ARG 71 -8.172 5.272 -9.897 614 HD2 ARG 71 HD2 ARG 71 -6.403 5.014 -11.658 615 HD3 ARG 71 HD1 ARG 71 -6.556 6.743 -11.970 616 HE ARG 71 HE ARG 71 -6.053 6.054 -9.211 617 HH11 ARG 71 HH11 ARG 71 -4.625 6.884 -12.303 618 HH12 ARG 71 HH12 ARG 71 -3.117 7.394 -11.599 619 HH21 ARG 71 HH21 ARG 71 -4.062 6.709 -8.299 620 HH22 ARG 71 HH22 ARG 71 -2.796 7.291 -9.334 621 H GLU 72 HN GLU 72 -9.607 3.701 -14.601 622 HA GLU 72 HA GLU 72 -7.010 2.871 -15.593 623 HB2 GLU 72 HB2 GLU 72 -9.592 3.277 -17.112 624 HB3 GLU 72 HB1 GLU 72 -8.165 2.417 -17.677 625 HG2 GLU 72 HG2 GLU 72 -8.487 0.761 -15.883 626 HG3 GLU 72 HG1 GLU 72 -9.955 1.605 -15.397 627 H GLU 73 HN GLU 73 -5.635 4.111 -16.724 628 HA GLU 73 HA GLU 73 -6.206 6.961 -16.782 629 HB2 GLU 73 HB2 GLU 73 -3.658 5.418 -17.281 630 HB3 GLU 73 HB1 GLU 73 -3.780 7.170 -17.291 631 HG2 GLU 73 HG2 GLU 73 -4.368 5.402 -14.928 632 HG3 GLU 73 HG1 GLU 73 -2.873 6.297 -15.190 633 H LYS 74 HN LYS 74 -5.202 4.401 -19.043 634 HA LYS 74 HA LYS 74 -5.376 6.319 -21.236 635 HB2 LYS 74 HB2 LYS 74 -4.399 4.495 -22.622 636 HB3 LYS 74 HB1 LYS 74 -3.391 4.981 -21.270 637 HG2 LYS 74 HG2 LYS 74 -4.129 3.008 -20.018 638 HG3 LYS 74 HG1 LYS 74 -5.127 2.520 -21.390 639 HD2 LYS 74 HD2 LYS 74 -3.069 2.454 -22.786 640 HD3 LYS 74 HD1 LYS 74 -2.123 2.795 -21.338 641 HE2 LYS 74 HE2 LYS 74 -3.900 0.395 -21.761 642 HE3 LYS 74 HE1 LYS 74 -2.141 0.405 -21.873 643 HZ1 LYS 74 HZ1 LYS 74 -3.741 0.971 -19.438 644 HZ2 LYS 74 HZ2 LYS 74 -2.055 1.049 -19.529 645 HZ3 LYS 74 HZ3 LYS 74 -2.846 -0.430 -19.742 646 H VAL 75 HN VAL 75 -7.777 6.287 -20.589 647 HA VAL 75 HA VAL 75 -9.299 4.054 -21.587 648 HB VAL 75 HB VAL 75 -11.285 5.388 -21.062 649 HG11 VAL 75 HG11 VAL 75 -10.944 5.568 -18.642 650 HG12 VAL 75 HG12 VAL 75 -9.203 5.439 -18.882 651 HG13 VAL 75 HG13 VAL 75 -10.252 4.084 -19.290 652 HG21 VAL 75 HG21 VAL 75 -9.342 7.563 -20.293 653 HG22 VAL 75 HG22 VAL 75 -11.087 7.597 -20.040 654 HG23 VAL 75 HG23 VAL 75 -10.434 7.594 -21.678 655 H GLY 76 HN GLY 76 -8.083 7.033 -22.851 656 HA2 GLY 76 HA2 GLY 76 -8.010 6.790 -25.396 657 HA3 GLY 76 HA1 GLY 76 -9.759 6.709 -25.254 658 H LYS 77 HN LYS 77 -6.948 8.770 -25.011 659 HA LYS 77 HA LYS 77 -8.707 11.059 -25.455 660 HB2 LYS 77 HB2 LYS 77 -8.091 10.842 -22.982 661 HB3 LYS 77 HB1 LYS 77 -6.446 11.224 -23.467 662 HG2 LYS 77 HG2 LYS 77 -7.199 13.360 -24.372 663 HG3 LYS 77 HG1 LYS 77 -8.854 12.978 -23.901 664 HD2 LYS 77 HD2 LYS 77 -7.855 14.459 -22.272 665 HD3 LYS 77 HD1 LYS 77 -8.132 12.875 -21.547 666 HE2 LYS 77 HE2 LYS 77 -5.805 12.303 -21.795 667 HE3 LYS 77 HE1 LYS 77 -5.497 13.793 -22.684 668 HZ1 LYS 77 HZ1 LYS 77 -4.798 13.944 -20.368 669 HZ2 LYS 77 HZ2 LYS 77 -6.379 13.642 -19.853 670 HZ3 LYS 77 HZ3 LYS 77 -6.024 15.054 -20.709 671 H LYS 78 HN LYS 78 -6.735 9.373 -26.980 672 HA LYS 78 HA LYS 78 -5.001 11.576 -27.876 673 HB2 LYS 78 HB2 LYS 78 -4.526 8.595 -27.993 674 HB3 LYS 78 HB1 LYS 78 -3.542 9.768 -28.856 675 HG2 LYS 78 HG2 LYS 78 -3.900 9.677 -25.869 676 HG3 LYS 78 HG1 LYS 78 -2.519 9.024 -26.750 677 HD2 LYS 78 HD2 LYS 78 -2.020 11.273 -27.608 678 HD3 LYS 78 HD1 LYS 78 -3.389 11.915 -26.696 679 HE2 LYS 78 HE2 LYS 78 -0.972 10.548 -25.520 680 HE3 LYS 78 HE1 LYS 78 -1.263 12.285 -25.533 681 HZ1 LYS 78 HZ1 LYS 78 -3.011 10.289 -24.203 682 HZ2 LYS 78 HZ2 LYS 78 -3.190 11.968 -24.151 683 HZ3 LYS 78 HZ3 LYS 78 -1.858 11.237 -23.412 684 H GLU 79 HN GLU 79 -5.990 12.488 -29.548 685 HA GLU 79 HA GLU 79 -7.635 11.065 -31.390 686 HB2 GLU 79 HB2 GLU 79 -6.415 13.826 -31.493 687 HB3 GLU 79 HB1 GLU 79 -7.533 13.207 -32.699 688 HG2 GLU 79 HG2 GLU 79 -8.170 13.451 -29.770 689 HG3 GLU 79 HG1 GLU 79 -8.576 14.663 -30.984 690 H LYS 80 HN LYS 80 -4.275 11.740 -31.134 691 HA LYS 80 HA LYS 80 -3.673 11.140 -33.891 692 HB2 LYS 80 HB2 LYS 80 -1.824 11.376 -31.508 693 HB3 LYS 80 HB1 LYS 80 -1.332 11.315 -33.194 694 HG2 LYS 80 HG2 LYS 80 -2.514 13.422 -33.605 695 HG3 LYS 80 HG1 LYS 80 -2.966 13.487 -31.902 696 HD2 LYS 80 HD2 LYS 80 -1.056 14.901 -32.236 697 HD3 LYS 80 HD1 LYS 80 -0.548 13.482 -31.320 698 HE2 LYS 80 HE2 LYS 80 1.079 14.029 -33.040 699 HE3 LYS 80 HE1 LYS 80 0.326 12.471 -33.370 700 HZ1 LYS 80 HZ1 LYS 80 -1.127 13.574 -34.972 701 HZ2 LYS 80 HZ2 LYS 80 0.501 13.788 -35.371 702 HZ3 LYS 80 HZ3 LYS 80 -0.366 15.052 -34.663 703 H ILE 81 HN ILE 81 -3.630 9.153 -34.670 704 HA ILE 81 HA ILE 81 -3.783 6.886 -32.935 705 HB ILE 81 HB ILE 81 -3.938 5.510 -34.931 706 HG12 ILE 81 HG12 ILE 81 -2.318 6.887 -36.319 707 HG13 ILE 81 HG11 ILE 81 -3.746 6.309 -37.158 708 HG21 ILE 81 HG21 ILE 81 -5.943 6.561 -34.113 709 HG22 ILE 81 HG22 ILE 81 -5.988 6.482 -35.875 710 HG23 ILE 81 HG23 ILE 81 -5.614 8.005 -35.068 711 HD11 ILE 81 HD11 ILE 81 -3.346 8.528 -37.866 712 HD12 ILE 81 HD12 ILE 81 -3.168 9.100 -36.211 713 HD13 ILE 81 HD13 ILE 81 -4.748 8.581 -36.799 714 H GLY 82 HN GLY 82 -1.214 8.529 -34.527 715 HA2 GLY 82 HA2 GLY 82 1.053 8.280 -34.186 716 HA3 GLY 82 HA1 GLY 82 0.699 6.940 -33.110 717 H LYS 83 HN LYS 83 -0.818 6.438 -36.005 718 HA LYS 83 HA LYS 83 -0.556 5.000 -37.723 719 HB2 LYS 83 HB2 LYS 83 1.175 6.763 -38.298 720 HB3 LYS 83 HB1 LYS 83 2.384 5.675 -37.632 721 HG2 LYS 83 HG2 LYS 83 1.727 3.972 -39.284 722 HG3 LYS 83 HG1 LYS 83 0.574 5.114 -39.974 723 HD2 LYS 83 HD2 LYS 83 2.425 6.650 -40.477 724 HD3 LYS 83 HD1 LYS 83 3.566 5.475 -39.819 725 HE2 LYS 83 HE2 LYS 83 1.725 5.001 -42.161 726 HE3 LYS 83 HE1 LYS 83 3.438 5.402 -42.278 727 HZ1 LYS 83 HZ1 LYS 83 3.007 3.014 -42.495 728 HZ2 LYS 83 HZ2 LYS 83 2.353 2.983 -40.937 729 HZ3 LYS 83 HZ3 LYS 83 3.985 3.358 -41.161 730 H LYS 84 HN LYS 84 -0.171 4.032 -34.931 731 HA LYS 84 HA LYS 84 1.609 1.766 -35.305 732 HB2 LYS 84 HB2 LYS 84 0.988 1.148 -33.009 733 HB3 LYS 84 HB1 LYS 84 1.542 2.812 -33.104 734 HG2 LYS 84 HG2 LYS 84 -0.806 3.562 -33.081 735 HG3 LYS 84 HG1 LYS 84 -1.312 1.882 -32.890 736 HD2 LYS 84 HD2 LYS 84 0.022 1.765 -30.804 737 HD3 LYS 84 HD1 LYS 84 0.399 3.479 -30.984 738 HE2 LYS 84 HE2 LYS 84 -2.345 2.275 -30.647 739 HE3 LYS 84 HE1 LYS 84 -1.440 3.163 -29.424 740 HZ1 LYS 84 HZ1 LYS 84 -1.570 5.135 -30.765 741 HZ2 LYS 84 HZ2 LYS 84 -3.129 4.521 -30.543 742 HZ3 LYS 84 HZ3 LYS 84 -2.333 4.294 -32.017 743 H LYS 85 HN LYS 85 -0.600 2.115 -37.053 744 HA LYS 85 HA LYS 85 -2.488 0.002 -36.349 745 HB2 LYS 85 HB2 LYS 85 -2.491 1.903 -38.705 746 HB3 LYS 85 HB1 LYS 85 -3.794 0.818 -38.246 747 HG2 LYS 85 HG2 LYS 85 -4.153 2.061 -36.200 748 HG3 LYS 85 HG1 LYS 85 -2.785 3.110 -36.571 749 HD2 LYS 85 HD2 LYS 85 -4.837 4.243 -37.141 750 HD3 LYS 85 HD1 LYS 85 -3.961 3.849 -38.620 751 HE2 LYS 85 HE2 LYS 85 -6.308 3.378 -38.923 752 HE3 LYS 85 HE1 LYS 85 -5.403 1.865 -38.907 753 HZ1 LYS 85 HZ1 LYS 85 -6.971 3.000 -36.656 754 HZ2 LYS 85 HZ2 LYS 85 -6.041 1.594 -36.569 755 HZ3 LYS 85 HZ3 LYS 85 -7.384 1.653 -37.589 756 H ARG 86 HN ARG 86 -3.189 -1.086 -38.676 757 HA ARG 86 HA ARG 86 -0.878 -2.662 -39.380 758 HB2 ARG 86 HB2 ARG 86 -2.438 -4.003 -40.691 759 HB3 ARG 86 HB1 ARG 86 -3.087 -3.712 -39.084 760 HG2 ARG 86 HG2 ARG 86 -4.559 -1.998 -39.955 761 HG3 ARG 86 HG1 ARG 86 -3.864 -2.189 -41.564 762 HD2 ARG 86 HD2 ARG 86 -4.658 -4.495 -41.639 763 HD3 ARG 86 HD1 ARG 86 -5.336 -4.319 -40.021 764 HE ARG 86 HE ARG 86 -6.528 -2.326 -41.406 765 HH11 ARG 86 HH11 ARG 86 -6.185 -5.761 -41.978 766 HH12 ARG 86 HH12 ARG 86 -7.694 -5.898 -42.824 767 HH21 ARG 86 HH21 ARG 86 -8.512 -2.505 -42.521 768 HH22 ARG 86 HH22 ARG 86 -9.018 -4.048 -43.139 769 H GLN 87 HN GLN 87 0.041 -2.868 -41.433 770 HA GLN 87 HA GLN 87 -0.450 -0.645 -43.279 771 HB2 GLN 87 HB2 GLN 87 1.747 -2.729 -43.319 772 HB3 GLN 87 HB1 GLN 87 1.606 -1.373 -44.424 773 HG2 GLN 87 HG2 GLN 87 3.175 -0.599 -42.953 774 HG3 GLN 87 HG1 GLN 87 1.697 0.054 -42.247 775 HE21 GLN 87 HE21 GLN 87 4.175 -2.369 -41.977 776 HE22 GLN 87 HE22 GLN 87 3.872 -2.789 -40.328 777 H LYS 88 HN LYS 88 -1.123 -3.924 -42.782 778 HA LYS 88 HA LYS 88 -1.567 -4.619 -45.546 779 HB2 LYS 88 HB2 LYS 88 -2.356 -6.020 -42.982 780 HB3 LYS 88 HB1 LYS 88 -2.563 -6.692 -44.592 781 HG2 LYS 88 HG2 LYS 88 0.080 -5.950 -43.353 782 HG3 LYS 88 HG1 LYS 88 -0.588 -7.580 -43.432 783 HD2 LYS 88 HD2 LYS 88 0.031 -5.850 -45.826 784 HD3 LYS 88 HD1 LYS 88 1.080 -7.121 -45.202 785 HE2 LYS 88 HE2 LYS 88 -1.719 -7.481 -46.273 786 HE3 LYS 88 HE1 LYS 88 -0.226 -7.923 -47.097 787 HZ1 LYS 88 HZ1 LYS 88 -1.273 -9.108 -44.586 788 HZ2 LYS 88 HZ2 LYS 88 0.233 -9.473 -45.259 789 HZ3 LYS 88 HZ3 LYS 88 -1.181 -9.858 -46.097 790 H LYS 89 HN LYS 89 -2.872 -2.483 -45.568 791 HA LYS 89 HA LYS 89 -5.598 -2.778 -44.591 792 HB2 LYS 89 HB2 LYS 89 -4.197 -0.506 -46.011 793 HB3 LYS 89 HB1 LYS 89 -5.863 -0.455 -45.456 794 HG2 LYS 89 HG2 LYS 89 -5.228 -0.498 -43.196 795 HG3 LYS 89 HG1 LYS 89 -3.583 -1.003 -43.583 796 HD2 LYS 89 HD2 LYS 89 -3.744 1.382 -42.936 797 HD3 LYS 89 HD1 LYS 89 -3.101 1.146 -44.561 798 HE2 LYS 89 HE2 LYS 89 -5.321 1.634 -45.493 799 HE3 LYS 89 HE1 LYS 89 -5.939 1.896 -43.864 800 HZ1 LYS 89 HZ1 LYS 89 -3.788 3.474 -45.168 801 HZ2 LYS 89 HZ2 LYS 89 -4.392 3.732 -43.611 802 HZ3 LYS 89 HZ3 LYS 89 -5.388 3.981 -44.952 803 H ARG 90 HN ARG 90 -4.241 -1.669 -47.694 804 HA ARG 90 HA ARG 90 -4.951 -1.842 -49.842 805 HB2 ARG 90 HB2 ARG 90 -6.245 -4.414 -48.911 806 HB3 ARG 90 HB1 ARG 90 -6.005 -3.937 -50.585 807 HG2 ARG 90 HG2 ARG 90 -3.591 -4.021 -50.276 808 HG3 ARG 90 HG1 ARG 90 -3.819 -4.472 -48.583 809 HD2 ARG 90 HD2 ARG 90 -5.049 -6.484 -49.324 810 HD3 ARG 90 HD1 ARG 90 -4.714 -6.044 -50.997 811 HE ARG 90 HE ARG 90 -2.260 -6.142 -49.772 812 HH11 ARG 90 HH11 ARG 90 -4.915 -8.361 -50.272 813 HH12 ARG 90 HH12 ARG 90 -3.903 -9.771 -50.279 814 HH21 ARG 90 HH21 ARG 90 -0.919 -7.996 -49.785 815 HH22 ARG 90 HH22 ARG 90 -1.632 -9.563 -50.004 816 H LYS 91 HN LYS 91 -7.706 -3.449 -48.370 817 HA LYS 91 HA LYS 91 -9.371 -1.089 -48.543 818 HB2 LYS 91 HB2 LYS 91 -9.639 -2.059 -50.783 819 HB3 LYS 91 HB1 LYS 91 -9.994 -3.629 -50.079 820 HG2 LYS 91 HG2 LYS 91 -12.037 -2.615 -50.816 821 HG3 LYS 91 HG1 LYS 91 -12.028 -2.671 -49.054 822 HD2 LYS 91 HD2 LYS 91 -11.312 -0.309 -49.012 823 HD3 LYS 91 HD1 LYS 91 -11.404 -0.268 -50.773 824 HE2 LYS 91 HE2 LYS 91 -13.700 -0.842 -48.901 825 HE3 LYS 91 HE1 LYS 91 -13.404 0.691 -49.717 826 HZ1 LYS 91 HZ1 LYS 91 -15.055 -0.596 -50.890 827 HZ2 LYS 91 HZ2 LYS 91 -13.994 -1.904 -51.041 828 HZ3 LYS 91 HZ3 LYS 91 -13.665 -0.449 -51.842 829 H ALA 92 HN ALA 92 -10.768 -1.095 -46.852 830 HA ALA 92 HA ALA 92 -10.590 -3.158 -44.897 831 HB1 ALA 92 HB1 ALA 92 -12.182 -1.820 -43.626 832 HB2 ALA 92 HB2 ALA 92 -12.500 -0.827 -45.048 833 HB3 ALA 92 HB3 ALA 92 -10.905 -0.805 -44.296 834 H ALA 93 HN ALA 93 -11.252 -4.851 -46.476 835 HA ALA 93 HA ALA 93 -12.677 -6.482 -47.127 836 HB1 ALA 93 HB1 ALA 93 -14.855 -6.718 -46.066 837 HB2 ALA 93 HB2 ALA 93 -14.718 -5.091 -45.397 838 HB3 ALA 93 HB3 ALA 93 -13.609 -6.358 -44.871 839 H GLN 94 HN GLN 94 -14.540 -6.890 -48.531 840 HA GLN 94 HA GLN 94 -15.605 -6.520 -50.491 841 HB2 GLN 94 HB2 GLN 94 -16.262 -3.971 -49.036 842 HB3 GLN 94 HB1 GLN 94 -16.826 -4.254 -50.675 843 HG2 GLN 94 HG2 GLN 94 -18.600 -4.920 -49.337 844 HG3 GLN 94 HG1 GLN 94 -17.807 -6.427 -49.784 845 HE21 GLN 94 HE21 GLN 94 -16.706 -4.131 -47.358 846 HE22 GLN 94 HE22 GLN 94 -16.911 -5.190 -46.008 847 H LYS 95 HN LYS 95 -13.588 -6.613 -51.619 848 HA LYS 95 HA LYS 95 -12.473 -4.091 -52.520 849 HB2 LYS 95 HB2 LYS 95 -11.819 -6.952 -53.245 850 HB3 LYS 95 HB1 LYS 95 -11.010 -5.558 -53.945 851 HG2 LYS 95 HG2 LYS 95 -10.318 -4.892 -51.648 852 HG3 LYS 95 HG1 LYS 95 -10.992 -6.412 -51.062 853 HD2 LYS 95 HD2 LYS 95 -8.805 -6.155 -53.127 854 HD3 LYS 95 HD1 LYS 95 -8.554 -6.530 -51.423 855 HE2 LYS 95 HE2 LYS 95 -9.852 -8.575 -51.666 856 HE3 LYS 95 HE1 LYS 95 -10.163 -8.195 -53.358 857 HZ1 LYS 95 HZ1 LYS 95 -7.799 -8.359 -53.799 858 HZ2 LYS 95 HZ2 LYS 95 -8.366 -9.793 -53.110 859 HZ3 LYS 95 HZ3 LYS 95 -7.486 -8.697 -52.171 860 H ARG 96 HN ARG 96 -14.084 -3.100 -53.625 861 HA ARG 96 HA ARG 96 -15.435 -2.538 -55.348 862 HB2 ARG 96 HB2 ARG 96 -13.913 -4.700 -56.809 863 HB3 ARG 96 HB1 ARG 96 -14.989 -3.539 -57.569 864 HG2 ARG 96 HG2 ARG 96 -13.544 -1.712 -56.823 865 HG3 ARG 96 HG1 ARG 96 -12.457 -2.887 -56.077 866 HD2 ARG 96 HD2 ARG 96 -12.041 -3.895 -58.257 867 HD3 ARG 96 HD1 ARG 96 -13.150 -2.749 -59.008 868 HE ARG 96 HE ARG 96 -11.034 -1.472 -57.559 869 HH11 ARG 96 HH11 ARG 96 -11.876 -2.975 -60.604 870 HH12 ARG 96 HH12 ARG 96 -10.692 -2.092 -61.513 871 HH21 ARG 96 HH21 ARG 96 -9.474 -0.310 -58.744 872 HH22 ARG 96 HH22 ARG 96 -9.332 -0.564 -60.456 873 H LYS 97 HN LYS 97 -16.640 -4.013 -53.511 874 HA LYS 97 HA LYS 97 -18.276 -5.943 -55.021 875 HB2 LYS 97 HB2 LYS 97 -17.019 -6.814 -53.004 876 HB3 LYS 97 HB1 LYS 97 -18.001 -5.750 -52.012 877 HG2 LYS 97 HG2 LYS 97 -19.224 -7.825 -53.803 878 HG3 LYS 97 HG1 LYS 97 -18.691 -8.196 -52.164 879 HD2 LYS 97 HD2 LYS 97 -20.215 -6.539 -51.262 880 HD3 LYS 97 HD1 LYS 97 -20.690 -6.055 -52.890 881 HE2 LYS 97 HE2 LYS 97 -22.386 -7.491 -51.966 882 HE3 LYS 97 HE1 LYS 97 -21.562 -8.335 -53.275 883 HZ1 LYS 97 HZ1 LYS 97 -21.872 -9.810 -51.430 884 HZ2 LYS 97 HZ2 LYS 97 -21.121 -8.731 -50.368 885 HZ3 LYS 97 HZ3 LYS 97 -20.222 -9.481 -51.586 886 H ASN 98 HN ASN 98 -18.454 -3.579 -52.384 887 HA ASN 98 HA ASN 98 -20.071 -2.179 -51.651 888 HB2 ASN 98 HB2 ASN 98 -19.486 -1.083 -53.782 889 HB3 ASN 98 HB1 ASN 98 -20.738 -2.015 -54.597 890 HD21 ASN 98 HD21 ASN 98 -21.789 -0.132 -55.234 891 HD22 ASN 98 HD22 ASN 98 -22.713 0.819 -54.127 Start of MODEL 8 1 H1 LYS 1 HT1 LYS 1 19.173 3.177 -11.106 2 H2 LYS 1 HT2 LYS 1 17.890 3.648 -12.093 3 H3 LYS 1 HT3 LYS 1 17.667 3.530 -10.425 4 HA LYS 1 HA LYS 1 19.280 5.286 -10.077 5 HB2 LYS 1 HB2 LYS 1 20.545 4.985 -12.150 6 HB3 LYS 1 HB1 LYS 1 19.168 5.546 -13.085 7 HG2 LYS 1 HG2 LYS 1 19.345 7.744 -12.119 8 HG3 LYS 1 HG1 LYS 1 20.632 7.201 -11.040 9 HD2 LYS 1 HD2 LYS 1 22.052 6.725 -12.978 10 HD3 LYS 1 HD1 LYS 1 20.764 7.272 -14.054 11 HE2 LYS 1 HE2 LYS 1 20.891 9.502 -13.128 12 HE3 LYS 1 HE1 LYS 1 22.088 8.974 -11.948 13 HZ1 LYS 1 HZ1 LYS 1 23.611 8.497 -13.747 14 HZ2 LYS 1 HZ2 LYS 1 23.111 10.109 -13.820 15 HZ3 LYS 1 HZ3 LYS 1 22.461 8.972 -14.891 16 HA PRO 2 HA PRO 2 15.679 8.063 -11.722 17 HB2 PRO 2 HB2 PRO 2 13.672 6.791 -13.085 18 HB3 PRO 2 HB1 PRO 2 14.996 7.656 -13.872 19 HG2 PRO 2 HG2 PRO 2 14.699 4.730 -13.340 20 HG3 PRO 2 HG1 PRO 2 15.257 5.542 -14.816 21 HD2 PRO 2 HD2 PRO 2 16.986 4.445 -13.104 22 HD3 PRO 2 HD1 PRO 2 17.359 5.973 -13.923 23 H VAL 3 HN VAL 3 14.671 8.356 -9.866 24 HA VAL 3 HA VAL 3 13.549 6.037 -8.478 25 HB VAL 3 HB VAL 3 15.291 7.299 -7.286 26 HG11 VAL 3 HG11 VAL 3 14.854 9.549 -6.441 27 HG12 VAL 3 HG12 VAL 3 13.351 9.599 -7.360 28 HG13 VAL 3 HG13 VAL 3 14.896 9.510 -8.203 29 HG21 VAL 3 HG21 VAL 3 12.563 7.522 -6.026 30 HG22 VAL 3 HG22 VAL 3 14.099 7.601 -5.164 31 HG23 VAL 3 HG23 VAL 3 13.626 6.114 -5.985 32 H SER 4 HN SER 4 11.460 5.887 -7.950 33 HA SER 4 HA SER 4 9.536 7.678 -9.073 34 HB2 SER 4 HB2 SER 4 9.106 5.492 -7.017 35 HB3 SER 4 HB1 SER 4 7.897 6.185 -8.100 36 HG SER 4 HG SER 4 8.626 5.004 -9.698 37 H LEU 5 HN LEU 5 7.668 8.424 -7.521 38 HA LEU 5 HA LEU 5 8.884 10.269 -5.692 39 HB2 LEU 5 HB2 LEU 5 6.045 9.792 -6.548 40 HB3 LEU 5 HB1 LEU 5 6.431 10.909 -5.259 41 HG LEU 5 HG LEU 5 6.104 12.136 -7.298 42 HD11 LEU 5 HD11 LEU 5 7.846 12.935 -5.772 43 HD12 LEU 5 HD12 LEU 5 8.199 13.340 -7.452 44 HD13 LEU 5 HD13 LEU 5 9.048 12.008 -6.670 45 HD21 LEU 5 HD21 LEU 5 7.526 11.793 -9.267 46 HD22 LEU 5 HD22 LEU 5 6.541 10.374 -8.905 47 HD23 LEU 5 HD23 LEU 5 8.254 10.390 -8.483 48 H SER 6 HN SER 6 9.636 8.099 -4.553 49 HA SER 6 HA SER 6 7.891 7.812 -2.215 50 HB2 SER 6 HB2 SER 6 9.441 5.624 -3.614 51 HB3 SER 6 HB1 SER 6 8.580 5.442 -2.093 52 HG SER 6 HG SER 6 7.437 4.803 -4.082 53 H TYR 7 HN TYR 7 10.363 9.402 -2.941 54 HA TYR 7 HA TYR 7 12.485 8.265 -1.363 55 HB2 TYR 7 HB2 TYR 7 12.762 9.780 -3.394 56 HB3 TYR 7 HB1 TYR 7 12.273 11.110 -2.352 57 HD1 TYR 7 HD1 TYR 7 13.819 12.107 -0.839 58 HD2 TYR 7 HD2 TYR 7 14.863 8.539 -2.908 59 HE1 TYR 7 HE1 TYR 7 16.157 12.384 -0.128 60 HE2 TYR 7 HE2 TYR 7 17.200 8.805 -2.200 61 HH TYR 7 HH TYR 7 18.151 11.017 0.200 62 H ARG 8 HN ARG 8 13.041 8.757 0.706 63 HA ARG 8 HA ARG 8 12.742 9.324 2.875 64 HB2 ARG 8 HB2 ARG 8 11.860 11.867 1.527 65 HB3 ARG 8 HB1 ARG 8 11.878 11.710 3.277 66 HG2 ARG 8 HG2 ARG 8 14.254 11.274 3.250 67 HG3 ARG 8 HG1 ARG 8 14.264 11.322 1.486 68 HD2 ARG 8 HD2 ARG 8 13.634 13.646 1.504 69 HD3 ARG 8 HD1 ARG 8 13.455 13.623 3.257 70 HE ARG 8 HE ARG 8 15.941 13.062 3.233 71 HH11 ARG 8 HH11 ARG 8 14.396 15.020 0.773 72 HH12 ARG 8 HH12 ARG 8 15.820 15.954 0.447 73 HH21 ARG 8 HH21 ARG 8 17.815 14.288 2.800 74 HH22 ARG 8 HH22 ARG 8 17.764 15.529 1.588 75 H CYS 9 HN CYS 9 10.986 7.611 2.256 76 HA CYS 9 HA CYS 9 8.472 8.534 3.464 77 HB2 CYS 9 HB2 CYS 9 8.826 7.620 0.781 78 HB3 CYS 9 HB1 CYS 9 7.882 6.419 1.660 79 HA PRO 10 HA PRO 10 8.139 5.419 6.471 80 HB2 PRO 10 HB2 PRO 10 6.408 3.888 4.585 81 HB3 PRO 10 HB1 PRO 10 6.179 4.202 6.307 82 HG2 PRO 10 HG2 PRO 10 4.930 5.629 4.382 83 HG3 PRO 10 HG1 PRO 10 5.373 6.289 5.957 84 HD2 PRO 10 HD2 PRO 10 6.461 6.946 3.334 85 HD3 PRO 10 HD1 PRO 10 6.707 7.769 4.888 86 H CYS 11 HN CYS 11 8.075 3.695 3.367 87 HA CYS 11 HA CYS 11 9.807 1.632 4.464 88 HB2 CYS 11 HB2 CYS 11 7.798 1.691 2.482 89 HB3 CYS 11 HB1 CYS 11 9.302 1.319 1.651 90 H ARG 12 HN ARG 12 11.882 1.296 3.921 91 HA ARG 12 HA ARG 12 13.416 3.315 2.632 92 HB2 ARG 12 HB2 ARG 12 14.209 0.459 3.245 93 HB3 ARG 12 HB1 ARG 12 15.305 1.778 2.861 94 HG2 ARG 12 HG2 ARG 12 13.606 1.476 5.323 95 HG3 ARG 12 HG1 ARG 12 15.361 1.401 5.216 96 HD2 ARG 12 HD2 ARG 12 13.640 3.820 4.682 97 HD3 ARG 12 HD1 ARG 12 14.620 3.539 6.118 98 HE ARG 12 HE ARG 12 16.254 3.405 3.826 99 HH11 ARG 12 HH11 ARG 12 14.494 5.714 5.780 100 HH12 ARG 12 HH12 ARG 12 15.529 7.044 5.371 101 HH21 ARG 12 HH21 ARG 12 17.611 5.154 3.274 102 HH22 ARG 12 HH22 ARG 12 17.305 6.726 3.943 103 H PHE 13 HN PHE 13 15.134 2.099 0.878 104 HA PHE 13 HA PHE 13 13.426 1.971 -1.402 105 HB2 PHE 13 HB2 PHE 13 15.437 1.850 -2.731 106 HB3 PHE 13 HB1 PHE 13 15.658 3.059 -1.473 107 HD1 PHE 13 HD1 PHE 13 16.894 0.038 -2.931 108 HD2 PHE 13 HD2 PHE 13 16.977 2.439 0.573 109 HE1 PHE 13 HE1 PHE 13 18.947 -1.072 -2.225 110 HE2 PHE 13 HE2 PHE 13 19.030 1.332 1.287 111 HZ PHE 13 HZ PHE 13 20.007 -0.483 -0.091 112 H PHE 14 HN PHE 14 13.034 0.245 -2.742 113 HA PHE 14 HA PHE 14 12.686 -2.104 -1.108 114 HB2 PHE 14 HB2 PHE 14 11.481 -2.331 -3.707 115 HB3 PHE 14 HB1 PHE 14 10.722 -2.261 -2.127 116 HD1 PHE 14 HD1 PHE 14 9.791 -0.226 -1.268 117 HD2 PHE 14 HD2 PHE 14 11.837 -0.276 -4.998 118 HE1 PHE 14 HE1 PHE 14 8.892 2.003 -1.788 119 HE2 PHE 14 HE2 PHE 14 10.941 1.949 -5.525 120 HZ PHE 14 HZ PHE 14 9.475 3.110 -3.868 121 H GLU 15 HN GLU 15 12.964 -4.220 -1.841 122 HA GLU 15 HA GLU 15 15.379 -4.549 -3.448 123 HB2 GLU 15 HB2 GLU 15 13.842 -6.485 -1.718 124 HB3 GLU 15 HB1 GLU 15 15.309 -6.886 -2.589 125 HG2 GLU 15 HG2 GLU 15 15.096 -4.796 -0.441 126 HG3 GLU 15 HG1 GLU 15 15.686 -6.440 -0.204 127 H SER 16 HN SER 16 15.144 -4.932 -5.531 128 HA SER 16 HA SER 16 12.630 -5.908 -6.595 129 HB2 SER 16 HB2 SER 16 15.184 -5.178 -8.053 130 HB3 SER 16 HB1 SER 16 13.595 -5.419 -8.778 131 HG SER 16 HG SER 16 13.468 -3.332 -8.487 132 H HIS 17 HN HIS 17 14.089 -7.733 -4.979 133 HA HIS 17 HA HIS 17 14.521 -9.879 -6.947 134 HB2 HIS 17 HB2 HIS 17 16.174 -9.201 -4.523 135 HB3 HIS 17 HB1 HIS 17 16.116 -10.846 -5.138 136 HD1 HIS 17 HD1 HIS 17 18.051 -11.346 -6.556 137 HD2 HIS 17 HD2 HIS 17 16.909 -7.366 -6.904 138 HE1 HIS 17 HE1 HIS 17 19.696 -10.309 -8.148 139 HE2 HIS 17 HE2 HIS 17 18.894 -7.942 -8.460 140 H ILE 18 HN ILE 18 12.811 -8.689 -4.367 141 HA ILE 18 HA ILE 18 12.398 -10.988 -2.785 142 HB ILE 18 HB ILE 18 10.751 -8.494 -3.109 143 HG12 ILE 18 HG12 ILE 18 12.660 -9.367 -0.949 144 HG13 ILE 18 HG11 ILE 18 13.015 -8.185 -2.199 145 HG21 ILE 18 HG21 ILE 18 9.384 -10.395 -2.306 146 HG22 ILE 18 HG22 ILE 18 9.538 -9.088 -1.129 147 HG23 ILE 18 HG23 ILE 18 10.493 -10.558 -0.942 148 HD11 ILE 18 HD11 ILE 18 10.901 -7.900 -0.075 149 HD12 ILE 18 HD12 ILE 18 11.318 -6.702 -1.300 150 HD13 ILE 18 HD13 ILE 18 12.491 -7.134 -0.050 151 H ALA 19 HN ALA 19 11.064 -12.612 -2.957 152 HA ALA 19 HA ALA 19 9.454 -12.861 -5.396 153 HB1 ALA 19 HB1 ALA 19 9.616 -15.287 -4.962 154 HB2 ALA 19 HB2 ALA 19 10.570 -14.945 -3.512 155 HB3 ALA 19 HB3 ALA 19 11.198 -14.523 -5.111 156 H ARG 20 HN ARG 20 7.459 -14.139 -5.225 157 HA ARG 20 HA ARG 20 5.796 -13.445 -3.012 158 HB2 ARG 20 HB2 ARG 20 5.266 -13.748 -5.521 159 HB3 ARG 20 HB1 ARG 20 5.217 -15.461 -5.148 160 HG2 ARG 20 HG2 ARG 20 3.416 -15.108 -3.584 161 HG3 ARG 20 HG1 ARG 20 3.499 -13.362 -3.867 162 HD2 ARG 20 HD2 ARG 20 1.739 -14.217 -5.240 163 HD3 ARG 20 HD1 ARG 20 3.120 -13.812 -6.272 164 HE ARG 20 HE ARG 20 3.063 -16.559 -5.425 165 HH11 ARG 20 HH11 ARG 20 1.973 -14.270 -7.834 166 HH12 ARG 20 HH12 ARG 20 1.781 -15.468 -9.073 167 HH21 ARG 20 HH21 ARG 20 2.822 -18.145 -7.053 168 HH22 ARG 20 HH22 ARG 20 2.259 -17.677 -8.624 169 H ALA 21 HN ALA 21 7.850 -16.057 -3.862 170 HA ALA 21 HA ALA 21 6.409 -18.012 -2.264 171 HB1 ALA 21 HB1 ALA 21 7.318 -18.704 -4.427 172 HB2 ALA 21 HB2 ALA 21 8.043 -19.617 -3.103 173 HB3 ALA 21 HB3 ALA 21 8.943 -18.306 -3.868 174 H ASN 22 HN ASN 22 8.860 -15.742 -1.862 175 HA ASN 22 HA ASN 22 10.003 -17.224 0.346 176 HB2 ASN 22 HB2 ASN 22 11.802 -15.628 0.256 177 HB3 ASN 22 HB1 ASN 22 11.547 -16.302 -1.310 178 HD21 ASN 22 HD21 ASN 22 9.590 -13.694 0.013 179 HD22 ASN 22 HD22 ASN 22 10.159 -12.504 -1.094 180 H VAL 23 HN VAL 23 7.675 -15.002 -0.250 181 HA VAL 23 HA VAL 23 8.232 -13.402 2.107 182 HB VAL 23 HB VAL 23 7.740 -12.190 0.064 183 HG11 VAL 23 HG11 VAL 23 5.414 -12.158 -0.811 184 HG12 VAL 23 HG12 VAL 23 5.052 -13.540 0.230 185 HG13 VAL 23 HG13 VAL 23 6.245 -13.697 -1.068 186 HG21 VAL 23 HG21 VAL 23 6.149 -10.646 0.980 187 HG22 VAL 23 HG22 VAL 23 7.213 -11.258 2.255 188 HG23 VAL 23 HG23 VAL 23 5.569 -11.877 2.103 189 H LYS 24 HN LYS 24 6.993 -13.167 3.739 190 HA LYS 24 HA LYS 24 4.762 -14.988 4.195 191 HB2 LYS 24 HB2 LYS 24 6.237 -13.176 6.116 192 HB3 LYS 24 HB1 LYS 24 4.986 -14.326 6.547 193 HG2 LYS 24 HG2 LYS 24 6.490 -16.133 5.674 194 HG3 LYS 24 HG1 LYS 24 7.742 -14.897 5.540 195 HD2 LYS 24 HD2 LYS 24 7.891 -14.594 7.793 196 HD3 LYS 24 HD1 LYS 24 6.268 -15.191 8.115 197 HE2 LYS 24 HE2 LYS 24 8.749 -16.767 7.463 198 HE3 LYS 24 HE1 LYS 24 7.826 -16.774 8.961 199 HZ1 LYS 24 HZ1 LYS 24 5.958 -17.759 7.781 200 HZ2 LYS 24 HZ2 LYS 24 7.332 -18.733 7.649 201 HZ3 LYS 24 HZ3 LYS 24 6.846 -17.779 6.343 202 H HIS 25 HN HIS 25 3.637 -13.314 6.216 203 HA HIS 25 HA HIS 25 1.567 -12.006 5.188 204 HB2 HIS 25 HB2 HIS 25 2.891 -10.267 7.157 205 HB3 HIS 25 HB1 HIS 25 1.271 -10.942 7.187 206 HD1 HIS 25 HD1 HIS 25 2.932 -10.674 9.704 207 HD2 HIS 25 HD2 HIS 25 2.896 -14.135 7.406 208 HE1 HIS 25 HE1 HIS 25 3.638 -12.522 11.247 209 HE2 HIS 25 HE2 HIS 25 3.708 -14.584 9.810 210 H LEU 26 HN LEU 26 1.464 -10.660 3.489 211 HA LEU 26 HA LEU 26 3.554 -8.627 3.218 212 HB2 LEU 26 HB2 LEU 26 3.359 -10.103 1.314 213 HB3 LEU 26 HB1 LEU 26 1.650 -9.745 1.158 214 HG LEU 26 HG LEU 26 2.106 -7.514 0.424 215 HD11 LEU 26 HD11 LEU 26 3.955 -7.103 2.004 216 HD12 LEU 26 HD12 LEU 26 4.320 -6.577 0.371 217 HD13 LEU 26 HD13 LEU 26 5.007 -8.077 0.986 218 HD21 LEU 26 HD21 LEU 26 4.315 -8.809 -1.050 219 HD22 LEU 26 HD22 LEU 26 2.843 -8.030 -1.651 220 HD23 LEU 26 HD23 LEU 26 2.776 -9.685 -1.047 221 H LYS 27 HN LYS 27 3.103 -6.584 3.450 222 HA LYS 27 HA LYS 27 0.295 -5.750 3.779 223 HB2 LYS 27 HB2 LYS 27 1.135 -6.104 5.984 224 HB3 LYS 27 HB1 LYS 27 2.636 -5.281 5.607 225 HG2 LYS 27 HG2 LYS 27 1.282 -3.875 6.995 226 HG3 LYS 27 HG1 LYS 27 1.407 -3.178 5.375 227 HD2 LYS 27 HD2 LYS 27 -0.881 -3.022 6.278 228 HD3 LYS 27 HD1 LYS 27 -0.813 -4.016 4.823 229 HE2 LYS 27 HE2 LYS 27 -2.255 -5.012 6.528 230 HE3 LYS 27 HE1 LYS 27 -0.864 -6.036 6.182 231 HZ1 LYS 27 HZ1 LYS 27 -1.096 -4.196 8.502 232 HZ2 LYS 27 HZ2 LYS 27 0.196 -5.240 8.186 233 HZ3 LYS 27 HZ3 LYS 27 -1.327 -5.870 8.557 234 H ILE 28 HN ILE 28 -0.181 -3.688 3.110 235 HA ILE 28 HA ILE 28 1.991 -2.296 1.700 236 HB ILE 28 HB ILE 28 -0.964 -2.055 1.150 237 HG12 ILE 28 HG12 ILE 28 -0.354 -4.336 0.684 238 HG13 ILE 28 HG11 ILE 28 -0.462 -3.494 -0.847 239 HG21 ILE 28 HG21 ILE 28 0.322 -0.145 0.411 240 HG22 ILE 28 HG22 ILE 28 -0.217 -1.085 -0.981 241 HG23 ILE 28 HG23 ILE 28 1.456 -1.203 -0.431 242 HD11 ILE 28 HD11 ILE 28 1.431 -5.022 -0.742 243 HD12 ILE 28 HD12 ILE 28 2.089 -4.082 0.598 244 HD13 ILE 28 HD13 ILE 28 1.922 -3.346 -0.997 245 H LEU 29 HN LEU 29 2.516 -0.285 2.272 246 HA LEU 29 HA LEU 29 1.191 0.851 4.600 247 HB2 LEU 29 HB2 LEU 29 3.775 0.652 4.095 248 HB3 LEU 29 HB1 LEU 29 3.512 2.148 3.211 249 HG LEU 29 HG LEU 29 4.373 2.551 5.472 250 HD11 LEU 29 HD11 LEU 29 2.673 4.175 6.221 251 HD12 LEU 29 HD12 LEU 29 1.535 3.498 5.049 252 HD13 LEU 29 HD13 LEU 29 3.017 4.284 4.496 253 HD21 LEU 29 HD21 LEU 29 3.375 0.582 6.553 254 HD22 LEU 29 HD22 LEU 29 1.790 1.347 6.451 255 HD23 LEU 29 HD23 LEU 29 3.057 2.073 7.437 256 H ASN 30 HN ASN 30 -0.274 2.415 4.495 257 HA ASN 30 HA ASN 30 -0.793 3.852 2.061 258 HB2 ASN 30 HB2 ASN 30 -1.924 3.915 4.833 259 HB3 ASN 30 HB1 ASN 30 -2.284 5.211 3.707 260 HD21 ASN 30 HD21 ASN 30 -2.726 1.857 4.453 261 HD22 ASN 30 HD22 ASN 30 -3.984 1.558 3.306 262 H THR 31 HN THR 31 0.975 5.025 1.526 263 HA THR 31 HA THR 31 2.486 6.518 3.401 264 HB THR 31 HB THR 31 3.309 7.398 1.020 265 HG1 THR 31 HG1 THR 31 3.068 5.086 -0.115 266 HG21 THR 31 HG21 THR 31 3.919 4.794 2.381 267 HG22 THR 31 HG22 THR 31 4.780 6.329 2.532 268 HG23 THR 31 HG23 THR 31 4.854 5.417 1.025 269 HA PRO 32 HA PRO 32 1.428 10.910 3.135 270 HB2 PRO 32 HB2 PRO 32 3.992 10.900 1.586 271 HB3 PRO 32 HB1 PRO 32 3.427 12.046 2.810 272 HG2 PRO 32 HG2 PRO 32 5.134 10.165 3.495 273 HG3 PRO 32 HG1 PRO 32 3.768 10.542 4.558 274 HD2 PRO 32 HD2 PRO 32 4.192 8.208 2.776 275 HD3 PRO 32 HD1 PRO 32 3.336 8.306 4.321 276 H ASN 33 HN ASN 33 1.088 8.929 0.551 277 HA ASN 33 HA ASN 33 0.489 9.087 -1.612 278 HB2 ASN 33 HB2 ASN 33 -0.326 10.982 -2.505 279 HB3 ASN 33 HB1 ASN 33 -0.056 11.679 -0.921 280 HD21 ASN 33 HD21 ASN 33 1.768 13.036 -0.624 281 HD22 ASN 33 HD22 ASN 33 2.518 13.822 -1.974 282 H CYS 34 HN CYS 34 2.780 8.255 -0.571 283 HA CYS 34 HA CYS 34 4.683 8.577 -2.766 284 HB2 CYS 34 HB2 CYS 34 4.707 7.238 -0.088 285 HB3 CYS 34 HB1 CYS 34 5.757 6.600 -1.312 286 H ALA 35 HN ALA 35 5.377 6.242 -3.620 287 HA ALA 35 HA ALA 35 3.116 4.961 -4.695 288 HB1 ALA 35 HB1 ALA 35 5.895 3.827 -4.339 289 HB2 ALA 35 HB2 ALA 35 5.336 4.760 -5.728 290 HB3 ALA 35 HB3 ALA 35 4.634 3.176 -5.389 291 H LEU 36 HN LEU 36 2.276 2.870 -4.179 292 HA LEU 36 HA LEU 36 1.745 2.488 -1.481 293 HB2 LEU 36 HB2 LEU 36 1.304 0.995 -4.009 294 HB3 LEU 36 HB1 LEU 36 1.096 0.134 -2.507 295 HG LEU 36 HG LEU 36 -0.555 1.855 -1.788 296 HD11 LEU 36 HD11 LEU 36 -1.423 3.432 -3.408 297 HD12 LEU 36 HD12 LEU 36 -0.276 2.857 -4.616 298 HD13 LEU 36 HD13 LEU 36 0.309 3.692 -3.176 299 HD21 LEU 36 HD21 LEU 36 -2.348 1.130 -3.299 300 HD22 LEU 36 HD22 LEU 36 -1.328 -0.212 -2.779 301 HD23 LEU 36 HD23 LEU 36 -1.136 0.467 -4.395 302 H GLN 37 HN GLN 37 3.129 1.857 -0.008 303 HA GLN 37 HA GLN 37 5.617 0.621 -0.728 304 HB2 GLN 37 HB2 GLN 37 4.480 1.080 2.024 305 HB3 GLN 37 HB1 GLN 37 6.166 0.835 1.605 306 HG2 GLN 37 HG2 GLN 37 4.654 3.156 0.491 307 HG3 GLN 37 HG1 GLN 37 5.304 3.206 2.128 308 HE21 GLN 37 HE21 GLN 37 6.680 4.835 1.632 309 HE22 GLN 37 HE22 GLN 37 8.102 4.595 0.685 310 H ILE 38 HN ILE 38 5.763 -1.489 -1.072 311 HA ILE 38 HA ILE 38 3.823 -3.262 0.149 312 HB ILE 38 HB ILE 38 5.977 -3.980 -1.846 313 HG12 ILE 38 HG12 ILE 38 3.687 -3.875 -3.305 314 HG13 ILE 38 HG11 ILE 38 3.432 -2.528 -2.211 315 HG21 ILE 38 HG21 ILE 38 5.133 -5.963 -1.034 316 HG22 ILE 38 HG22 ILE 38 4.097 -5.667 -2.434 317 HG23 ILE 38 HG23 ILE 38 3.504 -5.295 -0.812 318 HD11 ILE 38 HD11 ILE 38 5.566 -1.566 -2.942 319 HD12 ILE 38 HD12 ILE 38 4.418 -1.767 -4.261 320 HD13 ILE 38 HD13 ILE 38 5.757 -2.901 -4.077 321 H VAL 39 HN VAL 39 4.393 -3.631 2.236 322 HA VAL 39 HA VAL 39 7.224 -4.055 2.859 323 HB VAL 39 HB VAL 39 5.593 -2.442 4.168 324 HG11 VAL 39 HG11 VAL 39 3.879 -4.010 4.740 325 HG12 VAL 39 HG12 VAL 39 4.677 -3.437 6.204 326 HG13 VAL 39 HG13 VAL 39 5.045 -5.040 5.568 327 HG21 VAL 39 HG21 VAL 39 7.925 -2.739 4.702 328 HG22 VAL 39 HG22 VAL 39 7.578 -4.259 5.527 329 HG23 VAL 39 HG23 VAL 39 6.973 -2.737 6.186 330 H ALA 40 HN ALA 40 8.006 -6.021 3.309 331 HA ALA 40 HA ALA 40 6.039 -8.197 3.569 332 HB1 ALA 40 HB1 ALA 40 7.183 -9.500 1.952 333 HB2 ALA 40 HB2 ALA 40 8.507 -8.338 1.861 334 HB3 ALA 40 HB3 ALA 40 6.914 -7.908 1.245 335 H ARG 41 HN ARG 41 6.573 -9.831 4.935 336 HA ARG 41 HA ARG 41 9.217 -9.655 6.205 337 HB2 ARG 41 HB2 ARG 41 6.594 -10.848 7.104 338 HB3 ARG 41 HB1 ARG 41 8.120 -11.222 7.910 339 HG2 ARG 41 HG2 ARG 41 7.932 -8.402 7.594 340 HG3 ARG 41 HG1 ARG 41 6.434 -8.993 8.309 341 HD2 ARG 41 HD2 ARG 41 9.098 -9.874 9.326 342 HD3 ARG 41 HD1 ARG 41 8.384 -8.354 9.857 343 HE ARG 41 HE ARG 41 6.379 -9.984 10.365 344 HH11 ARG 41 HH11 ARG 41 9.791 -10.571 10.917 345 HH12 ARG 41 HH12 ARG 41 9.523 -11.465 12.379 346 HH21 ARG 41 HH21 ARG 41 6.037 -11.150 12.299 347 HH22 ARG 41 HH22 ARG 41 7.395 -11.796 13.162 348 H LEU 42 HN LEU 42 10.698 -11.098 5.630 349 HA LEU 42 HA LEU 42 10.075 -13.013 3.639 350 HB2 LEU 42 HB2 LEU 42 12.534 -12.320 5.182 351 HB3 LEU 42 HB1 LEU 42 12.507 -13.807 4.255 352 HG LEU 42 HG LEU 42 11.877 -11.132 3.025 353 HD11 LEU 42 HD11 LEU 42 14.120 -11.027 3.971 354 HD12 LEU 42 HD12 LEU 42 14.184 -11.104 2.210 355 HD13 LEU 42 HD13 LEU 42 14.539 -12.540 3.168 356 HD21 LEU 42 HD21 LEU 42 12.748 -13.777 1.838 357 HD22 LEU 42 HD22 LEU 42 12.424 -12.296 0.940 358 HD23 LEU 42 HD23 LEU 42 11.116 -13.115 1.791 359 H LYS 43 HN LYS 43 10.568 -15.254 3.693 360 HA LYS 43 HA LYS 43 8.951 -16.474 5.683 361 HB2 LYS 43 HB2 LYS 43 9.144 -16.992 3.196 362 HB3 LYS 43 HB1 LYS 43 10.634 -17.816 3.592 363 HG2 LYS 43 HG2 LYS 43 9.424 -19.386 4.987 364 HG3 LYS 43 HG1 LYS 43 7.913 -18.538 4.633 365 HD2 LYS 43 HD2 LYS 43 8.411 -18.952 2.178 366 HD3 LYS 43 HD1 LYS 43 9.687 -20.046 2.723 367 HE2 LYS 43 HE2 LYS 43 8.057 -21.398 3.913 368 HE3 LYS 43 HE1 LYS 43 6.769 -20.291 3.439 369 HZ1 LYS 43 HZ1 LYS 43 7.198 -20.852 1.127 370 HZ2 LYS 43 HZ2 LYS 43 6.810 -22.232 2.018 371 HZ3 LYS 43 HZ3 LYS 43 8.417 -21.926 1.588 372 H ASN 44 HN ASN 44 12.268 -17.231 4.621 373 HA ASN 44 HA ASN 44 12.783 -18.658 7.077 374 HB2 ASN 44 HB2 ASN 44 14.460 -18.092 4.656 375 HB3 ASN 44 HB1 ASN 44 15.095 -18.918 6.068 376 HD21 ASN 44 HD21 ASN 44 14.767 -19.841 3.317 377 HD22 ASN 44 HD22 ASN 44 13.787 -21.263 3.406 378 H ASN 45 HN ASN 45 13.679 -15.637 5.573 379 HA ASN 45 HA ASN 45 15.713 -15.034 7.489 380 HB2 ASN 45 HB2 ASN 45 15.375 -14.193 5.013 381 HB3 ASN 45 HB1 ASN 45 14.457 -12.925 5.805 382 HD21 ASN 45 HD21 ASN 45 16.910 -12.733 4.302 383 HD22 ASN 45 HD22 ASN 45 18.087 -12.046 5.368 384 H ASN 46 HN ASN 46 12.327 -14.392 7.133 385 HA ASN 46 HA ASN 46 10.724 -13.594 8.512 386 HB2 ASN 46 HB2 ASN 46 12.922 -13.835 10.556 387 HB3 ASN 46 HB1 ASN 46 11.288 -13.333 10.964 388 HD21 ASN 46 HD21 ASN 46 9.631 -14.828 10.919 389 HD22 ASN 46 HD22 ASN 46 9.915 -16.528 10.811 390 H ARG 47 HN ARG 47 13.186 -11.796 7.467 391 HA ARG 47 HA ARG 47 12.892 -9.494 9.157 392 HB2 ARG 47 HB2 ARG 47 14.543 -10.110 6.733 393 HB3 ARG 47 HB1 ARG 47 14.404 -8.466 7.339 394 HG2 ARG 47 HG2 ARG 47 15.352 -9.097 9.443 395 HG3 ARG 47 HG1 ARG 47 15.344 -10.798 8.981 396 HD2 ARG 47 HD2 ARG 47 17.554 -9.947 8.728 397 HD3 ARG 47 HD1 ARG 47 16.875 -10.265 7.137 398 HE ARG 47 HE ARG 47 16.341 -7.659 7.452 399 HH11 ARG 47 HH11 ARG 47 19.267 -9.506 7.957 400 HH12 ARG 47 HH12 ARG 47 20.323 -8.212 7.498 401 HH21 ARG 47 HH21 ARG 47 17.725 -5.949 6.818 402 HH22 ARG 47 HH22 ARG 47 19.444 -6.184 6.841 403 H GLN 48 HN GLN 48 12.060 -7.594 8.650 404 HA GLN 48 HA GLN 48 9.944 -7.527 6.713 405 HB2 GLN 48 HB2 GLN 48 9.846 -6.524 9.023 406 HB3 GLN 48 HB1 GLN 48 10.938 -5.276 8.453 407 HG2 GLN 48 HG2 GLN 48 9.312 -4.622 6.775 408 HG3 GLN 48 HG1 GLN 48 8.212 -5.870 7.359 409 HE21 GLN 48 HE21 GLN 48 6.625 -4.522 7.980 410 HE22 GLN 48 HE22 GLN 48 6.751 -3.412 9.298 411 H VAL 49 HN VAL 49 10.063 -6.719 4.783 412 HA VAL 49 HA VAL 49 12.302 -4.961 4.007 413 HB VAL 49 HB VAL 49 11.308 -6.664 1.880 414 HG11 VAL 49 HG11 VAL 49 13.752 -6.954 1.451 415 HG12 VAL 49 HG12 VAL 49 14.048 -5.923 2.851 416 HG13 VAL 49 HG13 VAL 49 13.182 -5.287 1.453 417 HG21 VAL 49 HG21 VAL 49 12.826 -7.959 4.114 418 HG22 VAL 49 HG22 VAL 49 12.512 -8.677 2.535 419 HG23 VAL 49 HG23 VAL 49 11.170 -8.308 3.618 420 H CYS 50 HN CYS 50 11.788 -4.218 1.669 421 HA CYS 50 HA CYS 50 8.943 -3.632 1.351 422 HB2 CYS 50 HB2 CYS 50 11.209 -1.814 0.507 423 HB3 CYS 50 HB1 CYS 50 9.499 -1.456 0.537 424 H ILE 51 HN ILE 51 8.187 -4.432 -0.511 425 HA ILE 51 HA ILE 51 10.049 -5.548 -2.445 426 HB ILE 51 HB ILE 51 7.101 -5.532 -2.932 427 HG12 ILE 51 HG12 ILE 51 8.455 -7.268 -0.850 428 HG13 ILE 51 HG11 ILE 51 7.191 -6.077 -0.557 429 HG21 ILE 51 HG21 ILE 51 7.496 -7.517 -4.063 430 HG22 ILE 51 HG22 ILE 51 8.958 -7.865 -3.146 431 HG23 ILE 51 HG23 ILE 51 8.974 -6.601 -4.376 432 HD11 ILE 51 HD11 ILE 51 6.217 -8.256 -0.503 433 HD12 ILE 51 HD12 ILE 51 6.933 -8.673 -2.056 434 HD13 ILE 51 HD13 ILE 51 5.667 -7.451 -1.972 435 H ASP 52 HN ASP 52 10.293 -4.873 -4.539 436 HA ASP 52 HA ASP 52 9.801 -2.130 -5.087 437 HB2 ASP 52 HB2 ASP 52 11.733 -3.299 -6.034 438 HB3 ASP 52 HB1 ASP 52 10.664 -4.356 -6.944 439 HA PRO 53 HA PRO 53 5.598 -2.489 -6.319 440 HB2 PRO 53 HB2 PRO 53 5.369 -0.077 -7.553 441 HB3 PRO 53 HB1 PRO 53 5.400 -0.273 -5.799 442 HG2 PRO 53 HG2 PRO 53 7.632 0.467 -7.645 443 HG3 PRO 53 HG1 PRO 53 7.186 1.188 -6.096 444 HD2 PRO 53 HD2 PRO 53 9.197 -0.550 -6.302 445 HD3 PRO 53 HD1 PRO 53 8.131 -0.533 -4.891 446 H LYS 54 HN LYS 54 8.205 -2.165 -8.521 447 HA LYS 54 HA LYS 54 6.428 -2.345 -10.834 448 HB2 LYS 54 HB2 LYS 54 9.352 -1.665 -10.643 449 HB3 LYS 54 HB1 LYS 54 8.475 -1.821 -12.160 450 HG2 LYS 54 HG2 LYS 54 7.803 0.087 -9.968 451 HG3 LYS 54 HG1 LYS 54 8.684 0.520 -11.422 452 HD2 LYS 54 HD2 LYS 54 5.836 -0.437 -11.187 453 HD3 LYS 54 HD1 LYS 54 6.375 1.182 -11.642 454 HE2 LYS 54 HE2 LYS 54 7.378 0.299 -13.649 455 HE3 LYS 54 HE1 LYS 54 6.968 -1.328 -13.128 456 HZ1 LYS 54 HZ1 LYS 54 4.984 0.784 -13.740 457 HZ2 LYS 54 HZ2 LYS 54 4.644 -0.827 -13.353 458 HZ3 LYS 54 HZ3 LYS 54 5.428 -0.453 -14.805 459 H LEU 55 HN LEU 55 8.080 -4.369 -8.823 460 HA LEU 55 HA LEU 55 9.142 -6.352 -10.426 461 HB2 LEU 55 HB2 LEU 55 7.866 -6.176 -7.766 462 HB3 LEU 55 HB1 LEU 55 8.016 -7.786 -8.447 463 HG LEU 55 HG LEU 55 10.350 -5.899 -8.199 464 HD11 LEU 55 HD11 LEU 55 10.949 -7.282 -6.190 465 HD12 LEU 55 HD12 LEU 55 9.290 -7.890 -6.210 466 HD13 LEU 55 HD13 LEU 55 9.602 -6.166 -5.984 467 HD21 LEU 55 HD21 LEU 55 10.117 -8.876 -8.576 468 HD22 LEU 55 HD22 LEU 55 11.630 -7.994 -8.348 469 HD23 LEU 55 HD23 LEU 55 10.638 -7.693 -9.776 470 H LYS 56 HN LYS 56 8.302 -8.103 -11.493 471 HA LYS 56 HA LYS 56 5.979 -7.466 -12.955 472 HB2 LYS 56 HB2 LYS 56 7.443 -10.107 -12.880 473 HB3 LYS 56 HB1 LYS 56 6.360 -9.548 -14.145 474 HG2 LYS 56 HG2 LYS 56 9.011 -8.323 -13.417 475 HG3 LYS 56 HG1 LYS 56 8.683 -9.344 -14.818 476 HD2 LYS 56 HD2 LYS 56 7.061 -7.664 -15.619 477 HD3 LYS 56 HD1 LYS 56 7.489 -6.631 -14.252 478 HE2 LYS 56 HE2 LYS 56 9.803 -6.561 -15.040 479 HE3 LYS 56 HE1 LYS 56 9.368 -7.582 -16.407 480 HZ1 LYS 56 HZ1 LYS 56 8.348 -4.854 -15.860 481 HZ2 LYS 56 HZ2 LYS 56 7.829 -5.840 -17.131 482 HZ3 LYS 56 HZ3 LYS 56 9.430 -5.297 -17.081 483 H TRP 57 HN TRP 57 6.537 -9.608 -10.238 484 HA TRP 57 HA TRP 57 3.845 -10.680 -10.446 485 HB2 TRP 57 HB2 TRP 57 4.410 -12.100 -8.623 486 HB3 TRP 57 HB1 TRP 57 5.814 -12.056 -9.664 487 HD1 TRP 57 HD1 TRP 57 8.006 -10.964 -8.691 488 HE1 TRP 57 HE1 TRP 57 8.752 -10.389 -6.285 489 HE3 TRP 57 HE3 TRP 57 3.469 -11.213 -6.392 490 HZ2 TRP 57 HZ2 TRP 57 7.540 -10.089 -3.749 491 HZ3 TRP 57 HZ3 TRP 57 3.333 -10.759 -3.985 492 HH2 TRP 57 HH2 TRP 57 5.328 -10.215 -2.685 493 H ILE 58 HN ILE 58 5.527 -8.123 -8.921 494 HA ILE 58 HA ILE 58 3.665 -7.655 -6.804 495 HB ILE 58 HB ILE 58 5.956 -6.127 -7.979 496 HG12 ILE 58 HG12 ILE 58 6.372 -7.959 -6.381 497 HG13 ILE 58 HG11 ILE 58 6.881 -6.397 -5.746 498 HG21 ILE 58 HG21 ILE 58 4.259 -4.464 -7.528 499 HG22 ILE 58 HG22 ILE 58 5.585 -4.346 -6.361 500 HG23 ILE 58 HG23 ILE 58 4.059 -5.094 -5.890 501 HD11 ILE 58 HD11 ILE 58 4.940 -6.275 -4.352 502 HD12 ILE 58 HD12 ILE 58 5.731 -7.830 -4.095 503 HD13 ILE 58 HD13 ILE 58 4.279 -7.734 -5.079 504 H GLN 59 HN GLN 59 4.167 -6.336 -10.056 505 HA GLN 59 HA GLN 59 2.236 -4.332 -10.096 506 HB2 GLN 59 HB2 GLN 59 3.057 -6.318 -12.184 507 HB3 GLN 59 HB1 GLN 59 2.011 -4.958 -12.543 508 HG2 GLN 59 HG2 GLN 59 4.745 -4.611 -11.370 509 HG3 GLN 59 HG1 GLN 59 4.488 -4.763 -13.105 510 HE21 GLN 59 HE21 GLN 59 4.053 -2.744 -10.312 511 HE22 GLN 59 HE22 GLN 59 3.581 -1.319 -11.174 512 H GLU 60 HN GLU 60 1.926 -7.760 -10.188 513 HA GLU 60 HA GLU 60 -0.865 -7.843 -10.816 514 HB2 GLU 60 HB2 GLU 60 0.936 -9.915 -9.535 515 HB3 GLU 60 HB1 GLU 60 -0.697 -10.217 -10.102 516 HG2 GLU 60 HG2 GLU 60 1.552 -9.311 -11.874 517 HG3 GLU 60 HG1 GLU 60 1.111 -10.998 -11.620 518 H TYR 61 HN TYR 61 1.087 -7.851 -7.887 519 HA TYR 61 HA TYR 61 -1.128 -8.410 -6.147 520 HB2 TYR 61 HB2 TYR 61 1.158 -9.007 -5.450 521 HB3 TYR 61 HB1 TYR 61 1.638 -7.320 -5.534 522 HD1 TYR 61 HD1 TYR 61 0.291 -9.880 -3.462 523 HD2 TYR 61 HD2 TYR 61 0.490 -5.672 -3.975 524 HE1 TYR 61 HE1 TYR 61 -0.355 -9.557 -1.127 525 HE2 TYR 61 HE2 TYR 61 -0.176 -5.348 -1.637 526 HH TYR 61 HH TYR 61 -0.198 -7.879 0.637 527 H LEU 62 HN LEU 62 0.568 -5.680 -7.393 528 HA LEU 62 HA LEU 62 -0.331 -3.602 -5.852 529 HB2 LEU 62 HB2 LEU 62 0.896 -3.987 -8.379 530 HB3 LEU 62 HB1 LEU 62 -0.363 -2.766 -8.556 531 HG LEU 62 HG LEU 62 0.674 -1.494 -6.684 532 HD11 LEU 62 HD11 LEU 62 1.814 -3.123 -5.454 533 HD12 LEU 62 HD12 LEU 62 3.086 -2.154 -6.207 534 HD13 LEU 62 HD13 LEU 62 2.651 -3.733 -6.882 535 HD21 LEU 62 HD21 LEU 62 2.585 -0.677 -7.974 536 HD22 LEU 62 HD22 LEU 62 1.171 -0.917 -8.998 537 HD23 LEU 62 HD23 LEU 62 2.484 -2.093 -9.021 538 H GLU 63 HN GLU 63 -1.863 -5.101 -8.655 539 HA GLU 63 HA GLU 63 -4.070 -3.478 -8.895 540 HB2 GLU 63 HB2 GLU 63 -3.957 -6.462 -9.174 541 HB3 GLU 63 HB1 GLU 63 -5.196 -5.420 -9.839 542 HG2 GLU 63 HG2 GLU 63 -3.468 -4.246 -11.119 543 HG3 GLU 63 HG1 GLU 63 -2.295 -5.411 -10.539 544 H LYS 64 HN LYS 64 -3.591 -6.192 -6.738 545 HA LYS 64 HA LYS 64 -6.144 -6.043 -5.467 546 HB2 LYS 64 HB2 LYS 64 -3.570 -7.367 -4.653 547 HB3 LYS 64 HB1 LYS 64 -5.069 -7.526 -3.751 548 HG2 LYS 64 HG2 LYS 64 -5.155 -9.430 -5.009 549 HG3 LYS 64 HG1 LYS 64 -6.003 -8.308 -6.072 550 HD2 LYS 64 HD2 LYS 64 -3.942 -7.918 -7.314 551 HD3 LYS 64 HD1 LYS 64 -3.092 -9.049 -6.260 552 HE2 LYS 64 HE2 LYS 64 -3.712 -10.114 -8.362 553 HE3 LYS 64 HE1 LYS 64 -4.559 -10.854 -7.005 554 HZ1 LYS 64 HZ1 LYS 64 -5.712 -8.832 -8.849 555 HZ2 LYS 64 HZ2 LYS 64 -6.521 -9.581 -7.569 556 HZ3 LYS 64 HZ3 LYS 64 -6.020 -10.492 -8.899 557 H ALA 65 HN ALA 65 -2.904 -4.905 -4.777 558 HA ALA 65 HA ALA 65 -3.293 -3.884 -2.205 559 HB1 ALA 65 HB1 ALA 65 -1.430 -2.858 -4.335 560 HB2 ALA 65 HB2 ALA 65 -1.096 -4.219 -3.266 561 HB3 ALA 65 HB3 ALA 65 -1.277 -2.595 -2.597 562 H LEU 66 HN LEU 66 -4.000 -2.617 -5.345 563 HA LEU 66 HA LEU 66 -4.621 0.050 -4.427 564 HB2 LEU 66 HB2 LEU 66 -4.826 -1.417 -6.997 565 HB3 LEU 66 HB1 LEU 66 -5.916 -0.064 -6.781 566 HG LEU 66 HG LEU 66 -3.938 0.615 -7.984 567 HD11 LEU 66 HD11 LEU 66 -3.268 2.508 -6.627 568 HD12 LEU 66 HD12 LEU 66 -3.909 1.729 -5.184 569 HD13 LEU 66 HD13 LEU 66 -5.002 2.233 -6.473 570 HD21 LEU 66 HD21 LEU 66 -1.739 0.624 -6.771 571 HD22 LEU 66 HD22 LEU 66 -2.333 -0.968 -7.259 572 HD23 LEU 66 HD23 LEU 66 -2.492 -0.445 -5.581 573 H ASN 67 HN ASN 67 -6.266 -2.920 -4.869 574 HA ASN 67 HA ASN 67 -8.892 -1.783 -4.501 575 HB2 ASN 67 HB2 ASN 67 -7.846 -4.454 -5.194 576 HB3 ASN 67 HB1 ASN 67 -9.455 -4.339 -4.542 577 HD21 ASN 67 HD21 ASN 67 -7.386 -3.584 -7.214 578 HD22 ASN 67 HD22 ASN 67 -8.646 -3.138 -8.312 579 H LYS 68 HN LYS 68 -6.466 -2.620 -2.464 580 HA LYS 68 HA LYS 68 -7.643 -4.125 -0.442 581 HB2 LYS 68 HB2 LYS 68 -5.493 -2.025 -0.381 582 HB3 LYS 68 HB1 LYS 68 -6.034 -2.815 1.092 583 HG2 LYS 68 HG2 LYS 68 -4.954 -4.265 -1.313 584 HG3 LYS 68 HG1 LYS 68 -3.987 -3.801 0.086 585 HD2 LYS 68 HD2 LYS 68 -5.488 -5.157 1.516 586 HD3 LYS 68 HD1 LYS 68 -6.360 -5.666 0.072 587 HE2 LYS 68 HE2 LYS 68 -4.830 -7.400 0.600 588 HE3 LYS 68 HE1 LYS 68 -4.191 -6.561 -0.811 589 HZ1 LYS 68 HZ1 LYS 68 -2.750 -5.292 0.750 590 HZ2 LYS 68 HZ2 LYS 68 -2.407 -6.946 0.687 591 HZ3 LYS 68 HZ3 LYS 68 -3.268 -6.309 1.998 592 H GLY 69 HN GLY 69 -7.400 -0.571 -0.626 593 HA2 GLY 69 HA2 GLY 69 -10.011 -0.101 0.262 594 HA3 GLY 69 HA1 GLY 69 -8.952 -0.102 1.665 595 H ARG 70 HN ARG 70 -9.988 1.604 -1.135 596 HA ARG 70 HA ARG 70 -8.068 3.686 -1.138 597 HB2 ARG 70 HB2 ARG 70 -9.599 3.341 -3.010 598 HB3 ARG 70 HB1 ARG 70 -10.977 3.682 -1.978 599 HG2 ARG 70 HG2 ARG 70 -10.512 5.589 -3.361 600 HG3 ARG 70 HG1 ARG 70 -10.156 5.984 -1.680 601 HD2 ARG 70 HD2 ARG 70 -8.434 6.843 -3.183 602 HD3 ARG 70 HD1 ARG 70 -7.782 5.626 -2.087 603 HE ARG 70 HE ARG 70 -8.533 4.318 -4.426 604 HH11 ARG 70 HH11 ARG 70 -6.272 6.804 -3.467 605 HH12 ARG 70 HH12 ARG 70 -5.091 6.369 -4.661 606 HH21 ARG 70 HH21 ARG 70 -6.985 3.740 -6.001 607 HH22 ARG 70 HH22 ARG 70 -5.495 4.623 -6.099 608 H ARG 71 HN ARG 71 -10.876 2.971 0.740 609 HA ARG 71 HA ARG 71 -10.203 5.155 2.561 610 HB2 ARG 71 HB2 ARG 71 -12.529 5.721 2.928 611 HB3 ARG 71 HB1 ARG 71 -12.168 5.882 1.219 612 HG2 ARG 71 HG2 ARG 71 -13.449 3.416 2.351 613 HG3 ARG 71 HG1 ARG 71 -14.387 4.825 1.858 614 HD2 ARG 71 HD2 ARG 71 -12.515 3.259 0.087 615 HD3 ARG 71 HD1 ARG 71 -14.270 3.112 0.101 616 HE ARG 71 HE ARG 71 -13.620 5.797 -0.336 617 HH11 ARG 71 HH11 ARG 71 -13.327 2.710 -1.971 618 HH12 ARG 71 HH12 ARG 71 -13.430 3.399 -3.561 619 HH21 ARG 71 HH21 ARG 71 -13.746 6.700 -2.427 620 HH22 ARG 71 HH22 ARG 71 -13.659 5.666 -3.822 621 H GLU 72 HN GLU 72 -10.672 4.683 4.741 622 HA GLU 72 HA GLU 72 -10.422 1.901 5.341 623 HB2 GLU 72 HB2 GLU 72 -9.417 3.994 6.555 624 HB3 GLU 72 HB1 GLU 72 -10.948 4.002 7.416 625 HG2 GLU 72 HG2 GLU 72 -9.124 1.615 7.295 626 HG3 GLU 72 HG1 GLU 72 -9.058 2.831 8.566 627 H GLU 73 HN GLU 73 -12.232 0.803 4.836 628 HA GLU 73 HA GLU 73 -14.597 1.364 6.491 629 HB2 GLU 73 HB2 GLU 73 -16.018 0.517 4.639 630 HB3 GLU 73 HB1 GLU 73 -15.176 2.002 4.227 631 HG2 GLU 73 HG2 GLU 73 -13.614 0.839 2.866 632 HG3 GLU 73 HG1 GLU 73 -14.191 -0.725 3.442 633 H LYS 74 HN LYS 74 -12.323 -0.360 6.963 634 HA LYS 74 HA LYS 74 -13.570 -3.009 6.640 635 HB2 LYS 74 HB2 LYS 74 -11.177 -3.872 6.807 636 HB3 LYS 74 HB1 LYS 74 -11.633 -3.062 5.318 637 HG2 LYS 74 HG2 LYS 74 -10.554 -1.001 6.153 638 HG3 LYS 74 HG1 LYS 74 -10.022 -1.897 7.578 639 HD2 LYS 74 HD2 LYS 74 -8.712 -3.388 6.213 640 HD3 LYS 74 HD1 LYS 74 -9.342 -2.650 4.739 641 HE2 LYS 74 HE2 LYS 74 -8.264 -0.547 5.315 642 HE3 LYS 74 HE1 LYS 74 -7.673 -1.246 6.820 643 HZ1 LYS 74 HZ1 LYS 74 -6.364 -2.815 5.544 644 HZ2 LYS 74 HZ2 LYS 74 -5.966 -1.230 5.110 645 HZ3 LYS 74 HZ3 LYS 74 -6.940 -2.163 4.093 646 H VAL 75 HN VAL 75 -14.123 -1.240 8.755 647 HA VAL 75 HA VAL 75 -12.699 -2.064 11.096 648 HB VAL 75 HB VAL 75 -14.541 -0.952 12.349 649 HG11 VAL 75 HG11 VAL 75 -14.046 1.321 11.567 650 HG12 VAL 75 HG12 VAL 75 -13.337 0.651 10.098 651 HG13 VAL 75 HG13 VAL 75 -12.595 0.323 11.665 652 HG21 VAL 75 HG21 VAL 75 -16.368 -1.426 10.794 653 HG22 VAL 75 HG22 VAL 75 -15.633 -0.356 9.599 654 HG23 VAL 75 HG23 VAL 75 -16.237 0.302 11.119 655 H GLY 76 HN GLY 76 -15.050 -3.511 9.164 656 HA2 GLY 76 HA2 GLY 76 -16.293 -5.103 11.225 657 HA3 GLY 76 HA1 GLY 76 -16.463 -5.323 9.488 658 H LYS 77 HN LYS 77 -13.685 -5.328 11.665 659 HA LYS 77 HA LYS 77 -12.650 -7.732 10.384 660 HB2 LYS 77 HB2 LYS 77 -11.211 -5.728 10.827 661 HB3 LYS 77 HB1 LYS 77 -11.434 -5.998 12.548 662 HG2 LYS 77 HG2 LYS 77 -10.365 -8.215 12.296 663 HG3 LYS 77 HG1 LYS 77 -10.061 -7.838 10.599 664 HD2 LYS 77 HD2 LYS 77 -9.026 -6.275 12.966 665 HD3 LYS 77 HD1 LYS 77 -8.090 -7.403 11.988 666 HE2 LYS 77 HE2 LYS 77 -8.441 -5.994 10.022 667 HE3 LYS 77 HE1 LYS 77 -9.390 -4.870 10.993 668 HZ1 LYS 77 HZ1 LYS 77 -6.516 -5.507 11.381 669 HZ2 LYS 77 HZ2 LYS 77 -7.425 -4.463 12.352 670 HZ3 LYS 77 HZ3 LYS 77 -7.144 -4.074 10.731 671 H LYS 78 HN LYS 78 -12.260 -9.667 11.518 672 HA LYS 78 HA LYS 78 -14.046 -10.057 13.772 673 HB2 LYS 78 HB2 LYS 78 -12.306 -12.089 12.367 674 HB3 LYS 78 HB1 LYS 78 -13.647 -12.424 13.452 675 HG2 LYS 78 HG2 LYS 78 -13.841 -11.104 10.753 676 HG3 LYS 78 HG1 LYS 78 -14.290 -12.766 11.135 677 HD2 LYS 78 HD2 LYS 78 -16.058 -12.015 12.579 678 HD3 LYS 78 HD1 LYS 78 -15.541 -10.337 12.412 679 HE2 LYS 78 HE2 LYS 78 -17.490 -10.794 11.023 680 HE3 LYS 78 HE1 LYS 78 -16.086 -10.397 10.035 681 HZ1 LYS 78 HZ1 LYS 78 -17.364 -12.292 9.175 682 HZ2 LYS 78 HZ2 LYS 78 -17.027 -13.156 10.586 683 HZ3 LYS 78 HZ3 LYS 78 -15.770 -12.711 9.550 684 H GLU 79 HN GLU 79 -11.392 -8.613 13.830 685 HA GLU 79 HA GLU 79 -10.336 -9.957 16.221 686 HB2 GLU 79 HB2 GLU 79 -8.771 -8.300 14.225 687 HB3 GLU 79 HB1 GLU 79 -8.120 -9.075 15.661 688 HG2 GLU 79 HG2 GLU 79 -8.602 -11.260 14.732 689 HG3 GLU 79 HG1 GLU 79 -9.335 -10.513 13.313 690 H LYS 80 HN LYS 80 -11.506 -8.750 17.688 691 HA LYS 80 HA LYS 80 -12.033 -5.979 17.255 692 HB2 LYS 80 HB2 LYS 80 -13.218 -6.035 19.362 693 HB3 LYS 80 HB1 LYS 80 -13.630 -7.450 18.410 694 HG2 LYS 80 HG2 LYS 80 -12.199 -8.835 19.768 695 HG3 LYS 80 HG1 LYS 80 -11.645 -7.423 20.671 696 HD2 LYS 80 HD2 LYS 80 -13.940 -7.039 21.458 697 HD3 LYS 80 HD1 LYS 80 -14.476 -8.469 20.574 698 HE2 LYS 80 HE2 LYS 80 -13.005 -9.863 21.936 699 HE3 LYS 80 HE1 LYS 80 -12.447 -8.437 22.805 700 HZ1 LYS 80 HZ1 LYS 80 -14.151 -9.672 24.024 701 HZ2 LYS 80 HZ2 LYS 80 -15.249 -9.414 22.765 702 HZ3 LYS 80 HZ3 LYS 80 -14.664 -8.102 23.654 703 H ILE 81 HN ILE 81 -11.372 -4.216 18.424 704 HA ILE 81 HA ILE 81 -8.779 -4.493 19.762 705 HB ILE 81 HB ILE 81 -8.644 -2.024 19.579 706 HG12 ILE 81 HG12 ILE 81 -11.166 -2.280 17.927 707 HG13 ILE 81 HG11 ILE 81 -11.099 -1.611 19.554 708 HG21 ILE 81 HG21 ILE 81 -8.262 -1.944 17.166 709 HG22 ILE 81 HG22 ILE 81 -9.155 -3.453 16.975 710 HG23 ILE 81 HG23 ILE 81 -7.638 -3.434 17.874 711 HD11 ILE 81 HD11 ILE 81 -9.632 0.168 18.751 712 HD12 ILE 81 HD12 ILE 81 -11.172 0.143 17.892 713 HD13 ILE 81 HD13 ILE 81 -9.723 -0.501 17.121 714 H GLY 82 HN GLY 82 -8.441 -3.069 21.698 715 HA2 GLY 82 HA2 GLY 82 -9.038 -2.382 23.813 716 HA3 GLY 82 HA1 GLY 82 -10.676 -2.176 23.214 717 H LYS 83 HN LYS 83 -8.921 -5.194 23.050 718 HA LYS 83 HA LYS 83 -11.036 -6.462 24.577 719 HB2 LYS 83 HB2 LYS 83 -9.785 -8.579 23.941 720 HB3 LYS 83 HB1 LYS 83 -10.457 -7.644 22.613 721 HG2 LYS 83 HG2 LYS 83 -8.265 -6.692 22.158 722 HG3 LYS 83 HG1 LYS 83 -7.582 -7.600 23.507 723 HD2 LYS 83 HD2 LYS 83 -8.077 -9.687 22.413 724 HD3 LYS 83 HD1 LYS 83 -8.934 -8.847 21.119 725 HE2 LYS 83 HE2 LYS 83 -6.000 -8.544 21.747 726 HE3 LYS 83 HE1 LYS 83 -6.664 -9.549 20.461 727 HZ1 LYS 83 HZ1 LYS 83 -7.652 -7.519 19.506 728 HZ2 LYS 83 HZ2 LYS 83 -5.964 -7.471 19.550 729 HZ3 LYS 83 HZ3 LYS 83 -6.862 -6.595 20.684 730 H LYS 84 HN LYS 84 -9.430 -4.728 26.062 731 HA LYS 84 HA LYS 84 -7.609 -6.401 27.607 732 HB2 LYS 84 HB2 LYS 84 -6.961 -4.093 26.928 733 HB3 LYS 84 HB1 LYS 84 -8.287 -3.465 27.893 734 HG2 LYS 84 HG2 LYS 84 -7.247 -4.372 29.909 735 HG3 LYS 84 HG1 LYS 84 -5.912 -4.995 28.935 736 HD2 LYS 84 HD2 LYS 84 -5.397 -2.699 28.212 737 HD3 LYS 84 HD1 LYS 84 -6.701 -2.096 29.235 738 HE2 LYS 84 HE2 LYS 84 -4.568 -1.826 30.350 739 HE3 LYS 84 HE1 LYS 84 -5.555 -3.011 31.204 740 HZ1 LYS 84 HZ1 LYS 84 -4.295 -4.773 30.170 741 HZ2 LYS 84 HZ2 LYS 84 -3.251 -3.722 30.980 742 HZ3 LYS 84 HZ3 LYS 84 -3.376 -3.656 29.297 743 H LYS 85 HN LYS 85 -9.978 -3.944 28.574 744 HA LYS 85 HA LYS 85 -11.568 -3.851 30.179 745 HB2 LYS 85 HB2 LYS 85 -11.698 -6.844 29.775 746 HB3 LYS 85 HB1 LYS 85 -12.905 -5.872 30.603 747 HG2 LYS 85 HG2 LYS 85 -12.161 -5.673 27.692 748 HG3 LYS 85 HG1 LYS 85 -13.615 -6.421 28.350 749 HD2 LYS 85 HD2 LYS 85 -14.228 -4.211 29.326 750 HD3 LYS 85 HD1 LYS 85 -12.849 -3.509 28.481 751 HE2 LYS 85 HE2 LYS 85 -15.240 -4.858 27.240 752 HE3 LYS 85 HE1 LYS 85 -14.860 -3.139 27.198 753 HZ1 LYS 85 HZ1 LYS 85 -14.262 -4.180 25.128 754 HZ2 LYS 85 HZ2 LYS 85 -13.291 -5.313 25.921 755 HZ3 LYS 85 HZ3 LYS 85 -12.855 -3.677 25.922 756 H ARG 86 HN ARG 86 -12.295 -4.965 32.346 757 HA ARG 86 HA ARG 86 -11.879 -5.583 34.472 758 HB2 ARG 86 HB2 ARG 86 -9.509 -6.951 33.213 759 HB3 ARG 86 HB1 ARG 86 -9.919 -7.098 34.915 760 HG2 ARG 86 HG2 ARG 86 -12.063 -8.085 34.334 761 HG3 ARG 86 HG1 ARG 86 -11.695 -7.900 32.618 762 HD2 ARG 86 HD2 ARG 86 -11.282 -10.189 33.437 763 HD3 ARG 86 HD1 ARG 86 -9.825 -9.413 32.819 764 HE ARG 86 HE ARG 86 -10.392 -9.463 35.707 765 HH11 ARG 86 HH11 ARG 86 -8.332 -10.244 32.987 766 HH12 ARG 86 HH12 ARG 86 -6.997 -10.741 33.977 767 HH21 ARG 86 HH21 ARG 86 -8.620 -10.120 37.021 768 HH22 ARG 86 HH22 ARG 86 -7.167 -10.687 36.264 769 H GLN 87 HN GLN 87 -8.505 -5.144 33.433 770 HA GLN 87 HA GLN 87 -8.284 -3.059 35.486 771 HB2 GLN 87 HB2 GLN 87 -5.989 -4.018 35.989 772 HB3 GLN 87 HB1 GLN 87 -7.366 -4.959 36.543 773 HG2 GLN 87 HG2 GLN 87 -7.117 -6.446 34.616 774 HG3 GLN 87 HG1 GLN 87 -5.727 -5.506 34.076 775 HE21 GLN 87 HE21 GLN 87 -6.942 -7.716 36.477 776 HE22 GLN 87 HE22 GLN 87 -5.403 -8.182 37.114 777 H LYS 88 HN LYS 88 -8.005 -1.290 34.332 778 HA LYS 88 HA LYS 88 -6.535 -1.044 31.936 779 HB2 LYS 88 HB2 LYS 88 -7.229 1.008 34.047 780 HB3 LYS 88 HB1 LYS 88 -6.539 1.399 32.480 781 HG2 LYS 88 HG2 LYS 88 -9.164 -0.016 32.867 782 HG3 LYS 88 HG1 LYS 88 -8.994 1.722 32.627 783 HD2 LYS 88 HD2 LYS 88 -8.080 -0.410 30.695 784 HD3 LYS 88 HD1 LYS 88 -9.557 0.540 30.543 785 HE2 LYS 88 HE2 LYS 88 -6.742 1.627 30.550 786 HE3 LYS 88 HE1 LYS 88 -7.772 1.438 29.134 787 HZ1 LYS 88 HZ1 LYS 88 -8.375 3.186 31.458 788 HZ2 LYS 88 HZ2 LYS 88 -9.306 3.034 30.058 789 HZ3 LYS 88 HZ3 LYS 88 -7.762 3.713 29.973 790 H LYS 89 HN LYS 89 -5.711 -0.200 35.279 791 HA LYS 89 HA LYS 89 -2.873 -0.485 34.566 792 HB2 LYS 89 HB2 LYS 89 -2.433 0.755 36.707 793 HB3 LYS 89 HB1 LYS 89 -3.241 1.697 35.467 794 HG2 LYS 89 HG2 LYS 89 -5.350 1.476 36.602 795 HG3 LYS 89 HG1 LYS 89 -4.633 0.386 37.793 796 HD2 LYS 89 HD2 LYS 89 -3.183 2.161 38.585 797 HD3 LYS 89 HD1 LYS 89 -3.797 3.251 37.343 798 HE2 LYS 89 HE2 LYS 89 -5.481 2.008 39.510 799 HE3 LYS 89 HE1 LYS 89 -4.780 3.622 39.599 800 HZ1 LYS 89 HZ1 LYS 89 -7.068 3.714 38.864 801 HZ2 LYS 89 HZ2 LYS 89 -6.734 2.684 37.569 802 HZ3 LYS 89 HZ3 LYS 89 -6.044 4.226 37.621 803 H ARG 90 HN ARG 90 -1.567 -1.300 36.560 804 HA ARG 90 HA ARG 90 -2.505 -3.978 36.850 805 HB2 ARG 90 HB2 ARG 90 -0.046 -2.621 37.947 806 HB3 ARG 90 HB1 ARG 90 -0.365 -4.347 38.057 807 HG2 ARG 90 HG2 ARG 90 0.013 -2.749 35.533 808 HG3 ARG 90 HG1 ARG 90 1.141 -3.912 36.232 809 HD2 ARG 90 HD2 ARG 90 -0.563 -5.678 35.941 810 HD3 ARG 90 HD1 ARG 90 -1.612 -4.503 35.153 811 HE ARG 90 HE ARG 90 0.945 -4.644 33.906 812 HH11 ARG 90 HH11 ARG 90 -2.151 -6.257 34.140 813 HH12 ARG 90 HH12 ARG 90 -2.035 -6.985 32.572 814 HH21 ARG 90 HH21 ARG 90 1.107 -5.611 31.840 815 HH22 ARG 90 HH22 ARG 90 -0.170 -6.638 31.273 816 H LYS 91 HN LYS 91 -2.963 -1.223 38.692 817 HA LYS 91 HA LYS 91 -4.136 -0.849 40.596 818 HB2 LYS 91 HB2 LYS 91 -4.865 -3.750 40.189 819 HB3 LYS 91 HB1 LYS 91 -5.595 -2.730 41.419 820 HG2 LYS 91 HG2 LYS 91 -6.458 -1.244 39.698 821 HG3 LYS 91 HG1 LYS 91 -5.685 -2.227 38.452 822 HD2 LYS 91 HD2 LYS 91 -7.063 -4.134 39.091 823 HD3 LYS 91 HD1 LYS 91 -7.821 -3.172 40.362 824 HE2 LYS 91 HE2 LYS 91 -7.932 -2.572 37.409 825 HE3 LYS 91 HE1 LYS 91 -9.221 -3.322 38.347 826 HZ1 LYS 91 HZ1 LYS 91 -9.369 -1.320 39.686 827 HZ2 LYS 91 HZ2 LYS 91 -9.598 -0.957 38.049 828 HZ3 LYS 91 HZ3 LYS 91 -8.125 -0.599 38.792 829 H ALA 92 HN ALA 92 -1.381 -1.519 40.811 830 HA ALA 92 HA ALA 92 -0.826 -3.428 42.794 831 HB1 ALA 92 HB1 ALA 92 0.751 -0.954 42.095 832 HB2 ALA 92 HB2 ALA 92 0.865 -2.511 41.274 833 HB3 ALA 92 HB3 ALA 92 1.353 -2.367 42.963 834 H ALA 93 HN ALA 93 -1.675 -0.020 43.005 835 HA ALA 93 HA ALA 93 -1.509 -0.177 45.936 836 HB1 ALA 93 HB1 ALA 93 -1.684 2.258 44.164 837 HB2 ALA 93 HB2 ALA 93 -0.216 1.627 44.908 838 HB3 ALA 93 HB3 ALA 93 -1.512 2.262 45.919 839 H GLN 94 HN GLN 94 -3.685 -1.234 44.180 840 HA GLN 94 HA GLN 94 -5.915 0.417 45.154 841 HB2 GLN 94 HB2 GLN 94 -6.002 0.195 42.769 842 HB3 GLN 94 HB1 GLN 94 -5.739 -1.536 42.864 843 HG2 GLN 94 HG2 GLN 94 -8.028 -1.131 42.315 844 HG3 GLN 94 HG1 GLN 94 -7.943 -1.781 43.948 845 HE21 GLN 94 HE21 GLN 94 -10.051 -0.252 42.656 846 HE22 GLN 94 HE22 GLN 94 -10.292 1.156 43.635 847 H LYS 95 HN LYS 95 -6.082 -0.373 47.205 848 HA LYS 95 HA LYS 95 -6.827 -3.209 47.466 849 HB2 LYS 95 HB2 LYS 95 -6.002 -1.231 49.606 850 HB3 LYS 95 HB1 LYS 95 -6.421 -2.914 49.883 851 HG2 LYS 95 HG2 LYS 95 -4.087 -1.925 48.255 852 HG3 LYS 95 HG1 LYS 95 -4.010 -2.578 49.892 853 HD2 LYS 95 HD2 LYS 95 -4.932 -4.714 49.034 854 HD3 LYS 95 HD1 LYS 95 -4.874 -4.047 47.402 855 HE2 LYS 95 HE2 LYS 95 -2.931 -5.443 47.812 856 HE3 LYS 95 HE1 LYS 95 -2.447 -3.759 47.614 857 HZ1 LYS 95 HZ1 LYS 95 -2.775 -5.155 50.216 858 HZ2 LYS 95 HZ2 LYS 95 -2.268 -3.557 50.004 859 HZ3 LYS 95 HZ3 LYS 95 -1.300 -4.830 49.458 860 H ARG 96 HN ARG 96 -8.603 -1.507 46.287 861 HA ARG 96 HA ARG 96 -10.740 -1.287 48.284 862 HB2 ARG 96 HB2 ARG 96 -10.010 0.797 46.216 863 HB3 ARG 96 HB1 ARG 96 -11.466 0.835 47.200 864 HG2 ARG 96 HG2 ARG 96 -10.204 1.145 49.193 865 HG3 ARG 96 HG1 ARG 96 -8.685 0.843 48.344 866 HD2 ARG 96 HD2 ARG 96 -10.553 3.150 47.813 867 HD3 ARG 96 HD1 ARG 96 -9.075 3.235 48.770 868 HE ARG 96 HE ARG 96 -8.884 2.332 45.989 869 HH11 ARG 96 HH11 ARG 96 -8.312 4.815 48.390 870 HH12 ARG 96 HH12 ARG 96 -7.192 5.692 47.399 871 HH21 ARG 96 HH21 ARG 96 -7.421 3.504 44.673 872 HH22 ARG 96 HH22 ARG 96 -6.699 4.958 45.283 873 H LYS 97 HN LYS 97 -12.822 -0.563 46.807 874 HA LYS 97 HA LYS 97 -13.199 -2.808 45.028 875 HB2 LYS 97 HB2 LYS 97 -15.081 -0.575 45.810 876 HB3 LYS 97 HB1 LYS 97 -15.526 -1.990 44.868 877 HG2 LYS 97 HG2 LYS 97 -15.025 -3.433 46.748 878 HG3 LYS 97 HG1 LYS 97 -14.498 -2.042 47.696 879 HD2 LYS 97 HD2 LYS 97 -16.763 -1.089 47.503 880 HD3 LYS 97 HD1 LYS 97 -17.274 -2.531 46.624 881 HE2 LYS 97 HE2 LYS 97 -16.706 -3.907 48.567 882 HE3 LYS 97 HE1 LYS 97 -16.211 -2.461 49.444 883 HZ1 LYS 97 HZ1 LYS 97 -18.432 -3.101 50.068 884 HZ2 LYS 97 HZ2 LYS 97 -18.945 -3.061 48.458 885 HZ3 LYS 97 HZ3 LYS 97 -18.489 -1.631 49.234 886 H ASN 98 HN ASN 98 -13.347 -2.756 42.860 887 HA ASN 98 HA ASN 98 -12.399 -0.413 41.481 888 HB2 ASN 98 HB2 ASN 98 -13.245 -3.146 40.517 889 HB3 ASN 98 HB1 ASN 98 -12.676 -1.875 39.442 890 HD21 ASN 98 HD21 ASN 98 -11.589 -4.531 40.064 891 HD22 ASN 98 HD22 ASN 98 -9.969 -4.261 40.603 Start of MODEL 9 1 H1 LYS 1 HT1 LYS 1 22.933 18.530 10.959 2 H2 LYS 1 HT2 LYS 1 23.439 16.998 11.464 3 H3 LYS 1 HT3 LYS 1 23.156 18.212 12.606 4 HA LYS 1 HA LYS 1 21.365 16.625 12.583 5 HB2 LYS 1 HB2 LYS 1 19.504 18.204 12.287 6 HB3 LYS 1 HB1 LYS 1 20.844 18.955 13.140 7 HG2 LYS 1 HG2 LYS 1 21.522 20.104 11.108 8 HG3 LYS 1 HG1 LYS 1 20.226 19.314 10.212 9 HD2 LYS 1 HD2 LYS 1 19.464 21.501 10.739 10 HD3 LYS 1 HD1 LYS 1 18.609 20.393 11.812 11 HE2 LYS 1 HE2 LYS 1 19.313 22.304 13.083 12 HE3 LYS 1 HE1 LYS 1 20.267 20.913 13.586 13 HZ1 LYS 1 HZ1 LYS 1 21.168 23.013 11.687 14 HZ2 LYS 1 HZ2 LYS 1 22.089 21.701 12.224 15 HZ3 LYS 1 HZ3 LYS 1 21.621 22.905 13.313 16 HA PRO 2 HA PRO 2 20.510 14.895 8.575 17 HB2 PRO 2 HB2 PRO 2 18.699 13.064 9.328 18 HB3 PRO 2 HB1 PRO 2 20.408 12.897 9.750 19 HG2 PRO 2 HG2 PRO 2 18.135 13.892 11.421 20 HG3 PRO 2 HG1 PRO 2 19.445 12.783 11.866 21 HD2 PRO 2 HD2 PRO 2 19.437 15.446 12.488 22 HD3 PRO 2 HD1 PRO 2 20.918 14.494 12.262 23 H VAL 3 HN VAL 3 18.812 14.834 7.050 24 HA VAL 3 HA VAL 3 16.973 16.998 7.279 25 HB VAL 3 HB VAL 3 17.110 14.862 5.143 26 HG11 VAL 3 HG11 VAL 3 14.988 16.099 5.174 27 HG12 VAL 3 HG12 VAL 3 15.941 16.464 3.737 28 HG13 VAL 3 HG13 VAL 3 15.880 17.617 5.069 29 HG21 VAL 3 HG21 VAL 3 18.425 16.490 3.870 30 HG22 VAL 3 HG22 VAL 3 19.235 16.031 5.367 31 HG23 VAL 3 HG23 VAL 3 18.406 17.583 5.253 32 H SER 4 HN SER 4 15.577 16.563 8.947 33 HA SER 4 HA SER 4 13.873 14.189 8.718 34 HB2 SER 4 HB2 SER 4 14.028 16.155 11.013 35 HB3 SER 4 HB1 SER 4 13.322 14.538 11.027 36 HG SER 4 HG SER 4 16.071 15.120 10.587 37 H LEU 5 HN LEU 5 13.252 15.780 6.754 38 HA LEU 5 HA LEU 5 11.089 17.564 7.649 39 HB2 LEU 5 HB2 LEU 5 12.870 17.608 5.237 40 HB3 LEU 5 HB1 LEU 5 11.320 18.420 5.205 41 HG LEU 5 HG LEU 5 13.040 20.024 5.681 42 HD11 LEU 5 HD11 LEU 5 12.221 20.969 7.749 43 HD12 LEU 5 HD12 LEU 5 11.502 19.424 8.196 44 HD13 LEU 5 HD13 LEU 5 10.888 20.311 6.802 45 HD21 LEU 5 HD21 LEU 5 14.441 19.888 7.686 46 HD22 LEU 5 HD22 LEU 5 14.751 18.558 6.572 47 HD23 LEU 5 HD23 LEU 5 13.789 18.285 8.024 48 H SER 6 HN SER 6 11.228 14.546 6.946 49 HA SER 6 HA SER 6 9.795 13.000 6.125 50 HB2 SER 6 HB2 SER 6 8.151 14.467 7.335 51 HB3 SER 6 HB1 SER 6 7.844 15.295 5.809 52 HG SER 6 HG SER 6 6.535 13.743 5.322 53 H TYR 7 HN TYR 7 11.609 14.332 4.297 54 HA TYR 7 HA TYR 7 10.274 14.617 1.781 55 HB2 TYR 7 HB2 TYR 7 13.133 14.419 2.626 56 HB3 TYR 7 HB1 TYR 7 12.726 14.188 0.932 57 HD1 TYR 7 HD1 TYR 7 13.393 16.598 3.483 58 HD2 TYR 7 HD2 TYR 7 11.414 16.037 -0.238 59 HE1 TYR 7 HE1 TYR 7 13.404 19.030 3.113 60 HE2 TYR 7 HE2 TYR 7 11.419 18.463 -0.617 61 HH TYR 7 HH TYR 7 11.546 20.532 0.691 62 H ARG 8 HN ARG 8 10.922 12.054 3.680 63 HA ARG 8 HA ARG 8 11.027 10.181 1.415 64 HB2 ARG 8 HB2 ARG 8 12.262 8.662 2.765 65 HB3 ARG 8 HB1 ARG 8 13.009 10.243 2.985 66 HG2 ARG 8 HG2 ARG 8 11.924 10.506 5.120 67 HG3 ARG 8 HG1 ARG 8 11.047 8.991 4.896 68 HD2 ARG 8 HD2 ARG 8 13.213 7.802 4.804 69 HD3 ARG 8 HD1 ARG 8 14.032 9.325 5.142 70 HE ARG 8 HE ARG 8 12.086 8.828 7.120 71 HH11 ARG 8 HH11 ARG 8 15.227 7.724 6.047 72 HH12 ARG 8 HH12 ARG 8 15.699 7.144 7.612 73 HH21 ARG 8 HH21 ARG 8 12.697 8.053 9.183 74 HH22 ARG 8 HH22 ARG 8 14.265 7.339 9.399 75 H CYS 9 HN CYS 9 9.781 8.237 1.649 76 HA CYS 9 HA CYS 9 7.382 8.706 3.268 77 HB2 CYS 9 HB2 CYS 9 7.741 7.988 0.548 78 HB3 CYS 9 HB1 CYS 9 6.990 6.615 1.360 79 HA PRO 10 HA PRO 10 7.358 5.609 6.233 80 HB2 PRO 10 HB2 PRO 10 5.636 3.990 4.422 81 HB3 PRO 10 HB1 PRO 10 5.466 4.297 6.152 82 HG2 PRO 10 HG2 PRO 10 4.066 5.667 4.297 83 HG3 PRO 10 HG1 PRO 10 4.576 6.366 5.840 84 HD2 PRO 10 HD2 PRO 10 5.506 6.998 3.142 85 HD3 PRO 10 HD1 PRO 10 5.774 7.879 4.658 86 H CYS 11 HN CYS 11 7.612 4.024 3.039 87 HA CYS 11 HA CYS 11 8.989 1.794 4.291 88 HB2 CYS 11 HB2 CYS 11 7.376 2.059 2.005 89 HB3 CYS 11 HB1 CYS 11 8.980 1.637 1.422 90 H ARG 12 HN ARG 12 10.978 1.036 3.706 91 HA ARG 12 HA ARG 12 12.998 2.981 3.109 92 HB2 ARG 12 HB2 ARG 12 13.413 -0.004 3.151 93 HB3 ARG 12 HB1 ARG 12 14.558 1.263 3.568 94 HG2 ARG 12 HG2 ARG 12 12.113 0.525 5.165 95 HG3 ARG 12 HG1 ARG 12 13.767 0.036 5.531 96 HD2 ARG 12 HD2 ARG 12 14.412 2.223 6.071 97 HD3 ARG 12 HD1 ARG 12 13.003 2.928 5.279 98 HE ARG 12 HE ARG 12 11.797 1.561 7.168 99 HH11 ARG 12 HH11 ARG 12 14.717 3.477 7.439 100 HH12 ARG 12 HH12 ARG 12 14.428 3.894 9.098 101 HH21 ARG 12 HH21 ARG 12 11.416 2.115 9.324 102 HH22 ARG 12 HH22 ARG 12 12.546 3.124 10.173 103 H PHE 13 HN PHE 13 14.769 1.839 1.426 104 HA PHE 13 HA PHE 13 13.419 1.988 -1.098 105 HB2 PHE 13 HB2 PHE 13 15.582 1.834 -2.110 106 HB3 PHE 13 HB1 PHE 13 15.760 2.852 -0.685 107 HD1 PHE 13 HD1 PHE 13 16.901 -0.038 -2.397 108 HD2 PHE 13 HD2 PHE 13 16.618 1.751 1.446 109 HE1 PHE 13 HE1 PHE 13 18.646 -1.533 -1.579 110 HE2 PHE 13 HE2 PHE 13 18.365 0.264 2.273 111 HZ PHE 13 HZ PHE 13 19.400 -1.393 0.766 112 H PHE 14 HN PHE 14 13.054 0.299 -2.537 113 HA PHE 14 HA PHE 14 12.470 -2.089 -1.025 114 HB2 PHE 14 HB2 PHE 14 11.560 -2.259 -3.741 115 HB3 PHE 14 HB1 PHE 14 10.636 -2.200 -2.253 116 HD1 PHE 14 HD1 PHE 14 9.753 -0.132 -1.395 117 HD2 PHE 14 HD2 PHE 14 11.945 -0.238 -5.038 118 HE1 PHE 14 HE1 PHE 14 8.924 2.110 -1.952 119 HE2 PHE 14 HE2 PHE 14 11.122 2.009 -5.602 120 HZ PHE 14 HZ PHE 14 9.609 3.189 -4.058 121 H GLU 15 HN GLU 15 12.743 -4.203 -1.861 122 HA GLU 15 HA GLU 15 15.313 -4.512 -3.203 123 HB2 GLU 15 HB2 GLU 15 15.553 -5.428 -1.107 124 HB3 GLU 15 HB1 GLU 15 13.860 -5.860 -0.999 125 HG2 GLU 15 HG2 GLU 15 15.018 -7.868 -1.093 126 HG3 GLU 15 HG1 GLU 15 14.312 -7.606 -2.681 127 H SER 16 HN SER 16 15.334 -5.456 -5.117 128 HA SER 16 HA SER 16 12.783 -6.414 -6.192 129 HB2 SER 16 HB2 SER 16 15.357 -5.666 -7.609 130 HB3 SER 16 HB1 SER 16 13.880 -6.193 -8.412 131 HG SER 16 HG SER 16 14.034 -3.939 -6.693 132 H HIS 17 HN HIS 17 14.258 -8.075 -4.400 133 HA HIS 17 HA HIS 17 14.685 -10.355 -6.210 134 HB2 HIS 17 HB2 HIS 17 16.202 -9.685 -3.687 135 HB3 HIS 17 HB1 HIS 17 16.245 -11.274 -4.441 136 HD1 HIS 17 HD1 HIS 17 17.406 -7.748 -4.908 137 HD2 HIS 17 HD2 HIS 17 17.797 -11.457 -6.747 138 HE1 HIS 17 HE1 HIS 17 19.222 -7.469 -6.626 139 HE2 HIS 17 HE2 HIS 17 19.307 -9.670 -7.844 140 H ILE 18 HN ILE 18 12.826 -8.980 -3.880 141 HA ILE 18 HA ILE 18 12.061 -11.275 -2.374 142 HB ILE 18 HB ILE 18 10.554 -8.712 -2.880 143 HG12 ILE 18 HG12 ILE 18 12.214 -9.473 -0.488 144 HG13 ILE 18 HG11 ILE 18 12.829 -8.508 -1.818 145 HG21 ILE 18 HG21 ILE 18 10.160 -10.782 -0.727 146 HG22 ILE 18 HG22 ILE 18 9.092 -10.514 -2.104 147 HG23 ILE 18 HG23 ILE 18 9.278 -9.261 -0.875 148 HD11 ILE 18 HD11 ILE 18 10.552 -7.771 0.004 149 HD12 ILE 18 HD12 ILE 18 11.141 -6.803 -1.347 150 HD13 ILE 18 HD13 ILE 18 12.187 -7.099 0.044 151 H ALA 19 HN ALA 19 10.530 -12.768 -2.794 152 HA ALA 19 HA ALA 19 9.034 -12.552 -5.324 153 HB1 ALA 19 HB1 ALA 19 9.392 -14.900 -5.735 154 HB2 ALA 19 HB2 ALA 19 10.269 -15.065 -4.214 155 HB3 ALA 19 HB3 ALA 19 10.950 -14.101 -5.526 156 H ARG 20 HN ARG 20 7.057 -13.870 -5.392 157 HA ARG 20 HA ARG 20 5.425 -13.442 -3.171 158 HB2 ARG 20 HB2 ARG 20 4.760 -13.832 -5.613 159 HB3 ARG 20 HB1 ARG 20 4.906 -15.549 -5.251 160 HG2 ARG 20 HG2 ARG 20 3.190 -15.389 -3.572 161 HG3 ARG 20 HG1 ARG 20 3.095 -13.641 -3.796 162 HD2 ARG 20 HD2 ARG 20 2.463 -14.055 -6.167 163 HD3 ARG 20 HD1 ARG 20 2.392 -15.778 -5.797 164 HE ARG 20 HE ARG 20 0.776 -14.428 -3.958 165 HH11 ARG 20 HH11 ARG 20 0.856 -15.171 -7.377 166 HH12 ARG 20 HH12 ARG 20 -0.870 -15.095 -7.559 167 HH21 ARG 20 HH21 ARG 20 -1.502 -14.327 -4.205 168 HH22 ARG 20 HH22 ARG 20 -2.203 -14.626 -5.764 169 H ALA 21 HN ALA 21 7.249 -16.251 -4.178 170 HA ALA 21 HA ALA 21 6.070 -17.951 -2.161 171 HB1 ALA 21 HB1 ALA 21 6.716 -18.890 -4.324 172 HB2 ALA 21 HB2 ALA 21 7.579 -19.669 -2.999 173 HB3 ALA 21 HB3 ALA 21 8.396 -18.468 -3.998 174 H ASN 22 HN ASN 22 8.567 -15.737 -2.338 175 HA ASN 22 HA ASN 22 10.088 -16.953 -0.206 176 HB2 ASN 22 HB2 ASN 22 10.596 -14.691 -2.123 177 HB3 ASN 22 HB1 ASN 22 11.612 -14.952 -0.719 178 HD21 ASN 22 HD21 ASN 22 13.402 -15.335 -1.991 179 HD22 ASN 22 HD22 ASN 22 13.606 -16.798 -2.888 180 H VAL 23 HN VAL 23 7.563 -14.838 -0.570 181 HA VAL 23 HA VAL 23 8.386 -13.209 1.713 182 HB VAL 23 HB VAL 23 7.732 -11.908 -0.219 183 HG11 VAL 23 HG11 VAL 23 5.370 -11.914 -0.982 184 HG12 VAL 23 HG12 VAL 23 5.095 -13.339 0.026 185 HG13 VAL 23 HG13 VAL 23 6.224 -13.421 -1.335 186 HG21 VAL 23 HG21 VAL 23 6.149 -10.453 0.824 187 HG22 VAL 23 HG22 VAL 23 7.269 -11.093 2.036 188 HG23 VAL 23 HG23 VAL 23 5.636 -11.745 1.911 189 H LYS 24 HN LYS 24 7.208 -12.980 3.464 190 HA LYS 24 HA LYS 24 5.062 -14.880 3.977 191 HB2 LYS 24 HB2 LYS 24 6.581 -13.113 5.899 192 HB3 LYS 24 HB1 LYS 24 5.384 -14.315 6.335 193 HG2 LYS 24 HG2 LYS 24 6.959 -15.954 5.106 194 HG3 LYS 24 HG1 LYS 24 8.155 -14.681 5.363 195 HD2 LYS 24 HD2 LYS 24 6.443 -15.690 7.602 196 HD3 LYS 24 HD1 LYS 24 7.936 -16.500 7.158 197 HE2 LYS 24 HE2 LYS 24 9.192 -14.473 7.550 198 HE3 LYS 24 HE1 LYS 24 7.705 -13.591 7.897 199 HZ1 LYS 24 HZ1 LYS 24 7.360 -14.948 9.834 200 HZ2 LYS 24 HZ2 LYS 24 8.910 -14.272 9.907 201 HZ3 LYS 24 HZ3 LYS 24 8.715 -15.893 9.475 202 H HIS 25 HN HIS 25 3.993 -13.388 6.111 203 HA HIS 25 HA HIS 25 1.780 -12.194 5.255 204 HB2 HIS 25 HB2 HIS 25 3.153 -10.583 7.330 205 HB3 HIS 25 HB1 HIS 25 1.524 -11.238 7.330 206 HD1 HIS 25 HD1 HIS 25 3.090 -11.310 9.862 207 HD2 HIS 25 HD2 HIS 25 3.268 -14.441 7.122 208 HE1 HIS 25 HE1 HIS 25 3.855 -13.310 11.162 209 HE2 HIS 25 HE2 HIS 25 3.771 -15.227 9.533 210 H LEU 26 HN LEU 26 1.603 -10.810 3.565 211 HA LEU 26 HA LEU 26 3.570 -8.662 3.317 212 HB2 LEU 26 HB2 LEU 26 3.290 -10.097 1.378 213 HB3 LEU 26 HB1 LEU 26 1.577 -9.735 1.317 214 HG LEU 26 HG LEU 26 1.997 -7.492 0.604 215 HD11 LEU 26 HD11 LEU 26 3.900 -7.078 2.106 216 HD12 LEU 26 HD12 LEU 26 4.212 -6.548 0.463 217 HD13 LEU 26 HD13 LEU 26 4.917 -8.050 1.056 218 HD21 LEU 26 HD21 LEU 26 4.137 -8.511 -1.062 219 HD22 LEU 26 HD22 LEU 26 2.465 -8.108 -1.494 220 HD23 LEU 26 HD23 LEU 26 2.850 -9.712 -0.868 221 H LYS 27 HN LYS 27 3.095 -6.608 3.556 222 HA LYS 27 HA LYS 27 0.294 -5.818 4.022 223 HB2 LYS 27 HB2 LYS 27 1.239 -5.980 6.190 224 HB3 LYS 27 HB1 LYS 27 2.747 -5.259 5.658 225 HG2 LYS 27 HG2 LYS 27 1.599 -3.667 6.993 226 HG3 LYS 27 HG1 LYS 27 1.556 -3.125 5.312 227 HD2 LYS 27 HD2 LYS 27 -0.735 -3.985 5.107 228 HD3 LYS 27 HD1 LYS 27 -0.682 -4.532 6.783 229 HE2 LYS 27 HE2 LYS 27 -0.374 -2.218 7.524 230 HE3 LYS 27 HE1 LYS 27 -0.430 -1.673 5.848 231 HZ1 LYS 27 HZ1 LYS 27 -2.556 -1.368 6.915 232 HZ2 LYS 27 HZ2 LYS 27 -2.633 -3.004 7.327 233 HZ3 LYS 27 HZ3 LYS 27 -2.696 -2.538 5.703 234 H ILE 28 HN ILE 28 -0.284 -3.834 3.246 235 HA ILE 28 HA ILE 28 1.769 -2.384 1.718 236 HB ILE 28 HB ILE 28 -1.221 -2.276 1.314 237 HG12 ILE 28 HG12 ILE 28 -0.460 -4.516 0.806 238 HG13 ILE 28 HG11 ILE 28 -0.770 -3.673 -0.698 239 HG21 ILE 28 HG21 ILE 28 -0.627 -1.240 -0.838 240 HG22 ILE 28 HG22 ILE 28 1.074 -1.276 -0.369 241 HG23 ILE 28 HG23 ILE 28 -0.072 -0.288 0.540 242 HD11 ILE 28 HD11 ILE 28 1.237 -5.035 -0.797 243 HD12 ILE 28 HD12 ILE 28 1.934 -4.081 0.512 244 HD13 ILE 28 HD13 ILE 28 1.581 -3.320 -1.041 245 H LEU 29 HN LEU 29 2.311 -0.421 2.378 246 HA LEU 29 HA LEU 29 0.992 0.713 4.684 247 HB2 LEU 29 HB2 LEU 29 3.561 0.714 4.026 248 HB3 LEU 29 HB1 LEU 29 3.113 2.178 3.163 249 HG LEU 29 HG LEU 29 4.046 2.703 5.347 250 HD11 LEU 29 HD11 LEU 29 2.210 4.098 6.234 251 HD12 LEU 29 HD12 LEU 29 1.086 3.281 5.142 252 HD13 LEU 29 HD13 LEU 29 2.412 4.246 4.490 253 HD21 LEU 29 HD21 LEU 29 2.910 2.074 7.405 254 HD22 LEU 29 HD22 LEU 29 3.427 0.645 6.510 255 HD23 LEU 29 HD23 LEU 29 1.734 1.137 6.487 256 H ASN 30 HN ASN 30 -0.607 2.088 4.597 257 HA ASN 30 HA ASN 30 -1.425 3.388 2.185 258 HB2 ASN 30 HB2 ASN 30 -2.290 3.613 5.059 259 HB3 ASN 30 HB1 ASN 30 -2.988 4.586 3.780 260 HD21 ASN 30 HD21 ASN 30 -2.698 1.428 5.147 261 HD22 ASN 30 HD22 ASN 30 -3.965 0.680 4.237 262 H THR 31 HN THR 31 0.204 4.715 1.477 263 HA THR 31 HA THR 31 1.617 6.446 3.230 264 HB THR 31 HB THR 31 2.287 7.317 0.816 265 HG1 THR 31 HG1 THR 31 2.205 5.027 -0.327 266 HG21 THR 31 HG21 THR 31 3.827 6.348 2.377 267 HG22 THR 31 HG22 THR 31 4.028 5.543 0.819 268 HG23 THR 31 HG23 THR 31 3.142 4.743 2.117 269 HA PRO 32 HA PRO 32 -0.014 10.652 2.820 270 HB2 PRO 32 HB2 PRO 32 2.473 11.041 1.249 271 HB3 PRO 32 HB1 PRO 32 1.796 12.030 2.544 272 HG2 PRO 32 HG2 PRO 32 3.830 10.378 3.024 273 HG3 PRO 32 HG1 PRO 32 2.537 10.607 4.210 274 HD2 PRO 32 HD2 PRO 32 3.094 8.302 2.446 275 HD3 PRO 32 HD1 PRO 32 2.314 8.350 4.032 276 H ASN 33 HN ASN 33 -0.043 8.540 0.355 277 HA ASN 33 HA ASN 33 -0.661 8.500 -1.818 278 HB2 ASN 33 HB2 ASN 33 -0.475 11.520 -1.775 279 HB3 ASN 33 HB1 ASN 33 -0.942 10.563 -3.174 280 HD21 ASN 33 HD21 ASN 33 -1.868 11.703 -0.048 281 HD22 ASN 33 HD22 ASN 33 -3.533 11.275 -0.142 282 H CYS 34 HN CYS 34 1.655 7.896 -0.895 283 HA CYS 34 HA CYS 34 3.606 8.635 -2.943 284 HB2 CYS 34 HB2 CYS 34 3.677 7.187 -0.329 285 HB3 CYS 34 HB1 CYS 34 4.871 6.750 -1.513 286 H ALA 35 HN ALA 35 4.702 6.527 -3.867 287 HA ALA 35 HA ALA 35 2.880 4.797 -5.073 288 HB1 ALA 35 HB1 ALA 35 5.218 4.934 -5.788 289 HB2 ALA 35 HB2 ALA 35 4.771 3.269 -5.417 290 HB3 ALA 35 HB3 ALA 35 5.732 4.202 -4.270 291 H LEU 36 HN LEU 36 1.964 2.870 -4.447 292 HA LEU 36 HA LEU 36 1.384 2.441 -1.760 293 HB2 LEU 36 HB2 LEU 36 1.204 0.716 -4.213 294 HB3 LEU 36 HB1 LEU 36 0.827 0.045 -2.642 295 HG LEU 36 HG LEU 36 -1.222 0.699 -3.716 296 HD11 LEU 36 HD11 LEU 36 -1.049 1.092 -1.294 297 HD12 LEU 36 HD12 LEU 36 -2.160 2.208 -2.087 298 HD13 LEU 36 HD13 LEU 36 -0.550 2.752 -1.618 299 HD21 LEU 36 HD21 LEU 36 -0.006 3.444 -3.996 300 HD22 LEU 36 HD22 LEU 36 -1.670 3.011 -4.391 301 HD23 LEU 36 HD23 LEU 36 -0.336 2.309 -5.306 302 H GLN 37 HN GLN 37 2.659 1.797 -0.192 303 HA GLN 37 HA GLN 37 5.265 0.708 -0.791 304 HB2 GLN 37 HB2 GLN 37 4.017 1.177 1.907 305 HB3 GLN 37 HB1 GLN 37 5.726 1.047 1.534 306 HG2 GLN 37 HG2 GLN 37 4.045 3.228 0.365 307 HG3 GLN 37 HG1 GLN 37 4.731 3.357 1.983 308 HE21 GLN 37 HE21 GLN 37 5.959 5.071 1.416 309 HE22 GLN 37 HE22 GLN 37 7.377 4.927 0.440 310 H ILE 38 HN ILE 38 5.526 -1.406 -1.047 311 HA ILE 38 HA ILE 38 3.657 -3.234 0.224 312 HB ILE 38 HB ILE 38 5.789 -3.955 -1.785 313 HG12 ILE 38 HG12 ILE 38 3.501 -3.838 -3.253 314 HG13 ILE 38 HG11 ILE 38 3.264 -2.470 -2.182 315 HG21 ILE 38 HG21 ILE 38 3.314 -5.234 -0.713 316 HG22 ILE 38 HG22 ILE 38 4.933 -5.923 -0.978 317 HG23 ILE 38 HG23 ILE 38 3.864 -5.619 -2.345 318 HD11 ILE 38 HD11 ILE 38 4.264 -1.731 -4.221 319 HD12 ILE 38 HD12 ILE 38 5.564 -2.914 -4.067 320 HD13 ILE 38 HD13 ILE 38 5.447 -1.580 -2.922 321 H VAL 39 HN VAL 39 4.307 -3.592 2.306 322 HA VAL 39 HA VAL 39 7.174 -3.953 2.817 323 HB VAL 39 HB VAL 39 5.709 -2.295 4.169 324 HG11 VAL 39 HG11 VAL 39 4.673 -3.201 6.178 325 HG12 VAL 39 HG12 VAL 39 4.941 -4.834 5.568 326 HG13 VAL 39 HG13 VAL 39 3.865 -3.736 4.704 327 HG21 VAL 39 HG21 VAL 39 7.502 -4.276 5.570 328 HG22 VAL 39 HG22 VAL 39 7.040 -2.692 6.197 329 HG23 VAL 39 HG23 VAL 39 8.009 -2.812 4.728 330 H ALA 40 HN ALA 40 8.006 -5.903 3.363 331 HA ALA 40 HA ALA 40 6.071 -8.103 3.661 332 HB1 ALA 40 HB1 ALA 40 6.815 -7.729 1.286 333 HB2 ALA 40 HB2 ALA 40 7.072 -9.346 1.934 334 HB3 ALA 40 HB3 ALA 40 8.424 -8.224 1.806 335 H ARG 41 HN ARG 41 6.693 -9.716 5.009 336 HA ARG 41 HA ARG 41 9.402 -9.576 6.118 337 HB2 ARG 41 HB2 ARG 41 6.848 -10.889 6.980 338 HB3 ARG 41 HB1 ARG 41 8.390 -11.481 7.592 339 HG2 ARG 41 HG2 ARG 41 7.939 -8.568 7.740 340 HG3 ARG 41 HG1 ARG 41 6.985 -9.578 8.808 341 HD2 ARG 41 HD2 ARG 41 9.017 -10.609 9.675 342 HD3 ARG 41 HD1 ARG 41 9.981 -9.611 8.591 343 HE ARG 41 HE ARG 41 8.340 -7.969 10.198 344 HH11 ARG 41 HH11 ARG 41 11.170 -10.020 10.436 345 HH12 ARG 41 HH12 ARG 41 11.859 -9.127 11.755 346 HH21 ARG 41 HH21 ARG 41 9.258 -6.790 11.939 347 HH22 ARG 41 HH22 ARG 41 10.770 -7.309 12.617 348 H LEU 42 HN LEU 42 10.934 -10.882 5.335 349 HA LEU 42 HA LEU 42 10.323 -12.601 3.167 350 HB2 LEU 42 HB2 LEU 42 12.812 -12.024 4.718 351 HB3 LEU 42 HB1 LEU 42 12.787 -13.336 3.557 352 HG LEU 42 HG LEU 42 12.105 -10.479 2.869 353 HD11 LEU 42 HD11 LEU 42 14.691 -11.983 2.468 354 HD12 LEU 42 HD12 LEU 42 14.434 -10.639 3.580 355 HD13 LEU 42 HD13 LEU 42 14.323 -10.377 1.840 356 HD21 LEU 42 HD21 LEU 42 11.113 -12.105 1.367 357 HD22 LEU 42 HD22 LEU 42 12.669 -12.907 1.167 358 HD23 LEU 42 HD23 LEU 42 12.438 -11.269 0.560 359 H LYS 43 HN LYS 43 10.411 -14.797 2.948 360 HA LYS 43 HA LYS 43 9.209 -16.276 4.965 361 HB2 LYS 43 HB2 LYS 43 8.904 -16.954 2.737 362 HB3 LYS 43 HB1 LYS 43 10.631 -17.044 2.455 363 HG2 LYS 43 HG2 LYS 43 10.790 -18.988 3.893 364 HG3 LYS 43 HG1 LYS 43 9.062 -18.881 4.233 365 HD2 LYS 43 HD2 LYS 43 8.472 -19.499 2.069 366 HD3 LYS 43 HD1 LYS 43 10.065 -19.104 1.413 367 HE2 LYS 43 HE2 LYS 43 9.818 -21.507 1.536 368 HE3 LYS 43 HE1 LYS 43 11.012 -20.980 2.725 369 HZ1 LYS 43 HZ1 LYS 43 8.173 -21.625 3.318 370 HZ2 LYS 43 HZ2 LYS 43 9.342 -21.161 4.448 371 HZ3 LYS 43 HZ3 LYS 43 9.493 -22.633 3.632 372 H ASN 44 HN ASN 44 12.530 -16.740 3.739 373 HA ASN 44 HA ASN 44 13.141 -18.373 6.038 374 HB2 ASN 44 HB2 ASN 44 14.784 -17.546 3.664 375 HB3 ASN 44 HB1 ASN 44 15.421 -18.527 4.973 376 HD21 ASN 44 HD21 ASN 44 15.214 -19.237 2.217 377 HD22 ASN 44 HD22 ASN 44 14.171 -20.617 2.118 378 H ASN 45 HN ASN 45 14.173 -15.262 4.716 379 HA ASN 45 HA ASN 45 16.191 -14.801 6.647 380 HB2 ASN 45 HB2 ASN 45 15.858 -13.714 4.325 381 HB3 ASN 45 HB1 ASN 45 14.793 -12.609 5.171 382 HD21 ASN 45 HD21 ASN 45 17.269 -12.064 3.798 383 HD22 ASN 45 HD22 ASN 45 18.323 -11.344 4.962 384 H ASN 46 HN ASN 46 12.789 -14.084 6.505 385 HA ASN 46 HA ASN 46 11.287 -13.513 8.097 386 HB2 ASN 46 HB2 ASN 46 12.669 -15.021 9.551 387 HB3 ASN 46 HB1 ASN 46 13.549 -13.598 10.086 388 HD21 ASN 46 HD21 ASN 46 12.952 -13.774 12.196 389 HD22 ASN 46 HD22 ASN 46 11.336 -13.507 12.751 390 H ARG 47 HN ARG 47 13.623 -11.559 7.011 391 HA ARG 47 HA ARG 47 13.293 -9.361 8.836 392 HB2 ARG 47 HB2 ARG 47 14.719 -9.655 6.204 393 HB3 ARG 47 HB1 ARG 47 14.558 -8.100 7.006 394 HG2 ARG 47 HG2 ARG 47 15.695 -9.085 8.989 395 HG3 ARG 47 HG1 ARG 47 15.986 -10.539 8.033 396 HD2 ARG 47 HD2 ARG 47 17.929 -9.142 7.951 397 HD3 ARG 47 HD1 ARG 47 17.166 -9.172 6.365 398 HE ARG 47 HE ARG 47 16.254 -6.958 7.901 399 HH11 ARG 47 HH11 ARG 47 18.964 -8.085 5.994 400 HH12 ARG 47 HH12 ARG 47 19.488 -6.488 5.564 401 HH21 ARG 47 HH21 ARG 47 16.944 -4.846 7.329 402 HH22 ARG 47 HH22 ARG 47 18.347 -4.649 6.329 403 H GLN 48 HN GLN 48 12.240 -7.491 8.486 404 HA GLN 48 HA GLN 48 10.028 -7.542 6.627 405 HB2 GLN 48 HB2 GLN 48 9.776 -6.660 8.938 406 HB3 GLN 48 HB1 GLN 48 10.859 -5.339 8.527 407 HG2 GLN 48 HG2 GLN 48 9.292 -4.639 6.776 408 HG3 GLN 48 HG1 GLN 48 8.191 -5.919 7.277 409 HE21 GLN 48 HE21 GLN 48 9.571 -2.842 8.082 410 HE22 GLN 48 HE22 GLN 48 8.476 -2.459 9.367 411 H VAL 49 HN VAL 49 10.086 -6.648 4.699 412 HA VAL 49 HA VAL 49 12.243 -4.765 3.973 413 HB VAL 49 HB VAL 49 11.228 -6.492 1.855 414 HG11 VAL 49 HG11 VAL 49 13.622 -6.625 1.231 415 HG12 VAL 49 HG12 VAL 49 13.991 -5.636 2.646 416 HG13 VAL 49 HG13 VAL 49 12.996 -4.980 1.346 417 HG21 VAL 49 HG21 VAL 49 11.289 -8.130 3.587 418 HG22 VAL 49 HG22 VAL 49 12.943 -7.671 3.999 419 HG23 VAL 49 HG23 VAL 49 12.598 -8.418 2.439 420 H CYS 50 HN CYS 50 11.692 -3.887 1.726 421 HA CYS 50 HA CYS 50 8.813 -3.533 1.372 422 HB2 CYS 50 HB2 CYS 50 11.010 -1.557 0.680 423 HB3 CYS 50 HB1 CYS 50 9.298 -1.338 0.398 424 H ILE 51 HN ILE 51 8.095 -4.277 -0.538 425 HA ILE 51 HA ILE 51 10.036 -5.443 -2.363 426 HB ILE 51 HB ILE 51 7.120 -5.481 -2.986 427 HG12 ILE 51 HG12 ILE 51 8.346 -7.126 -0.756 428 HG13 ILE 51 HG11 ILE 51 7.109 -5.889 -0.565 429 HG21 ILE 51 HG21 ILE 51 7.595 -7.484 -4.017 430 HG22 ILE 51 HG22 ILE 51 8.945 -7.834 -2.947 431 HG23 ILE 51 HG23 ILE 51 9.125 -6.627 -4.220 432 HD11 ILE 51 HD11 ILE 51 5.615 -7.289 -2.008 433 HD12 ILE 51 HD12 ILE 51 6.040 -8.007 -0.458 434 HD13 ILE 51 HD13 ILE 51 6.836 -8.555 -1.929 435 H ASP 52 HN ASP 52 10.413 -4.821 -4.437 436 HA ASP 52 HA ASP 52 9.910 -2.132 -5.149 437 HB2 ASP 52 HB2 ASP 52 11.840 -3.403 -6.007 438 HB3 ASP 52 HB1 ASP 52 10.752 -4.435 -6.920 439 HA PRO 53 HA PRO 53 5.706 -2.610 -6.410 440 HB2 PRO 53 HB2 PRO 53 5.425 -0.197 -7.621 441 HB3 PRO 53 HB1 PRO 53 5.424 -0.411 -5.868 442 HG2 PRO 53 HG2 PRO 53 7.666 0.429 -7.655 443 HG3 PRO 53 HG1 PRO 53 7.167 1.107 -6.103 444 HD2 PRO 53 HD2 PRO 53 9.238 -0.564 -6.305 445 HD3 PRO 53 HD1 PRO 53 8.152 -0.593 -4.910 446 H LYS 54 HN LYS 54 8.352 -2.196 -8.538 447 HA LYS 54 HA LYS 54 6.668 -2.393 -10.907 448 HB2 LYS 54 HB2 LYS 54 9.587 -1.777 -10.567 449 HB3 LYS 54 HB1 LYS 54 8.850 -2.047 -12.139 450 HG2 LYS 54 HG2 LYS 54 8.048 0.052 -10.177 451 HG3 LYS 54 HG1 LYS 54 9.018 0.339 -11.609 452 HD2 LYS 54 HD2 LYS 54 6.142 -0.548 -11.449 453 HD3 LYS 54 HD1 LYS 54 6.744 1.002 -12.039 454 HE2 LYS 54 HE2 LYS 54 7.413 -1.639 -13.222 455 HE3 LYS 54 HE1 LYS 54 6.088 -0.640 -13.803 456 HZ1 LYS 54 HZ1 LYS 54 7.720 1.110 -14.279 457 HZ2 LYS 54 HZ2 LYS 54 8.046 -0.299 -15.151 458 HZ3 LYS 54 HZ3 LYS 54 8.973 0.085 -13.791 459 H LEU 55 HN LEU 55 8.203 -4.443 -8.813 460 HA LEU 55 HA LEU 55 9.172 -6.513 -10.378 461 HB2 LEU 55 HB2 LEU 55 7.890 -6.206 -7.724 462 HB3 LEU 55 HB1 LEU 55 7.985 -7.839 -8.358 463 HG LEU 55 HG LEU 55 10.377 -6.029 -8.120 464 HD11 LEU 55 HD11 LEU 55 9.256 -7.980 -6.126 465 HD12 LEU 55 HD12 LEU 55 9.562 -6.254 -5.911 466 HD13 LEU 55 HD13 LEU 55 10.912 -7.374 -6.082 467 HD21 LEU 55 HD21 LEU 55 10.035 -8.992 -8.498 468 HD22 LEU 55 HD22 LEU 55 11.579 -8.192 -8.195 469 HD23 LEU 55 HD23 LEU 55 10.670 -7.831 -9.663 470 H LYS 56 HN LYS 56 8.249 -8.055 -11.598 471 HA LYS 56 HA LYS 56 5.813 -7.478 -12.828 472 HB2 LYS 56 HB2 LYS 56 7.780 -9.662 -12.960 473 HB3 LYS 56 HB1 LYS 56 6.158 -10.077 -13.491 474 HG2 LYS 56 HG2 LYS 56 7.544 -9.366 -15.356 475 HG3 LYS 56 HG1 LYS 56 6.198 -8.259 -15.103 476 HD2 LYS 56 HD2 LYS 56 7.683 -6.705 -13.947 477 HD3 LYS 56 HD1 LYS 56 9.032 -7.821 -14.169 478 HE2 LYS 56 HE2 LYS 56 9.117 -6.063 -15.838 479 HE3 LYS 56 HE1 LYS 56 8.781 -7.614 -16.604 480 HZ1 LYS 56 HZ1 LYS 56 6.784 -5.509 -15.980 481 HZ2 LYS 56 HZ2 LYS 56 6.429 -7.011 -16.669 482 HZ3 LYS 56 HZ3 LYS 56 7.378 -5.895 -17.514 483 H TRP 57 HN TRP 57 6.549 -9.774 -10.230 484 HA TRP 57 HA TRP 57 3.850 -10.772 -10.241 485 HB2 TRP 57 HB2 TRP 57 4.466 -12.147 -8.417 486 HB3 TRP 57 HB1 TRP 57 5.868 -12.098 -9.465 487 HD1 TRP 57 HD1 TRP 57 8.069 -10.966 -8.499 488 HE1 TRP 57 HE1 TRP 57 8.788 -10.350 -6.097 489 HE3 TRP 57 HE3 TRP 57 3.513 -11.220 -6.221 490 HZ2 TRP 57 HZ2 TRP 57 7.560 -10.021 -3.573 491 HZ3 TRP 57 HZ3 TRP 57 3.358 -10.728 -3.823 492 HH2 TRP 57 HH2 TRP 57 5.342 -10.150 -2.521 493 H ILE 58 HN ILE 58 5.594 -8.191 -8.762 494 HA ILE 58 HA ILE 58 3.717 -7.671 -6.665 495 HB ILE 58 HB ILE 58 5.973 -6.126 -7.894 496 HG12 ILE 58 HG12 ILE 58 6.452 -7.942 -6.296 497 HG13 ILE 58 HG11 ILE 58 6.945 -6.368 -5.681 498 HG21 ILE 58 HG21 ILE 58 5.587 -4.387 -6.184 499 HG22 ILE 58 HG22 ILE 58 4.024 -5.128 -5.841 500 HG23 ILE 58 HG23 ILE 58 4.346 -4.448 -7.441 501 HD11 ILE 58 HD11 ILE 58 5.837 -7.829 -4.013 502 HD12 ILE 58 HD12 ILE 58 4.364 -7.718 -4.962 503 HD13 ILE 58 HD13 ILE 58 5.054 -6.268 -4.238 504 H GLN 59 HN GLN 59 4.234 -6.410 -9.921 505 HA GLN 59 HA GLN 59 2.306 -4.422 -10.043 506 HB2 GLN 59 HB2 GLN 59 3.202 -6.437 -12.062 507 HB3 GLN 59 HB1 GLN 59 2.153 -5.099 -12.482 508 HG2 GLN 59 HG2 GLN 59 4.812 -4.651 -11.192 509 HG3 GLN 59 HG1 GLN 59 4.681 -4.922 -12.926 510 HE21 GLN 59 HE21 GLN 59 4.080 -2.746 -10.313 511 HE22 GLN 59 HE22 GLN 59 3.633 -1.378 -11.279 512 H GLU 60 HN GLU 60 1.990 -7.865 -10.105 513 HA GLU 60 HA GLU 60 -0.759 -7.946 -10.886 514 HB2 GLU 60 HB2 GLU 60 0.975 -10.016 -9.518 515 HB3 GLU 60 HB1 GLU 60 -0.634 -10.318 -10.154 516 HG2 GLU 60 HG2 GLU 60 1.729 -9.437 -11.793 517 HG3 GLU 60 HG1 GLU 60 1.167 -11.102 -11.636 518 H TYR 61 HN TYR 61 0.995 -7.953 -7.834 519 HA TYR 61 HA TYR 61 -1.342 -8.411 -6.219 520 HB2 TYR 61 HB2 TYR 61 0.876 -9.066 -5.398 521 HB3 TYR 61 HB1 TYR 61 1.433 -7.407 -5.511 522 HD1 TYR 61 HD1 TYR 61 -0.139 -9.844 -3.445 523 HD2 TYR 61 HD2 TYR 61 0.345 -5.671 -4.041 524 HE1 TYR 61 HE1 TYR 61 -0.845 -9.431 -1.142 525 HE2 TYR 61 HE2 TYR 61 -0.382 -5.253 -1.735 526 HH TYR 61 HH TYR 61 -0.747 -7.808 0.565 527 H LEU 62 HN LEU 62 0.530 -5.773 -7.411 528 HA LEU 62 HA LEU 62 -0.405 -3.609 -6.014 529 HB2 LEU 62 HB2 LEU 62 1.012 -4.138 -8.402 530 HB3 LEU 62 HB1 LEU 62 -0.203 -2.923 -8.771 531 HG LEU 62 HG LEU 62 0.679 -1.566 -6.857 532 HD11 LEU 62 HD11 LEU 62 3.073 -2.213 -6.232 533 HD12 LEU 62 HD12 LEU 62 2.638 -3.824 -6.831 534 HD13 LEU 62 HD13 LEU 62 1.747 -3.108 -5.487 535 HD21 LEU 62 HD21 LEU 62 2.663 -0.785 -8.057 536 HD22 LEU 62 HD22 LEU 62 1.315 -1.071 -9.157 537 HD23 LEU 62 HD23 LEU 62 2.632 -2.239 -9.054 538 H GLU 63 HN GLU 63 -1.779 -5.190 -8.849 539 HA GLU 63 HA GLU 63 -3.821 -3.478 -9.450 540 HB2 GLU 63 HB2 GLU 63 -3.919 -6.479 -9.465 541 HB3 GLU 63 HB1 GLU 63 -4.963 -5.413 -10.382 542 HG2 GLU 63 HG2 GLU 63 -3.008 -4.522 -11.526 543 HG3 GLU 63 HG1 GLU 63 -2.003 -5.667 -10.664 544 H LYS 64 HN LYS 64 -3.751 -5.982 -7.010 545 HA LYS 64 HA LYS 64 -6.434 -5.606 -6.103 546 HB2 LYS 64 HB2 LYS 64 -4.053 -6.927 -4.807 547 HB3 LYS 64 HB1 LYS 64 -5.680 -6.960 -4.137 548 HG2 LYS 64 HG2 LYS 64 -5.634 -8.973 -5.223 549 HG3 LYS 64 HG1 LYS 64 -6.289 -7.934 -6.488 550 HD2 LYS 64 HD2 LYS 64 -4.028 -7.674 -7.416 551 HD3 LYS 64 HD1 LYS 64 -3.419 -8.789 -6.192 552 HE2 LYS 64 HE2 LYS 64 -3.751 -9.985 -8.255 553 HE3 LYS 64 HE1 LYS 64 -4.945 -10.525 -7.076 554 HZ1 LYS 64 HZ1 LYS 64 -5.422 -8.592 -9.280 555 HZ2 LYS 64 HZ2 LYS 64 -6.568 -9.059 -8.131 556 HZ3 LYS 64 HZ3 LYS 64 -5.959 -10.192 -9.223 557 H ALA 65 HN ALA 65 -3.247 -4.643 -4.981 558 HA ALA 65 HA ALA 65 -4.007 -3.347 -2.618 559 HB1 ALA 65 HB1 ALA 65 -1.795 -2.332 -2.709 560 HB2 ALA 65 HB2 ALA 65 -1.647 -2.809 -4.403 561 HB3 ALA 65 HB3 ALA 65 -1.723 -4.042 -3.144 562 H LEU 66 HN LEU 66 -4.228 -2.383 -5.890 563 HA LEU 66 HA LEU 66 -4.488 0.455 -5.188 564 HB2 LEU 66 HB2 LEU 66 -3.959 -0.997 -7.740 565 HB3 LEU 66 HB1 LEU 66 -4.719 0.580 -7.811 566 HG LEU 66 HG LEU 66 -2.805 1.536 -6.605 567 HD11 LEU 66 HD11 LEU 66 -0.752 0.202 -6.389 568 HD12 LEU 66 HD12 LEU 66 -1.657 -1.224 -6.915 569 HD13 LEU 66 HD13 LEU 66 -2.074 -0.427 -5.400 570 HD21 LEU 66 HD21 LEU 66 -2.109 0.027 -9.118 571 HD22 LEU 66 HD22 LEU 66 -1.222 1.407 -8.469 572 HD23 LEU 66 HD23 LEU 66 -2.881 1.609 -9.032 573 H ASN 67 HN ASN 67 -6.280 -2.273 -6.209 574 HA ASN 67 HA ASN 67 -8.502 -0.952 -7.331 575 HB2 ASN 67 HB2 ASN 67 -9.279 -3.019 -7.702 576 HB3 ASN 67 HB1 ASN 67 -7.761 -3.582 -7.059 577 HD21 ASN 67 HD21 ASN 67 -7.692 -4.318 -4.902 578 HD22 ASN 67 HD22 ASN 67 -9.136 -4.875 -4.120 579 H LYS 68 HN LYS 68 -7.709 -1.883 -4.103 580 HA LYS 68 HA LYS 68 -8.338 -1.084 -2.062 581 HB2 LYS 68 HB2 LYS 68 -10.173 0.806 -3.541 582 HB3 LYS 68 HB1 LYS 68 -9.702 0.917 -1.853 583 HG2 LYS 68 HG2 LYS 68 -7.756 1.116 -4.140 584 HG3 LYS 68 HG1 LYS 68 -8.520 2.505 -3.370 585 HD2 LYS 68 HD2 LYS 68 -6.880 0.466 -1.880 586 HD3 LYS 68 HD1 LYS 68 -6.211 1.957 -2.540 587 HE2 LYS 68 HE2 LYS 68 -8.405 1.730 -0.490 588 HE3 LYS 68 HE1 LYS 68 -6.738 2.197 -0.174 589 HZ1 LYS 68 HZ1 LYS 68 -8.126 4.139 -0.292 590 HZ2 LYS 68 HZ2 LYS 68 -8.697 3.703 -1.822 591 HZ3 LYS 68 HZ3 LYS 68 -7.076 4.133 -1.616 592 H GLY 69 HN GLY 69 -11.116 -1.182 -4.252 593 HA2 GLY 69 HA2 GLY 69 -12.477 -3.302 -3.194 594 HA3 GLY 69 HA1 GLY 69 -12.931 -1.930 -2.187 595 H ARG 70 HN ARG 70 -13.947 -3.678 -4.727 596 HA ARG 70 HA ARG 70 -15.078 -1.359 -6.130 597 HB2 ARG 70 HB2 ARG 70 -14.839 -4.237 -7.030 598 HB3 ARG 70 HB1 ARG 70 -15.588 -2.949 -7.966 599 HG2 ARG 70 HG2 ARG 70 -13.406 -1.734 -7.891 600 HG3 ARG 70 HG1 ARG 70 -12.701 -3.172 -7.154 601 HD2 ARG 70 HD2 ARG 70 -14.028 -3.031 -9.858 602 HD3 ARG 70 HD1 ARG 70 -12.294 -3.109 -9.560 603 HE ARG 70 HE ARG 70 -14.089 -5.283 -8.701 604 HH11 ARG 70 HH11 ARG 70 -11.266 -4.158 -10.458 605 HH12 ARG 70 HH12 ARG 70 -10.753 -5.755 -10.896 606 HH21 ARG 70 HH21 ARG 70 -13.409 -7.382 -9.284 607 HH22 ARG 70 HH22 ARG 70 -11.973 -7.588 -10.240 608 H ARG 71 HN ARG 71 -15.832 -3.724 -3.889 609 HA ARG 71 HA ARG 71 -18.703 -3.165 -4.246 610 HB2 ARG 71 HB2 ARG 71 -17.436 -5.641 -3.050 611 HB3 ARG 71 HB1 ARG 71 -19.160 -5.307 -3.090 612 HG2 ARG 71 HG2 ARG 71 -17.376 -5.724 -5.481 613 HG3 ARG 71 HG1 ARG 71 -18.536 -6.881 -4.824 614 HD2 ARG 71 HD2 ARG 71 -19.174 -4.184 -6.015 615 HD3 ARG 71 HD1 ARG 71 -19.453 -5.750 -6.771 616 HE ARG 71 HE ARG 71 -20.758 -5.544 -4.242 617 HH11 ARG 71 HH11 ARG 71 -21.016 -4.655 -7.612 618 HH12 ARG 71 HH12 ARG 71 -22.743 -4.507 -7.576 619 HH21 ARG 71 HH21 ARG 71 -23.030 -5.343 -4.182 620 HH22 ARG 71 HH22 ARG 71 -23.892 -4.918 -5.626 621 H GLU 72 HN GLU 72 -19.290 -1.724 -2.798 622 HA GLU 72 HA GLU 72 -17.775 -0.733 -0.732 623 HB2 GLU 72 HB2 GLU 72 -19.731 0.391 -1.746 624 HB3 GLU 72 HB1 GLU 72 -20.790 -0.729 -0.905 625 HG2 GLU 72 HG2 GLU 72 -20.773 1.302 0.314 626 HG3 GLU 72 HG1 GLU 72 -19.866 0.114 1.246 627 H GLU 73 HN GLU 73 -16.959 -1.959 0.829 628 HA GLU 73 HA GLU 73 -16.789 -3.205 2.703 629 HB2 GLU 73 HB2 GLU 73 -19.558 -2.090 3.059 630 HB3 GLU 73 HB1 GLU 73 -18.769 -3.069 4.288 631 HG2 GLU 73 HG2 GLU 73 -16.917 -1.446 4.350 632 HG3 GLU 73 HG1 GLU 73 -17.788 -0.448 3.187 633 H LYS 74 HN LYS 74 -17.580 -4.629 0.341 634 HA LYS 74 HA LYS 74 -19.073 -6.815 1.626 635 HB2 LYS 74 HB2 LYS 74 -20.043 -5.889 -0.490 636 HB3 LYS 74 HB1 LYS 74 -18.599 -6.429 -1.330 637 HG2 LYS 74 HG2 LYS 74 -20.276 -8.052 -1.725 638 HG3 LYS 74 HG1 LYS 74 -19.143 -8.762 -0.576 639 HD2 LYS 74 HD2 LYS 74 -21.474 -7.311 0.542 640 HD3 LYS 74 HD1 LYS 74 -21.795 -8.851 -0.246 641 HE2 LYS 74 HE2 LYS 74 -19.761 -8.466 1.947 642 HE3 LYS 74 HE1 LYS 74 -21.415 -9.002 2.218 643 HZ1 LYS 74 HZ1 LYS 74 -19.878 -10.858 2.111 644 HZ2 LYS 74 HZ2 LYS 74 -19.397 -10.408 0.555 645 HZ3 LYS 74 HZ3 LYS 74 -20.983 -10.926 0.831 646 H VAL 75 HN VAL 75 -16.489 -6.323 -0.771 647 HA VAL 75 HA VAL 75 -15.124 -8.668 0.374 648 HB VAL 75 HB VAL 75 -14.871 -7.576 -2.435 649 HG11 VAL 75 HG11 VAL 75 -13.664 -10.030 -1.162 650 HG12 VAL 75 HG12 VAL 75 -12.797 -8.580 -1.665 651 HG13 VAL 75 HG13 VAL 75 -13.565 -9.611 -2.872 652 HG21 VAL 75 HG21 VAL 75 -16.234 -10.068 -1.424 653 HG22 VAL 75 HG22 VAL 75 -16.006 -9.642 -3.117 654 HG23 VAL 75 HG23 VAL 75 -17.026 -8.641 -2.088 655 H GLY 76 HN GLY 76 -14.190 -5.861 -1.617 656 HA2 GLY 76 HA2 GLY 76 -11.797 -5.544 0.026 657 HA3 GLY 76 HA1 GLY 76 -12.128 -4.733 -1.500 658 H LYS 77 HN LYS 77 -11.795 -4.216 1.709 659 HA LYS 77 HA LYS 77 -13.087 -1.643 1.515 660 HB2 LYS 77 HB2 LYS 77 -14.270 -1.978 3.733 661 HB3 LYS 77 HB1 LYS 77 -14.969 -2.790 2.343 662 HG2 LYS 77 HG2 LYS 77 -15.093 -4.372 4.035 663 HG3 LYS 77 HG1 LYS 77 -13.663 -4.849 3.125 664 HD2 LYS 77 HD2 LYS 77 -12.237 -3.759 4.777 665 HD3 LYS 77 HD1 LYS 77 -13.663 -3.240 5.676 666 HE2 LYS 77 HE2 LYS 77 -12.829 -6.095 5.166 667 HE3 LYS 77 HE1 LYS 77 -12.648 -5.220 6.686 668 HZ1 LYS 77 HZ1 LYS 77 -15.220 -5.890 5.357 669 HZ2 LYS 77 HZ2 LYS 77 -15.064 -5.010 6.793 670 HZ3 LYS 77 HZ3 LYS 77 -14.590 -6.630 6.740 671 H LYS 78 HN LYS 78 -12.750 -0.418 3.661 672 HA LYS 78 HA LYS 78 -9.985 -0.936 4.540 673 HB2 LYS 78 HB2 LYS 78 -10.257 0.983 2.964 674 HB3 LYS 78 HB1 LYS 78 -11.337 1.738 4.124 675 HG2 LYS 78 HG2 LYS 78 -9.258 2.786 4.394 676 HG3 LYS 78 HG1 LYS 78 -9.415 1.679 5.758 677 HD2 LYS 78 HD2 LYS 78 -7.986 0.066 4.652 678 HD3 LYS 78 HD1 LYS 78 -7.894 1.093 3.219 679 HE2 LYS 78 HE2 LYS 78 -6.902 1.826 5.971 680 HE3 LYS 78 HE1 LYS 78 -5.891 1.278 4.637 681 HZ1 LYS 78 HZ1 LYS 78 -7.567 3.729 4.584 682 HZ2 LYS 78 HZ2 LYS 78 -6.485 3.223 3.388 683 HZ3 LYS 78 HZ3 LYS 78 -5.908 3.703 4.902 684 H GLU 79 HN GLU 79 -10.237 -1.742 6.580 685 HA GLU 79 HA GLU 79 -12.251 -0.635 8.353 686 HB2 GLU 79 HB2 GLU 79 -11.725 -3.077 8.354 687 HB3 GLU 79 HB1 GLU 79 -10.115 -2.698 8.954 688 HG2 GLU 79 HG2 GLU 79 -11.103 -1.713 10.967 689 HG3 GLU 79 HG1 GLU 79 -12.710 -2.114 10.368 690 H LYS 80 HN LYS 80 -11.251 1.515 8.117 691 HA LYS 80 HA LYS 80 -8.762 1.861 9.622 692 HB2 LYS 80 HB2 LYS 80 -8.735 4.136 8.614 693 HB3 LYS 80 HB1 LYS 80 -8.689 2.839 7.431 694 HG2 LYS 80 HG2 LYS 80 -11.058 3.152 6.970 695 HG3 LYS 80 HG1 LYS 80 -11.134 4.427 8.189 696 HD2 LYS 80 HD2 LYS 80 -9.581 5.780 6.920 697 HD3 LYS 80 HD1 LYS 80 -9.375 4.486 5.741 698 HE2 LYS 80 HE2 LYS 80 -11.725 4.676 5.112 699 HE3 LYS 80 HE1 LYS 80 -11.949 5.945 6.312 700 HZ1 LYS 80 HZ1 LYS 80 -11.647 6.858 4.093 701 HZ2 LYS 80 HZ2 LYS 80 -10.143 6.099 3.963 702 HZ3 LYS 80 HZ3 LYS 80 -10.374 7.319 5.108 703 H ILE 81 HN ILE 81 -8.565 3.557 11.145 704 HA ILE 81 HA ILE 81 -9.158 4.624 13.054 705 HB ILE 81 HB ILE 81 -11.675 5.391 11.566 706 HG12 ILE 81 HG12 ILE 81 -8.981 6.775 11.611 707 HG13 ILE 81 HG11 ILE 81 -9.631 5.874 10.246 708 HG21 ILE 81 HG21 ILE 81 -10.185 6.726 13.825 709 HG22 ILE 81 HG22 ILE 81 -11.734 5.892 13.951 710 HG23 ILE 81 HG23 ILE 81 -11.605 7.378 13.008 711 HD11 ILE 81 HD11 ILE 81 -11.466 7.474 10.066 712 HD12 ILE 81 HD12 ILE 81 -9.894 8.263 9.929 713 HD13 ILE 81 HD13 ILE 81 -10.809 8.377 11.432 714 H GLY 82 HN GLY 82 -9.344 2.573 14.099 715 HA2 GLY 82 HA2 GLY 82 -12.067 2.127 15.096 716 HA3 GLY 82 HA1 GLY 82 -11.134 0.756 14.511 717 H LYS 83 HN LYS 83 -10.217 -0.370 16.077 718 HA LYS 83 HA LYS 83 -9.939 0.651 18.721 719 HB2 LYS 83 HB2 LYS 83 -8.825 -1.873 17.486 720 HB3 LYS 83 HB1 LYS 83 -8.859 -1.514 19.207 721 HG2 LYS 83 HG2 LYS 83 -11.304 -1.449 19.140 722 HG3 LYS 83 HG1 LYS 83 -11.259 -1.834 17.419 723 HD2 LYS 83 HD2 LYS 83 -10.113 -3.948 17.950 724 HD3 LYS 83 HD1 LYS 83 -10.238 -3.564 19.668 725 HE2 LYS 83 HE2 LYS 83 -12.674 -3.540 19.483 726 HE3 LYS 83 HE1 LYS 83 -12.550 -3.917 17.766 727 HZ1 LYS 83 HZ1 LYS 83 -11.719 -5.642 20.031 728 HZ2 LYS 83 HZ2 LYS 83 -11.405 -5.993 18.407 729 HZ3 LYS 83 HZ3 LYS 83 -13.000 -5.913 18.960 730 H LYS 84 HN LYS 84 -8.337 1.760 19.565 731 HA LYS 84 HA LYS 84 -5.684 1.665 18.337 732 HB2 LYS 84 HB2 LYS 84 -6.915 3.575 17.357 733 HB3 LYS 84 HB1 LYS 84 -7.207 4.206 18.968 734 HG2 LYS 84 HG2 LYS 84 -4.879 4.644 19.290 735 HG3 LYS 84 HG1 LYS 84 -4.471 3.813 17.789 736 HD2 LYS 84 HD2 LYS 84 -6.375 6.091 17.650 737 HD3 LYS 84 HD1 LYS 84 -4.672 6.451 17.918 738 HE2 LYS 84 HE2 LYS 84 -5.223 6.516 15.545 739 HE3 LYS 84 HE1 LYS 84 -4.080 5.224 15.898 740 HZ1 LYS 84 HZ1 LYS 84 -5.807 3.617 15.719 741 HZ2 LYS 84 HZ2 LYS 84 -5.889 4.601 14.350 742 HZ3 LYS 84 HZ3 LYS 84 -7.002 4.806 15.603 743 H LYS 85 HN LYS 85 -4.005 2.546 19.769 744 HA LYS 85 HA LYS 85 -4.393 1.455 22.393 745 HB2 LYS 85 HB2 LYS 85 -1.992 2.867 21.221 746 HB3 LYS 85 HB1 LYS 85 -2.007 1.897 22.686 747 HG2 LYS 85 HG2 LYS 85 -2.378 -0.098 21.466 748 HG3 LYS 85 HG1 LYS 85 -2.711 0.795 19.980 749 HD2 LYS 85 HD2 LYS 85 -0.384 1.637 20.015 750 HD3 LYS 85 HD1 LYS 85 -0.074 0.640 21.437 751 HE2 LYS 85 HE2 LYS 85 -0.487 -1.369 20.182 752 HE3 LYS 85 HE1 LYS 85 -0.996 -0.434 18.778 753 HZ1 LYS 85 HZ1 LYS 85 1.729 -0.419 19.954 754 HZ2 LYS 85 HZ2 LYS 85 1.237 0.445 18.586 755 HZ3 LYS 85 HZ3 LYS 85 1.271 -1.245 18.550 756 H ARG 86 HN ARG 86 -6.112 3.491 22.382 757 HA ARG 86 HA ARG 86 -6.771 5.419 23.394 758 HB2 ARG 86 HB2 ARG 86 -4.734 4.350 25.334 759 HB3 ARG 86 HB1 ARG 86 -5.709 5.769 25.687 760 HG2 ARG 86 HG2 ARG 86 -7.741 4.434 25.422 761 HG3 ARG 86 HG1 ARG 86 -6.755 3.010 25.089 762 HD2 ARG 86 HD2 ARG 86 -7.561 3.133 27.430 763 HD3 ARG 86 HD1 ARG 86 -5.806 3.080 27.292 764 HE ARG 86 HE ARG 86 -5.996 5.617 27.549 765 HH11 ARG 86 HH11 ARG 86 -8.190 3.339 29.055 766 HH12 ARG 86 HH12 ARG 86 -8.537 4.374 30.402 767 HH21 ARG 86 HH21 ARG 86 -6.455 6.977 29.327 768 HH22 ARG 86 HH22 ARG 86 -7.543 6.434 30.562 769 H GLN 87 HN GLN 87 -5.466 6.309 21.408 770 HA GLN 87 HA GLN 87 -3.351 8.113 22.367 771 HB2 GLN 87 HB2 GLN 87 -4.174 7.395 19.546 772 HB3 GLN 87 HB1 GLN 87 -2.871 8.494 19.969 773 HG2 GLN 87 HG2 GLN 87 -2.974 5.572 20.686 774 HG3 GLN 87 HG1 GLN 87 -2.069 6.262 19.339 775 HE21 GLN 87 HE21 GLN 87 -2.229 5.848 22.779 776 HE22 GLN 87 HE22 GLN 87 -0.641 6.442 23.126 777 H LYS 88 HN LYS 88 -3.579 10.319 22.227 778 HA LYS 88 HA LYS 88 -6.252 11.315 22.136 779 HB2 LYS 88 HB2 LYS 88 -5.156 13.550 22.469 780 HB3 LYS 88 HB1 LYS 88 -4.785 12.351 23.694 781 HG2 LYS 88 HG2 LYS 88 -2.619 11.941 22.651 782 HG3 LYS 88 HG1 LYS 88 -2.993 13.128 21.401 783 HD2 LYS 88 HD2 LYS 88 -3.122 14.882 23.069 784 HD3 LYS 88 HD1 LYS 88 -2.847 13.709 24.357 785 HE2 LYS 88 HE2 LYS 88 -0.633 13.235 23.478 786 HE3 LYS 88 HE1 LYS 88 -0.909 14.346 22.137 787 HZ1 LYS 88 HZ1 LYS 88 -0.906 15.135 24.998 788 HZ2 LYS 88 HZ2 LYS 88 -1.024 16.169 23.665 789 HZ3 LYS 88 HZ3 LYS 88 0.408 15.322 23.951 790 H LYS 89 HN LYS 89 -6.972 10.841 20.063 791 HA LYS 89 HA LYS 89 -5.610 11.927 17.771 792 HB2 LYS 89 HB2 LYS 89 -7.105 9.781 17.937 793 HB3 LYS 89 HB1 LYS 89 -8.431 10.912 17.695 794 HG2 LYS 89 HG2 LYS 89 -7.854 10.024 15.571 795 HG3 LYS 89 HG1 LYS 89 -7.276 11.690 15.616 796 HD2 LYS 89 HD2 LYS 89 -5.023 10.834 16.230 797 HD3 LYS 89 HD1 LYS 89 -5.632 9.192 16.023 798 HE2 LYS 89 HE2 LYS 89 -4.466 9.845 14.028 799 HE3 LYS 89 HE1 LYS 89 -6.190 9.750 13.674 800 HZ1 LYS 89 HZ1 LYS 89 -4.726 12.261 14.271 801 HZ2 LYS 89 HZ2 LYS 89 -6.348 12.130 13.809 802 HZ3 LYS 89 HZ3 LYS 89 -5.124 11.720 12.719 803 H ARG 90 HN ARG 90 -5.815 14.042 19.155 804 HA ARG 90 HA ARG 90 -8.286 15.457 18.692 805 HB2 ARG 90 HB2 ARG 90 -6.867 17.430 19.599 806 HB3 ARG 90 HB1 ARG 90 -7.365 16.155 20.691 807 HG2 ARG 90 HG2 ARG 90 -5.166 16.583 21.277 808 HG3 ARG 90 HG1 ARG 90 -5.057 15.142 20.273 809 HD2 ARG 90 HD2 ARG 90 -4.796 17.745 18.895 810 HD3 ARG 90 HD1 ARG 90 -3.476 17.281 19.964 811 HE ARG 90 HE ARG 90 -4.398 15.722 17.634 812 HH11 ARG 90 HH11 ARG 90 -1.901 16.640 19.927 813 HH12 ARG 90 HH12 ARG 90 -0.655 15.748 19.117 814 HH21 ARG 90 HH21 ARG 90 -2.755 14.532 16.586 815 HH22 ARG 90 HH22 ARG 90 -1.142 14.544 17.226 816 H LYS 91 HN LYS 91 -8.300 17.551 17.557 817 HA LYS 91 HA LYS 91 -7.458 17.036 14.887 818 HB2 LYS 91 HB2 LYS 91 -9.602 18.140 15.461 819 HB3 LYS 91 HB1 LYS 91 -8.703 19.539 16.032 820 HG2 LYS 91 HG2 LYS 91 -7.760 19.796 13.747 821 HG3 LYS 91 HG1 LYS 91 -8.812 18.485 13.215 822 HD2 LYS 91 HD2 LYS 91 -9.853 20.582 12.674 823 HD3 LYS 91 HD1 LYS 91 -10.767 19.816 13.974 824 HE2 LYS 91 HE2 LYS 91 -9.699 21.249 15.609 825 HE3 LYS 91 HE1 LYS 91 -8.683 21.961 14.361 826 HZ1 LYS 91 HZ1 LYS 91 -10.638 22.884 13.318 827 HZ2 LYS 91 HZ2 LYS 91 -10.574 23.370 14.936 828 HZ3 LYS 91 HZ3 LYS 91 -11.645 22.150 14.463 829 H ALA 92 HN ALA 92 -5.222 17.061 14.807 830 HA ALA 92 HA ALA 92 -3.931 19.646 15.325 831 HB1 ALA 92 HB1 ALA 92 -1.810 18.459 15.100 832 HB2 ALA 92 HB2 ALA 92 -2.672 16.973 14.700 833 HB3 ALA 92 HB3 ALA 92 -2.838 17.682 16.306 834 H ALA 93 HN ALA 93 -4.731 17.332 12.859 835 HA ALA 93 HA ALA 93 -4.981 17.481 10.621 836 HB1 ALA 93 HB1 ALA 93 -4.362 20.412 10.914 837 HB2 ALA 93 HB2 ALA 93 -5.964 19.688 11.054 838 HB3 ALA 93 HB3 ALA 93 -5.098 19.625 9.519 839 H GLN 94 HN GLN 94 -2.316 19.721 11.395 840 HA GLN 94 HA GLN 94 -0.363 18.002 10.193 841 HB2 GLN 94 HB2 GLN 94 -1.364 18.982 8.172 842 HB3 GLN 94 HB1 GLN 94 -1.077 20.595 8.803 843 HG2 GLN 94 HG2 GLN 94 0.563 20.018 7.124 844 HG3 GLN 94 HG1 GLN 94 1.329 20.221 8.696 845 HE21 GLN 94 HE21 GLN 94 2.167 18.754 6.278 846 HE22 GLN 94 HE22 GLN 94 2.463 17.131 6.800 847 H LYS 95 HN LYS 95 1.710 18.584 10.765 848 HA LYS 95 HA LYS 95 1.962 20.361 12.980 849 HB2 LYS 95 HB2 LYS 95 4.419 19.797 12.775 850 HB3 LYS 95 HB1 LYS 95 3.339 18.431 13.012 851 HG2 LYS 95 HG2 LYS 95 3.488 17.838 10.692 852 HG3 LYS 95 HG1 LYS 95 4.414 19.295 10.338 853 HD2 LYS 95 HD2 LYS 95 5.904 17.397 10.463 854 HD3 LYS 95 HD1 LYS 95 6.209 18.479 11.823 855 HE2 LYS 95 HE2 LYS 95 4.829 17.024 13.256 856 HE3 LYS 95 HE1 LYS 95 4.598 15.930 11.892 857 HZ1 LYS 95 HZ1 LYS 95 6.360 15.161 13.341 858 HZ2 LYS 95 HZ2 LYS 95 7.197 16.615 13.148 859 HZ3 LYS 95 HZ3 LYS 95 6.990 15.579 11.830 860 H ARG 96 HN ARG 96 1.562 22.420 12.470 861 HA ARG 96 HA ARG 96 1.925 24.537 11.792 862 HB2 ARG 96 HB2 ARG 96 4.538 23.479 10.717 863 HB3 ARG 96 HB1 ARG 96 4.091 25.178 10.771 864 HG2 ARG 96 HG2 ARG 96 3.761 24.707 13.318 865 HG3 ARG 96 HG1 ARG 96 4.829 23.339 12.992 866 HD2 ARG 96 HD2 ARG 96 6.177 25.203 13.673 867 HD3 ARG 96 HD1 ARG 96 6.439 24.925 11.952 868 HE ARG 96 HE ARG 96 4.708 27.055 13.039 869 HH11 ARG 96 HH11 ARG 96 6.966 25.880 10.621 870 HH12 ARG 96 HH12 ARG 96 6.946 27.357 9.714 871 HH21 ARG 96 HH21 ARG 96 4.681 28.989 11.831 872 HH22 ARG 96 HH22 ARG 96 5.658 29.121 10.404 873 H LYS 97 HN LYS 97 0.795 25.444 10.266 874 HA LYS 97 HA LYS 97 0.493 24.190 7.689 875 HB2 LYS 97 HB2 LYS 97 -0.676 26.725 8.846 876 HB3 LYS 97 HB1 LYS 97 -1.087 26.078 7.264 877 HG2 LYS 97 HG2 LYS 97 -1.475 24.567 9.835 878 HG3 LYS 97 HG1 LYS 97 -2.723 25.555 9.074 879 HD2 LYS 97 HD2 LYS 97 -2.621 24.163 7.074 880 HD3 LYS 97 HD1 LYS 97 -1.336 23.196 7.798 881 HE2 LYS 97 HE2 LYS 97 -2.796 22.356 9.474 882 HE3 LYS 97 HE1 LYS 97 -4.057 23.511 9.042 883 HZ1 LYS 97 HZ1 LYS 97 -4.327 22.400 6.931 884 HZ2 LYS 97 HZ2 LYS 97 -4.512 21.287 8.187 885 HZ3 LYS 97 HZ3 LYS 97 -3.079 21.318 7.293 886 H ASN 98 HN ASN 98 2.274 24.378 6.473 887 HA ASN 98 HA ASN 98 3.556 26.992 6.204 888 HB2 ASN 98 HB2 ASN 98 4.391 24.225 5.330 889 HB3 ASN 98 HB1 ASN 98 5.246 25.681 4.830 890 HD21 ASN 98 HD21 ASN 98 4.574 23.501 7.428 891 HD22 ASN 98 HD22 ASN 98 5.736 24.146 8.538 Start of MODEL 10 1 H1 LYS 1 HT1 LYS 1 14.704 19.504 -12.646 2 H2 LYS 1 HT2 LYS 1 15.166 21.122 -12.800 3 H3 LYS 1 HT3 LYS 1 13.703 20.595 -13.465 4 HA LYS 1 HA LYS 1 13.357 21.833 -11.430 5 HB2 LYS 1 HB2 LYS 1 11.916 20.198 -10.320 6 HB3 LYS 1 HB1 LYS 1 11.773 20.059 -12.064 7 HG2 LYS 1 HG2 LYS 1 13.320 18.129 -11.995 8 HG3 LYS 1 HG1 LYS 1 13.327 18.242 -10.235 9 HD2 LYS 1 HD2 LYS 1 10.887 17.900 -10.227 10 HD3 LYS 1 HD1 LYS 1 10.920 17.730 -11.984 11 HE2 LYS 1 HE2 LYS 1 12.456 15.805 -11.724 12 HE3 LYS 1 HE1 LYS 1 12.298 15.950 -9.975 13 HZ1 LYS 1 HZ1 LYS 1 10.108 15.358 -11.889 14 HZ2 LYS 1 HZ2 LYS 1 9.910 15.562 -10.224 15 HZ3 LYS 1 HZ3 LYS 1 10.818 14.266 -10.812 16 HA PRO 2 HA PRO 2 16.495 21.277 -8.351 17 HB2 PRO 2 HB2 PRO 2 14.871 22.642 -6.394 18 HB3 PRO 2 HB1 PRO 2 16.289 23.238 -7.255 19 HG2 PRO 2 HG2 PRO 2 13.748 24.171 -7.635 20 HG3 PRO 2 HG1 PRO 2 15.038 24.277 -8.840 21 HD2 PRO 2 HD2 PRO 2 12.745 22.379 -8.674 22 HD3 PRO 2 HD1 PRO 2 13.518 23.101 -10.100 23 H VAL 3 HN VAL 3 16.705 20.586 -6.036 24 HA VAL 3 HA VAL 3 14.774 18.429 -5.520 25 HB VAL 3 HB VAL 3 17.032 17.643 -6.042 26 HG11 VAL 3 HG11 VAL 3 18.893 18.038 -4.474 27 HG12 VAL 3 HG12 VAL 3 17.896 19.227 -3.634 28 HG13 VAL 3 HG13 VAL 3 18.364 19.496 -5.312 29 HG21 VAL 3 HG21 VAL 3 16.264 17.189 -3.165 30 HG22 VAL 3 HG22 VAL 3 17.371 16.185 -4.099 31 HG23 VAL 3 HG23 VAL 3 15.675 16.291 -4.563 32 H SER 4 HN SER 4 13.855 20.709 -4.690 33 HA SER 4 HA SER 4 14.639 21.529 -2.089 34 HB2 SER 4 HB2 SER 4 11.969 21.904 -3.466 35 HB3 SER 4 HB1 SER 4 12.599 22.849 -2.118 36 HG SER 4 HG SER 4 14.453 23.168 -3.749 37 H LEU 5 HN LEU 5 14.204 20.631 -0.188 38 HA LEU 5 HA LEU 5 13.493 19.170 1.382 39 HB2 LEU 5 HB2 LEU 5 10.977 19.631 -0.170 40 HB3 LEU 5 HB1 LEU 5 10.999 18.504 1.168 41 HG LEU 5 HG LEU 5 10.123 20.612 1.925 42 HD11 LEU 5 HD11 LEU 5 11.604 21.084 3.770 43 HD12 LEU 5 HD12 LEU 5 12.940 20.292 2.936 44 HD13 LEU 5 HD13 LEU 5 11.549 19.347 3.468 45 HD21 LEU 5 HD21 LEU 5 12.689 21.844 0.932 46 HD22 LEU 5 HD22 LEU 5 11.446 22.674 1.870 47 HD23 LEU 5 HD23 LEU 5 11.081 22.083 0.249 48 H SER 6 HN SER 6 14.913 17.546 0.671 49 HA SER 6 HA SER 6 14.064 15.595 -1.256 50 HB2 SER 6 HB2 SER 6 16.451 16.217 -0.944 51 HB3 SER 6 HB1 SER 6 16.403 15.509 0.669 52 HG SER 6 HG SER 6 16.636 13.611 -0.182 53 H TYR 7 HN TYR 7 12.054 15.643 0.433 54 HA TYR 7 HA TYR 7 12.378 13.489 2.379 55 HB2 TYR 7 HB2 TYR 7 11.079 15.498 3.017 56 HB3 TYR 7 HB1 TYR 7 9.950 15.168 1.711 57 HD1 TYR 7 HD1 TYR 7 8.091 13.804 2.083 58 HD2 TYR 7 HD2 TYR 7 11.325 13.699 4.847 59 HE1 TYR 7 HE1 TYR 7 6.757 12.385 3.582 60 HE2 TYR 7 HE2 TYR 7 9.996 12.283 6.355 61 HH TYR 7 HH TYR 7 7.703 11.711 6.818 62 H ARG 8 HN ARG 8 11.859 11.460 1.928 63 HA ARG 8 HA ARG 8 10.411 10.956 -0.577 64 HB2 ARG 8 HB2 ARG 8 11.465 8.738 -0.595 65 HB3 ARG 8 HB1 ARG 8 12.659 10.027 -0.586 66 HG2 ARG 8 HG2 ARG 8 13.149 9.658 1.720 67 HG3 ARG 8 HG1 ARG 8 11.802 8.527 1.876 68 HD2 ARG 8 HD2 ARG 8 14.148 8.103 0.038 69 HD3 ARG 8 HD1 ARG 8 14.061 7.460 1.675 70 HE ARG 8 HE ARG 8 12.057 6.213 0.925 71 HH11 ARG 8 HH11 ARG 8 14.356 7.343 -1.480 72 HH12 ARG 8 HH12 ARG 8 13.931 6.123 -2.636 73 HH21 ARG 8 HH21 ARG 8 11.531 4.592 -0.577 74 HH22 ARG 8 HH22 ARG 8 12.335 4.549 -2.119 75 H CYS 9 HN CYS 9 9.320 8.724 -0.516 76 HA CYS 9 HA CYS 9 7.266 8.843 1.426 77 HB2 CYS 9 HB2 CYS 9 7.964 6.892 -0.767 78 HB3 CYS 9 HB1 CYS 9 6.521 6.745 0.226 79 HA PRO 10 HA PRO 10 8.004 6.659 5.038 80 HB2 PRO 10 HB2 PRO 10 6.639 4.317 3.796 81 HB3 PRO 10 HB1 PRO 10 6.461 4.978 5.424 82 HG2 PRO 10 HG2 PRO 10 4.740 5.541 3.406 83 HG3 PRO 10 HG1 PRO 10 5.086 6.662 4.727 84 HD2 PRO 10 HD2 PRO 10 5.773 6.894 1.924 85 HD3 PRO 10 HD1 PRO 10 5.933 8.105 3.204 86 H CYS 11 HN CYS 11 8.248 4.162 2.504 87 HA CYS 11 HA CYS 11 10.388 2.957 4.063 88 HB2 CYS 11 HB2 CYS 11 8.496 1.619 2.964 89 HB3 CYS 11 HB1 CYS 11 9.392 1.845 1.470 90 H ARG 12 HN ARG 12 12.422 2.573 3.422 91 HA ARG 12 HA ARG 12 13.725 4.283 1.587 92 HB2 ARG 12 HB2 ARG 12 14.723 1.673 2.748 93 HB3 ARG 12 HB1 ARG 12 15.711 2.923 2.009 94 HG2 ARG 12 HG2 ARG 12 14.154 3.140 4.574 95 HG3 ARG 12 HG1 ARG 12 15.905 3.040 4.400 96 HD2 ARG 12 HD2 ARG 12 14.167 5.276 3.361 97 HD3 ARG 12 HD1 ARG 12 15.127 5.334 4.836 98 HE ARG 12 HE ARG 12 16.830 4.678 2.721 99 HH11 ARG 12 HH11 ARG 12 14.887 7.362 3.833 100 HH12 ARG 12 HH12 ARG 12 15.903 8.567 3.109 101 HH21 ARG 12 HH21 ARG 12 18.176 6.263 1.755 102 HH22 ARG 12 HH22 ARG 12 17.762 7.942 1.909 103 H PHE 13 HN PHE 13 15.430 2.686 0.079 104 HA PHE 13 HA PHE 13 13.616 2.121 -2.055 105 HB2 PHE 13 HB2 PHE 13 15.611 1.671 -3.399 106 HB3 PHE 13 HB1 PHE 13 15.770 3.189 -2.523 107 HD1 PHE 13 HD1 PHE 13 17.025 -0.181 -2.946 108 HD2 PHE 13 HD2 PHE 13 17.279 3.360 -0.610 109 HE1 PHE 13 HE1 PHE 13 19.144 -0.948 -2.019 110 HE2 PHE 13 HE2 PHE 13 19.401 2.599 0.319 111 HZ PHE 13 HZ PHE 13 20.323 0.407 -0.323 112 H PHE 14 HN PHE 14 13.232 0.156 -3.040 113 HA PHE 14 HA PHE 14 13.050 -1.877 -0.965 114 HB2 PHE 14 HB2 PHE 14 11.530 -2.344 -3.400 115 HB3 PHE 14 HB1 PHE 14 10.982 -2.256 -1.737 116 HD1 PHE 14 HD1 PHE 14 10.243 -0.164 -0.771 117 HD2 PHE 14 HD2 PHE 14 11.490 -0.388 -4.833 118 HE1 PHE 14 HE1 PHE 14 9.199 2.021 -1.210 119 HE2 PHE 14 HE2 PHE 14 10.453 1.795 -5.276 120 HZ PHE 14 HZ PHE 14 9.331 3.010 -3.479 121 H GLU 15 HN GLU 15 12.928 -4.185 -1.760 122 HA GLU 15 HA GLU 15 15.344 -4.698 -3.317 123 HB2 GLU 15 HB2 GLU 15 13.669 -6.515 -1.578 124 HB3 GLU 15 HB1 GLU 15 15.154 -6.988 -2.389 125 HG2 GLU 15 HG2 GLU 15 14.915 -4.868 -0.270 126 HG3 GLU 15 HG1 GLU 15 15.488 -6.515 -0.016 127 H SER 16 HN SER 16 15.127 -5.182 -5.395 128 HA SER 16 HA SER 16 12.505 -6.015 -6.380 129 HB2 SER 16 HB2 SER 16 13.883 -4.067 -7.374 130 HB3 SER 16 HB1 SER 16 14.890 -5.324 -8.089 131 HG SER 16 HG SER 16 12.325 -4.511 -8.738 132 H HIS 17 HN HIS 17 14.102 -7.873 -4.921 133 HA HIS 17 HA HIS 17 14.362 -9.918 -7.011 134 HB2 HIS 17 HB2 HIS 17 16.611 -9.125 -6.153 135 HB3 HIS 17 HB1 HIS 17 16.163 -9.791 -4.589 136 HD1 HIS 17 HD1 HIS 17 17.153 -12.026 -4.231 137 HD2 HIS 17 HD2 HIS 17 16.259 -11.359 -8.236 138 HE1 HIS 17 HE1 HIS 17 17.849 -14.120 -5.437 139 HE2 HIS 17 HE2 HIS 17 17.268 -13.708 -7.854 140 H ILE 18 HN ILE 18 12.846 -8.863 -4.296 141 HA ILE 18 HA ILE 18 12.435 -11.235 -2.828 142 HB ILE 18 HB ILE 18 10.693 -8.791 -3.112 143 HG12 ILE 18 HG12 ILE 18 12.647 -9.588 -0.963 144 HG13 ILE 18 HG11 ILE 18 12.944 -8.381 -2.206 145 HG21 ILE 18 HG21 ILE 18 10.546 -10.999 -1.066 146 HG22 ILE 18 HG22 ILE 18 9.365 -10.677 -2.337 147 HG23 ILE 18 HG23 ILE 18 9.604 -9.507 -1.038 148 HD11 ILE 18 HD11 ILE 18 11.031 -7.082 -1.299 149 HD12 ILE 18 HD12 ILE 18 12.383 -7.263 -0.182 150 HD13 ILE 18 HD13 ILE 18 10.932 -8.244 0.024 151 H ALA 19 HN ALA 19 10.870 -12.785 -2.964 152 HA ALA 19 HA ALA 19 9.283 -12.831 -5.445 153 HB1 ALA 19 HB1 ALA 19 10.426 -15.211 -3.994 154 HB2 ALA 19 HB2 ALA 19 11.176 -14.444 -5.394 155 HB3 ALA 19 HB3 ALA 19 9.596 -15.209 -5.549 156 H ARG 20 HN ARG 20 7.285 -14.017 -5.343 157 HA ARG 20 HA ARG 20 5.691 -13.414 -3.101 158 HB2 ARG 20 HB2 ARG 20 5.050 -13.807 -5.586 159 HB3 ARG 20 HB1 ARG 20 5.016 -15.510 -5.142 160 HG2 ARG 20 HG2 ARG 20 3.267 -15.138 -3.565 161 HG3 ARG 20 HG1 ARG 20 3.388 -13.388 -3.775 162 HD2 ARG 20 HD2 ARG 20 2.781 -13.698 -6.166 163 HD3 ARG 20 HD1 ARG 20 2.519 -15.409 -5.835 164 HE ARG 20 HE ARG 20 0.904 -14.293 -4.035 165 HH11 ARG 20 HH11 ARG 20 1.314 -13.636 -7.457 166 HH12 ARG 20 HH12 ARG 20 -0.315 -13.070 -7.664 167 HH21 ARG 20 HH21 ARG 20 -1.230 -13.571 -4.320 168 HH22 ARG 20 HH22 ARG 20 -1.759 -13.037 -5.885 169 H ALA 21 HN ALA 21 7.480 -16.222 -4.087 170 HA ALA 21 HA ALA 21 6.294 -17.918 -2.073 171 HB1 ALA 21 HB1 ALA 21 6.916 -18.861 -4.242 172 HB2 ALA 21 HB2 ALA 21 7.787 -19.646 -2.924 173 HB3 ALA 21 HB3 ALA 21 8.601 -18.447 -3.931 174 H ASN 22 HN ASN 22 8.744 -15.657 -2.224 175 HA ASN 22 HA ASN 22 10.268 -16.868 -0.072 176 HB2 ASN 22 HB2 ASN 22 10.772 -14.700 -2.056 177 HB3 ASN 22 HB1 ASN 22 11.574 -14.578 -0.500 178 HD21 ASN 22 HD21 ASN 22 13.598 -14.862 -1.304 179 HD22 ASN 22 HD22 ASN 22 14.163 -16.360 -1.942 180 H VAL 23 HN VAL 23 7.588 -15.042 -0.336 181 HA VAL 23 HA VAL 23 8.306 -13.394 1.978 182 HB VAL 23 HB VAL 23 7.829 -12.015 0.058 183 HG11 VAL 23 HG11 VAL 23 5.174 -13.417 0.020 184 HG12 VAL 23 HG12 VAL 23 6.402 -13.418 -1.257 185 HG13 VAL 23 HG13 VAL 23 5.528 -11.929 -0.863 186 HG21 VAL 23 HG21 VAL 23 5.626 -11.936 2.083 187 HG22 VAL 23 HG22 VAL 23 6.080 -10.620 1.000 188 HG23 VAL 23 HG23 VAL 23 7.216 -11.190 2.233 189 H LYS 24 HN LYS 24 7.033 -13.203 3.627 190 HA LYS 24 HA LYS 24 4.803 -15.052 3.965 191 HB2 LYS 24 HB2 LYS 24 6.240 -13.437 6.082 192 HB3 LYS 24 HB1 LYS 24 5.128 -14.771 6.336 193 HG2 LYS 24 HG2 LYS 24 6.861 -16.115 4.946 194 HG3 LYS 24 HG1 LYS 24 7.944 -14.808 5.417 195 HD2 LYS 24 HD2 LYS 24 6.303 -16.316 7.433 196 HD3 LYS 24 HD1 LYS 24 7.888 -16.874 6.912 197 HE2 LYS 24 HE2 LYS 24 8.885 -14.789 7.639 198 HE3 LYS 24 HE1 LYS 24 7.301 -14.188 8.135 199 HZ1 LYS 24 HZ1 LYS 24 8.808 -16.462 9.307 200 HZ2 LYS 24 HZ2 LYS 24 7.202 -16.107 9.693 201 HZ3 LYS 24 HZ3 LYS 24 8.421 -14.995 10.055 202 H HIS 25 HN HIS 25 3.658 -13.486 6.137 203 HA HIS 25 HA HIS 25 1.635 -12.085 5.147 204 HB2 HIS 25 HB2 HIS 25 2.789 -10.301 7.104 205 HB3 HIS 25 HB1 HIS 25 1.307 -11.230 7.200 206 HD1 HIS 25 HD1 HIS 25 1.508 -11.820 9.601 207 HD2 HIS 25 HD2 HIS 25 4.903 -12.903 7.455 208 HE1 HIS 25 HE1 HIS 25 2.972 -13.062 11.219 209 HE2 HIS 25 HE2 HIS 25 4.953 -13.814 9.875 210 H LEU 26 HN LEU 26 1.360 -10.521 3.714 211 HA LEU 26 HA LEU 26 3.519 -8.566 3.351 212 HB2 LEU 26 HB2 LEU 26 2.506 -10.320 1.500 213 HB3 LEU 26 HB1 LEU 26 1.598 -8.866 1.159 214 HG LEU 26 HG LEU 26 4.598 -9.145 1.142 215 HD11 LEU 26 HD11 LEU 26 3.470 -10.124 -0.809 216 HD12 LEU 26 HD12 LEU 26 4.440 -8.709 -1.231 217 HD13 LEU 26 HD13 LEU 26 2.680 -8.575 -1.116 218 HD21 LEU 26 HD21 LEU 26 4.481 -6.796 0.226 219 HD22 LEU 26 HD22 LEU 26 4.170 -6.992 1.951 220 HD23 LEU 26 HD23 LEU 26 2.826 -6.746 0.833 221 H LYS 27 HN LYS 27 3.047 -6.456 3.349 222 HA LYS 27 HA LYS 27 0.276 -5.603 3.847 223 HB2 LYS 27 HB2 LYS 27 1.179 -5.884 6.039 224 HB3 LYS 27 HB1 LYS 27 2.683 -5.110 5.579 225 HG2 LYS 27 HG2 LYS 27 1.423 -3.606 6.935 226 HG3 LYS 27 HG1 LYS 27 1.478 -3.005 5.277 227 HD2 LYS 27 HD2 LYS 27 -0.747 -2.714 6.234 228 HD3 LYS 27 HD1 LYS 27 -0.782 -3.847 4.889 229 HE2 LYS 27 HE2 LYS 27 -0.497 -4.871 7.681 230 HE3 LYS 27 HE1 LYS 27 -2.079 -4.368 7.098 231 HZ1 LYS 27 HZ1 LYS 27 -0.349 -6.481 5.933 232 HZ2 LYS 27 HZ2 LYS 27 -1.785 -5.935 5.230 233 HZ3 LYS 27 HZ3 LYS 27 -1.819 -6.701 6.735 234 H ILE 28 HN ILE 28 -0.167 -3.492 3.187 235 HA ILE 28 HA ILE 28 2.006 -2.236 1.655 236 HB ILE 28 HB ILE 28 -0.949 -2.067 1.078 237 HG12 ILE 28 HG12 ILE 28 -0.169 -4.333 0.751 238 HG13 ILE 28 HG11 ILE 28 -0.417 -3.585 -0.812 239 HG21 ILE 28 HG21 ILE 28 0.306 -0.138 0.280 240 HG22 ILE 28 HG22 ILE 28 -0.231 -1.135 -1.071 241 HG23 ILE 28 HG23 ILE 28 1.449 -1.205 -0.536 242 HD11 ILE 28 HD11 ILE 28 1.595 -4.938 -0.771 243 HD12 ILE 28 HD12 ILE 28 2.227 -3.948 0.544 244 HD13 ILE 28 HD13 ILE 28 1.965 -3.233 -1.046 245 H LEU 29 HN LEU 29 2.362 -0.096 1.825 246 HA LEU 29 HA LEU 29 1.199 1.229 4.150 247 HB2 LEU 29 HB2 LEU 29 3.725 1.148 3.415 248 HB3 LEU 29 HB1 LEU 29 3.263 2.481 2.363 249 HG LEU 29 HG LEU 29 4.281 3.326 4.387 250 HD11 LEU 29 HD11 LEU 29 1.302 3.829 4.306 251 HD12 LEU 29 HD12 LEU 29 2.570 4.735 3.475 252 HD13 LEU 29 HD13 LEU 29 2.464 4.782 5.233 253 HD21 LEU 29 HD21 LEU 29 3.271 2.973 6.588 254 HD22 LEU 29 HD22 LEU 29 3.826 1.462 5.868 255 HD23 LEU 29 HD23 LEU 29 2.109 1.857 5.874 256 H ASN 30 HN ASN 30 -0.446 2.572 3.978 257 HA ASN 30 HA ASN 30 -1.306 3.674 1.471 258 HB2 ASN 30 HB2 ASN 30 -2.164 4.054 4.328 259 HB3 ASN 30 HB1 ASN 30 -2.845 5.004 3.022 260 HD21 ASN 30 HD21 ASN 30 -4.196 4.005 1.515 261 HD22 ASN 30 HD22 ASN 30 -4.881 2.442 1.797 262 H THR 31 HN THR 31 0.317 4.981 0.652 263 HA THR 31 HA THR 31 1.638 6.891 2.321 264 HB THR 31 HB THR 31 2.540 7.424 -0.111 265 HG1 THR 31 HG1 THR 31 1.935 4.684 -0.400 266 HG21 THR 31 HG21 THR 31 4.298 5.799 0.281 267 HG22 THR 31 HG22 THR 31 3.271 4.946 1.434 268 HG23 THR 31 HG23 THR 31 3.834 6.581 1.791 269 HA PRO 32 HA PRO 32 0.120 11.037 1.232 270 HB2 PRO 32 HB2 PRO 32 2.502 10.906 -0.540 271 HB3 PRO 32 HB1 PRO 32 1.936 12.237 0.469 272 HG2 PRO 32 HG2 PRO 32 3.911 10.631 1.292 273 HG3 PRO 32 HG1 PRO 32 2.708 11.270 2.419 274 HD2 PRO 32 HD2 PRO 32 3.083 8.538 1.449 275 HD3 PRO 32 HD1 PRO 32 2.218 9.112 2.882 276 H ASN 33 HN ASN 33 -0.191 8.531 -0.851 277 HA ASN 33 HA ASN 33 -0.920 8.168 -2.960 278 HB2 ASN 33 HB2 ASN 33 -0.678 11.153 -3.416 279 HB3 ASN 33 HB1 ASN 33 -1.256 9.991 -4.605 280 HD21 ASN 33 HD21 ASN 33 -1.942 11.677 -1.680 281 HD22 ASN 33 HD22 ASN 33 -3.615 11.270 -1.578 282 H CYS 34 HN CYS 34 1.235 7.401 -2.267 283 HA CYS 34 HA CYS 34 3.310 8.125 -4.210 284 HB2 CYS 34 HB2 CYS 34 3.633 7.872 -1.572 285 HB3 CYS 34 HB1 CYS 34 3.774 6.202 -2.029 286 H ALA 35 HN ALA 35 4.560 6.127 -4.907 287 HA ALA 35 HA ALA 35 2.958 4.015 -5.868 288 HB1 ALA 35 HB1 ALA 35 5.909 4.032 -5.205 289 HB2 ALA 35 HB2 ALA 35 5.187 4.401 -6.773 290 HB3 ALA 35 HB3 ALA 35 5.081 2.767 -6.114 291 H LEU 36 HN LEU 36 2.069 2.357 -4.788 292 HA LEU 36 HA LEU 36 1.812 2.340 -2.054 293 HB2 LEU 36 HB2 LEU 36 1.421 0.198 -4.131 294 HB3 LEU 36 HB1 LEU 36 1.084 -0.089 -2.446 295 HG LEU 36 HG LEU 36 -0.985 0.403 -3.508 296 HD11 LEU 36 HD11 LEU 36 -0.094 2.889 -2.058 297 HD12 LEU 36 HD12 LEU 36 -0.657 1.401 -1.294 298 HD13 LEU 36 HD13 LEU 36 -1.754 2.347 -2.299 299 HD21 LEU 36 HD21 LEU 36 -0.121 1.491 -5.512 300 HD22 LEU 36 HD22 LEU 36 0.288 2.923 -4.566 301 HD23 LEU 36 HD23 LEU 36 -1.399 2.448 -4.764 302 H GLN 37 HN GLN 37 3.141 1.808 -0.466 303 HA GLN 37 HA GLN 37 5.698 0.617 -1.027 304 HB2 GLN 37 HB2 GLN 37 4.503 1.153 1.688 305 HB3 GLN 37 HB1 GLN 37 6.204 1.013 1.279 306 HG2 GLN 37 HG2 GLN 37 4.441 3.181 0.203 307 HG3 GLN 37 HG1 GLN 37 5.334 3.331 1.713 308 HE21 GLN 37 HE21 GLN 37 5.507 4.732 -0.894 309 HE22 GLN 37 HE22 GLN 37 7.162 4.614 -1.349 310 H ILE 38 HN ILE 38 5.969 -1.500 -1.182 311 HA ILE 38 HA ILE 38 3.957 -3.277 -0.064 312 HB ILE 38 HB ILE 38 6.323 -4.265 -1.603 313 HG12 ILE 38 HG12 ILE 38 5.497 -2.283 -2.867 314 HG13 ILE 38 HG11 ILE 38 5.283 -3.794 -3.739 315 HG21 ILE 38 HG21 ILE 38 3.641 -5.178 -0.875 316 HG22 ILE 38 HG22 ILE 38 5.109 -6.103 -1.254 317 HG23 ILE 38 HG23 ILE 38 4.084 -5.496 -2.554 318 HD11 ILE 38 HD11 ILE 38 2.914 -3.808 -3.054 319 HD12 ILE 38 HD12 ILE 38 3.353 -2.402 -4.028 320 HD13 ILE 38 HD13 ILE 38 3.161 -2.241 -2.283 321 H VAL 39 HN VAL 39 4.378 -3.497 2.132 322 HA VAL 39 HA VAL 39 7.155 -4.039 2.885 323 HB VAL 39 HB VAL 39 5.623 -2.283 4.106 324 HG11 VAL 39 HG11 VAL 39 4.601 -3.168 6.151 325 HG12 VAL 39 HG12 VAL 39 4.848 -4.802 5.535 326 HG13 VAL 39 HG13 VAL 39 3.782 -3.688 4.677 327 HG21 VAL 39 HG21 VAL 39 7.915 -2.738 4.704 328 HG22 VAL 39 HG22 VAL 39 7.435 -4.210 5.549 329 HG23 VAL 39 HG23 VAL 39 6.936 -2.636 6.166 330 H ALA 40 HN ALA 40 7.797 -5.991 3.301 331 HA ALA 40 HA ALA 40 5.772 -8.093 3.645 332 HB1 ALA 40 HB1 ALA 40 6.541 -7.908 1.301 333 HB2 ALA 40 HB2 ALA 40 6.929 -9.459 2.034 334 HB3 ALA 40 HB3 ALA 40 8.185 -8.236 1.846 335 H ARG 41 HN ARG 41 6.402 -9.866 4.849 336 HA ARG 41 HA ARG 41 8.990 -9.610 6.225 337 HB2 ARG 41 HB2 ARG 41 6.391 -10.921 6.929 338 HB3 ARG 41 HB1 ARG 41 7.886 -11.505 7.659 339 HG2 ARG 41 HG2 ARG 41 7.289 -8.589 7.707 340 HG3 ARG 41 HG1 ARG 41 6.475 -9.654 8.832 341 HD2 ARG 41 HD2 ARG 41 8.648 -10.478 9.616 342 HD3 ARG 41 HD1 ARG 41 9.445 -9.363 8.510 343 HE ARG 41 HE ARG 41 7.651 -7.964 10.191 344 HH11 ARG 41 HH11 ARG 41 10.759 -9.588 10.293 345 HH12 ARG 41 HH12 ARG 41 11.384 -8.569 11.556 346 HH21 ARG 41 HH21 ARG 41 8.461 -6.659 11.880 347 HH22 ARG 41 HH22 ARG 41 10.075 -6.917 12.462 348 H LEU 42 HN LEU 42 10.594 -10.808 5.463 349 HA LEU 42 HA LEU 42 10.216 -12.580 3.317 350 HB2 LEU 42 HB2 LEU 42 12.564 -12.024 5.098 351 HB3 LEU 42 HB1 LEU 42 12.646 -13.221 3.819 352 HG LEU 42 HG LEU 42 11.877 -10.355 3.306 353 HD11 LEU 42 HD11 LEU 42 14.178 -9.994 2.578 354 HD12 LEU 42 HD12 LEU 42 14.609 -11.618 3.115 355 HD13 LEU 42 HD13 LEU 42 14.108 -10.403 4.291 356 HD21 LEU 42 HD21 LEU 42 12.547 -10.924 1.004 357 HD22 LEU 42 HD22 LEU 42 11.209 -11.918 1.576 358 HD23 LEU 42 HD23 LEU 42 12.839 -12.587 1.514 359 H LYS 43 HN LYS 43 10.584 -14.799 3.115 360 HA LYS 43 HA LYS 43 9.022 -16.294 4.850 361 HB2 LYS 43 HB2 LYS 43 9.375 -16.863 2.524 362 HB3 LYS 43 HB1 LYS 43 11.067 -17.180 2.847 363 HG2 LYS 43 HG2 LYS 43 10.352 -19.008 4.383 364 HG3 LYS 43 HG1 LYS 43 8.703 -18.747 3.809 365 HD2 LYS 43 HD2 LYS 43 9.407 -19.233 1.528 366 HD3 LYS 43 HD1 LYS 43 11.068 -19.446 2.076 367 HE2 LYS 43 HE2 LYS 43 9.957 -21.597 1.784 368 HE3 LYS 43 HE1 LYS 43 10.390 -21.303 3.464 369 HZ1 LYS 43 HZ1 LYS 43 8.176 -22.231 3.293 370 HZ2 LYS 43 HZ2 LYS 43 7.687 -20.959 2.295 371 HZ3 LYS 43 HZ3 LYS 43 8.099 -20.657 3.904 372 H ASN 44 HN ASN 44 12.475 -16.857 4.281 373 HA ASN 44 HA ASN 44 12.701 -18.205 6.832 374 HB2 ASN 44 HB2 ASN 44 14.581 -17.787 4.536 375 HB3 ASN 44 HB1 ASN 44 15.119 -18.479 6.056 376 HD21 ASN 44 HD21 ASN 44 15.661 -20.361 5.021 377 HD22 ASN 44 HD22 ASN 44 14.476 -21.521 4.524 378 H ASN 45 HN ASN 45 14.240 -15.542 5.159 379 HA ASN 45 HA ASN 45 15.910 -14.652 7.197 380 HB2 ASN 45 HB2 ASN 45 15.804 -14.067 4.679 381 HB3 ASN 45 HB1 ASN 45 14.732 -12.792 5.213 382 HD21 ASN 45 HD21 ASN 45 16.362 -11.390 4.295 383 HD22 ASN 45 HD22 ASN 45 17.741 -10.962 5.247 384 H ASN 46 HN ASN 46 12.547 -14.208 6.738 385 HA ASN 46 HA ASN 46 10.891 -13.196 7.872 386 HB2 ASN 46 HB2 ASN 46 10.907 -13.445 10.264 387 HB3 ASN 46 HB1 ASN 46 11.543 -14.889 9.497 388 HD21 ASN 46 HD21 ASN 46 13.679 -15.450 9.821 389 HD22 ASN 46 HD22 ASN 46 14.665 -14.700 11.031 390 H ARG 47 HN ARG 47 13.200 -11.381 7.097 391 HA ARG 47 HA ARG 47 12.895 -9.252 9.009 392 HB2 ARG 47 HB2 ARG 47 14.334 -9.374 6.362 393 HB3 ARG 47 HB1 ARG 47 14.324 -7.977 7.421 394 HG2 ARG 47 HG2 ARG 47 15.530 -9.129 9.098 395 HG3 ARG 47 HG1 ARG 47 15.337 -10.674 8.257 396 HD2 ARG 47 HD2 ARG 47 16.767 -10.053 6.538 397 HD3 ARG 47 HD1 ARG 47 16.669 -8.348 6.955 398 HE ARG 47 HE ARG 47 17.823 -9.874 9.064 399 HH11 ARG 47 HH11 ARG 47 18.516 -8.465 5.934 400 HH12 ARG 47 HH12 ARG 47 20.216 -8.308 6.233 401 HH21 ARG 47 HH21 ARG 47 20.071 -9.688 9.455 402 HH22 ARG 47 HH22 ARG 47 21.103 -9.010 8.237 403 H GLN 48 HN GLN 48 11.667 -7.532 8.826 404 HA GLN 48 HA GLN 48 9.607 -7.381 6.884 405 HB2 GLN 48 HB2 GLN 48 9.511 -6.467 9.210 406 HB3 GLN 48 HB1 GLN 48 10.596 -5.187 8.704 407 HG2 GLN 48 HG2 GLN 48 8.949 -4.482 7.042 408 HG3 GLN 48 HG1 GLN 48 7.854 -5.738 7.622 409 HE21 GLN 48 HE21 GLN 48 6.291 -4.369 8.302 410 HE22 GLN 48 HE22 GLN 48 6.468 -3.294 9.646 411 H VAL 49 HN VAL 49 9.908 -6.700 4.897 412 HA VAL 49 HA VAL 49 12.066 -4.806 4.251 413 HB VAL 49 HB VAL 49 12.845 -7.151 3.884 414 HG11 VAL 49 HG11 VAL 49 10.740 -8.196 3.330 415 HG12 VAL 49 HG12 VAL 49 11.902 -8.449 2.028 416 HG13 VAL 49 HG13 VAL 49 10.628 -7.242 1.850 417 HG21 VAL 49 HG21 VAL 49 12.519 -5.532 1.360 418 HG22 VAL 49 HG22 VAL 49 13.698 -6.819 1.616 419 HG23 VAL 49 HG23 VAL 49 13.794 -5.335 2.563 420 H CYS 50 HN CYS 50 11.730 -3.796 2.083 421 HA CYS 50 HA CYS 50 8.896 -3.799 1.381 422 HB2 CYS 50 HB2 CYS 50 11.027 -1.692 1.015 423 HB3 CYS 50 HB1 CYS 50 9.441 -1.599 0.274 424 H ILE 51 HN ILE 51 8.254 -4.440 -0.530 425 HA ILE 51 HA ILE 51 10.211 -5.587 -2.355 426 HB ILE 51 HB ILE 51 7.288 -5.619 -2.959 427 HG12 ILE 51 HG12 ILE 51 8.564 -7.328 -0.806 428 HG13 ILE 51 HG11 ILE 51 7.323 -6.104 -0.554 429 HG21 ILE 51 HG21 ILE 51 7.767 -7.504 -4.141 430 HG22 ILE 51 HG22 ILE 51 9.035 -8.011 -3.031 431 HG23 ILE 51 HG23 ILE 51 9.355 -6.734 -4.207 432 HD11 ILE 51 HD11 ILE 51 7.073 -8.772 -1.891 433 HD12 ILE 51 HD12 ILE 51 5.880 -7.501 -2.132 434 HD13 ILE 51 HD13 ILE 51 6.174 -8.135 -0.514 435 H ASP 52 HN ASP 52 10.452 -4.963 -4.479 436 HA ASP 52 HA ASP 52 10.004 -2.235 -5.097 437 HB2 ASP 52 HB2 ASP 52 11.904 -3.450 -6.010 438 HB3 ASP 52 HB1 ASP 52 10.831 -4.554 -6.849 439 HA PRO 53 HA PRO 53 5.721 -2.680 -6.299 440 HB2 PRO 53 HB2 PRO 53 5.470 -0.186 -7.364 441 HB3 PRO 53 HB1 PRO 53 5.385 -0.531 -5.635 442 HG2 PRO 53 HG2 PRO 53 7.690 0.474 -7.255 443 HG3 PRO 53 HG1 PRO 53 7.125 1.007 -5.658 444 HD2 PRO 53 HD2 PRO 53 9.224 -0.623 -5.917 445 HD3 PRO 53 HD1 PRO 53 8.077 -0.809 -4.580 446 H LYS 54 HN LYS 54 8.392 -2.273 -8.297 447 HA LYS 54 HA LYS 54 6.876 -2.118 -10.772 448 HB2 LYS 54 HB2 LYS 54 9.801 -1.934 -10.161 449 HB3 LYS 54 HB1 LYS 54 9.160 -1.953 -11.801 450 HG2 LYS 54 HG2 LYS 54 8.270 0.138 -11.628 451 HG3 LYS 54 HG1 LYS 54 8.016 -0.014 -9.898 452 HD2 LYS 54 HD2 LYS 54 9.768 1.606 -10.421 453 HD3 LYS 54 HD1 LYS 54 10.343 0.226 -9.481 454 HE2 LYS 54 HE2 LYS 54 11.923 0.709 -11.231 455 HE3 LYS 54 HE1 LYS 54 11.109 -0.829 -11.497 456 HZ1 LYS 54 HZ1 LYS 54 9.718 0.162 -13.149 457 HZ2 LYS 54 HZ2 LYS 54 11.326 0.517 -13.530 458 HZ3 LYS 54 HZ3 LYS 54 10.345 1.701 -12.832 459 H LEU 55 HN LEU 55 8.178 -4.465 -8.759 460 HA LEU 55 HA LEU 55 9.115 -6.433 -10.479 461 HB2 LEU 55 HB2 LEU 55 7.828 -6.364 -7.799 462 HB3 LEU 55 HB1 LEU 55 8.069 -7.925 -8.554 463 HG LEU 55 HG LEU 55 10.301 -5.943 -8.142 464 HD11 LEU 55 HD11 LEU 55 9.401 -8.175 -6.330 465 HD12 LEU 55 HD12 LEU 55 9.380 -6.447 -5.981 466 HD13 LEU 55 HD13 LEU 55 10.918 -7.287 -6.173 467 HD21 LEU 55 HD21 LEU 55 10.264 -8.911 -8.660 468 HD22 LEU 55 HD22 LEU 55 11.708 -7.924 -8.401 469 HD23 LEU 55 HD23 LEU 55 10.694 -7.654 -9.820 470 H LYS 56 HN LYS 56 8.164 -7.967 -11.714 471 HA LYS 56 HA LYS 56 5.686 -7.273 -12.855 472 HB2 LYS 56 HB2 LYS 56 7.330 -9.782 -13.183 473 HB3 LYS 56 HB1 LYS 56 5.957 -9.347 -14.189 474 HG2 LYS 56 HG2 LYS 56 8.491 -7.747 -13.915 475 HG3 LYS 56 HG1 LYS 56 8.095 -8.820 -15.256 476 HD2 LYS 56 HD2 LYS 56 6.446 -6.424 -14.453 477 HD3 LYS 56 HD1 LYS 56 7.673 -6.403 -15.715 478 HE2 LYS 56 HE2 LYS 56 5.231 -8.165 -15.691 479 HE3 LYS 56 HE1 LYS 56 5.403 -6.677 -16.617 480 HZ1 LYS 56 HZ1 LYS 56 7.010 -9.150 -16.937 481 HZ2 LYS 56 HZ2 LYS 56 7.296 -7.711 -17.769 482 HZ3 LYS 56 HZ3 LYS 56 5.853 -8.553 -18.015 483 H TRP 57 HN TRP 57 6.517 -9.557 -10.337 484 HA TRP 57 HA TRP 57 3.843 -10.697 -10.407 485 HB2 TRP 57 HB2 TRP 57 4.542 -12.157 -8.679 486 HB3 TRP 57 HB1 TRP 57 5.916 -12.017 -9.752 487 HD1 TRP 57 HD1 TRP 57 8.112 -10.955 -8.764 488 HE1 TRP 57 HE1 TRP 57 8.882 -10.433 -6.352 489 HE3 TRP 57 HE3 TRP 57 3.606 -11.294 -6.405 490 HZ2 TRP 57 HZ2 TRP 57 7.708 -10.194 -3.798 491 HZ3 TRP 57 HZ3 TRP 57 3.504 -10.896 -3.985 492 HH2 TRP 57 HH2 TRP 57 5.514 -10.364 -2.705 493 H ILE 58 HN ILE 58 5.560 -8.151 -8.908 494 HA ILE 58 HA ILE 58 3.776 -7.740 -6.710 495 HB ILE 58 HB ILE 58 5.944 -6.107 -7.984 496 HG12 ILE 58 HG12 ILE 58 6.567 -7.945 -6.474 497 HG13 ILE 58 HG11 ILE 58 7.018 -6.377 -5.814 498 HG21 ILE 58 HG21 ILE 58 4.071 -5.228 -5.811 499 HG22 ILE 58 HG22 ILE 58 4.271 -4.505 -7.411 500 HG23 ILE 58 HG23 ILE 58 5.583 -4.424 -6.224 501 HD11 ILE 58 HD11 ILE 58 6.041 -7.987 -4.186 502 HD12 ILE 58 HD12 ILE 58 4.517 -7.837 -5.046 503 HD13 ILE 58 HD13 ILE 58 5.230 -6.426 -4.269 504 H GLN 59 HN GLN 59 4.118 -6.445 -9.969 505 HA GLN 59 HA GLN 59 2.146 -4.491 -9.955 506 HB2 GLN 59 HB2 GLN 59 2.940 -6.476 -12.048 507 HB3 GLN 59 HB1 GLN 59 1.869 -5.126 -12.383 508 HG2 GLN 59 HG2 GLN 59 4.630 -4.762 -11.269 509 HG3 GLN 59 HG1 GLN 59 4.326 -4.886 -13.001 510 HE21 GLN 59 HE21 GLN 59 3.943 -2.922 -10.159 511 HE22 GLN 59 HE22 GLN 59 3.446 -1.486 -10.981 512 H GLU 60 HN GLU 60 1.897 -7.947 -10.044 513 HA GLU 60 HA GLU 60 -0.934 -8.049 -10.488 514 HB2 GLU 60 HB2 GLU 60 0.860 -10.169 -9.277 515 HB3 GLU 60 HB1 GLU 60 -0.706 -10.412 -10.025 516 HG2 GLU 60 HG2 GLU 60 0.355 -9.499 -12.152 517 HG3 GLU 60 HG1 GLU 60 1.894 -9.704 -11.329 518 H TYR 61 HN TYR 61 1.177 -8.058 -7.662 519 HA TYR 61 HA TYR 61 -0.959 -8.532 -5.789 520 HB2 TYR 61 HB2 TYR 61 1.408 -9.060 -5.218 521 HB3 TYR 61 HB1 TYR 61 1.802 -7.350 -5.328 522 HD1 TYR 61 HD1 TYR 61 0.702 -9.952 -3.179 523 HD2 TYR 61 HD2 TYR 61 0.579 -5.755 -3.781 524 HE1 TYR 61 HE1 TYR 61 0.102 -9.629 -0.831 525 HE2 TYR 61 HE2 TYR 61 -0.042 -5.431 -1.426 526 HH TYR 61 HH TYR 61 0.203 -7.889 0.894 527 H LEU 62 HN LEU 62 0.648 -5.828 -7.239 528 HA LEU 62 HA LEU 62 -0.395 -3.705 -5.831 529 HB2 LEU 62 HB2 LEU 62 0.850 -4.218 -8.348 530 HB3 LEU 62 HB1 LEU 62 -0.432 -3.020 -8.562 531 HG LEU 62 HG LEU 62 1.749 -1.971 -8.201 532 HD11 LEU 62 HD11 LEU 62 -0.123 -1.590 -5.878 533 HD12 LEU 62 HD12 LEU 62 -0.229 -0.786 -7.444 534 HD13 LEU 62 HD13 LEU 62 1.141 -0.467 -6.380 535 HD21 LEU 62 HD21 LEU 62 1.728 -3.131 -5.437 536 HD22 LEU 62 HD22 LEU 62 3.020 -2.230 -6.240 537 HD23 LEU 62 HD23 LEU 62 2.606 -3.862 -6.779 538 H GLU 63 HN GLU 63 -1.756 -5.612 -8.459 539 HA GLU 63 HA GLU 63 -4.170 -4.375 -8.863 540 HB2 GLU 63 HB2 GLU 63 -3.790 -7.336 -8.650 541 HB3 GLU 63 HB1 GLU 63 -4.989 -6.490 -9.598 542 HG2 GLU 63 HG2 GLU 63 -3.102 -5.542 -10.940 543 HG3 GLU 63 HG1 GLU 63 -2.051 -6.626 -10.067 544 H LYS 64 HN LYS 64 -3.145 -6.534 -6.307 545 HA LYS 64 HA LYS 64 -5.694 -6.875 -5.075 546 HB2 LYS 64 HB2 LYS 64 -3.033 -7.169 -3.704 547 HB3 LYS 64 HB1 LYS 64 -4.529 -8.025 -3.356 548 HG2 LYS 64 HG2 LYS 64 -2.888 -8.362 -5.850 549 HG3 LYS 64 HG1 LYS 64 -2.824 -9.435 -4.454 550 HD2 LYS 64 HD2 LYS 64 -5.383 -8.874 -5.885 551 HD3 LYS 64 HD1 LYS 64 -4.271 -10.092 -6.482 552 HE2 LYS 64 HE2 LYS 64 -6.005 -11.096 -5.088 553 HE3 LYS 64 HE1 LYS 64 -4.413 -11.289 -4.368 554 HZ1 LYS 64 HZ1 LYS 64 -6.324 -9.169 -3.576 555 HZ2 LYS 64 HZ2 LYS 64 -4.890 -9.600 -2.792 556 HZ3 LYS 64 HZ3 LYS 64 -6.202 -10.658 -2.795 557 H ALA 65 HN ALA 65 -2.818 -4.948 -4.431 558 HA ALA 65 HA ALA 65 -3.701 -3.697 -2.079 559 HB1 ALA 65 HB1 ALA 65 -1.859 -2.139 -2.470 560 HB2 ALA 65 HB2 ALA 65 -1.713 -2.736 -4.126 561 HB3 ALA 65 HB3 ALA 65 -1.363 -3.807 -2.770 562 H LEU 66 HN LEU 66 -4.383 -3.104 -5.381 563 HA LEU 66 HA LEU 66 -5.248 -0.362 -4.997 564 HB2 LEU 66 HB2 LEU 66 -4.810 -2.179 -7.264 565 HB3 LEU 66 HB1 LEU 66 -6.106 -1.020 -7.471 566 HG LEU 66 HG LEU 66 -4.540 0.803 -7.010 567 HD11 LEU 66 HD11 LEU 66 -2.381 -1.285 -7.105 568 HD12 LEU 66 HD12 LEU 66 -3.044 -0.640 -5.602 569 HD13 LEU 66 HD13 LEU 66 -2.215 0.438 -6.733 570 HD21 LEU 66 HD21 LEU 66 -4.939 0.129 -9.312 571 HD22 LEU 66 HD22 LEU 66 -3.657 -1.076 -9.194 572 HD23 LEU 66 HD23 LEU 66 -3.265 0.640 -9.098 573 H ASN 67 HN ASN 67 -6.552 -3.355 -4.586 574 HA ASN 67 HA ASN 67 -9.124 -3.288 -5.538 575 HB2 ASN 67 HB2 ASN 67 -9.606 -5.055 -4.145 576 HB3 ASN 67 HB1 ASN 67 -7.865 -5.122 -4.154 577 HD21 ASN 67 HD21 ASN 67 -6.749 -4.183 -2.317 578 HD22 ASN 67 HD22 ASN 67 -7.532 -4.178 -0.773 579 H LYS 68 HN LYS 68 -7.949 -1.850 -2.554 580 HA LYS 68 HA LYS 68 -10.321 -0.122 -2.578 581 HB2 LYS 68 HB2 LYS 68 -8.988 -1.198 -0.085 582 HB3 LYS 68 HB1 LYS 68 -10.300 -0.035 -0.122 583 HG2 LYS 68 HG2 LYS 68 -10.376 -2.948 -0.833 584 HG3 LYS 68 HG1 LYS 68 -11.247 -2.113 0.450 585 HD2 LYS 68 HD2 LYS 68 -11.693 -1.806 -2.517 586 HD3 LYS 68 HD1 LYS 68 -12.739 -2.663 -1.387 587 HE2 LYS 68 HE2 LYS 68 -13.174 -0.561 -0.209 588 HE3 LYS 68 HE1 LYS 68 -12.125 0.281 -1.348 589 HZ1 LYS 68 HZ1 LYS 68 -14.573 -1.197 -2.124 590 HZ2 LYS 68 HZ2 LYS 68 -13.616 -0.232 -3.126 591 HZ3 LYS 68 HZ3 LYS 68 -14.513 0.472 -1.879 592 H GLY 69 HN GLY 69 -9.943 2.023 -1.822 593 HA2 GLY 69 HA2 GLY 69 -8.194 3.362 -0.556 594 HA3 GLY 69 HA1 GLY 69 -7.080 2.735 -1.761 595 H ARG 70 HN ARG 70 -9.628 3.031 -3.588 596 HA ARG 70 HA ARG 70 -9.164 5.884 -4.150 597 HB2 ARG 70 HB2 ARG 70 -9.609 3.621 -6.104 598 HB3 ARG 70 HB1 ARG 70 -9.555 5.323 -6.547 599 HG2 ARG 70 HG2 ARG 70 -7.257 5.473 -5.780 600 HG3 ARG 70 HG1 ARG 70 -7.304 3.786 -5.267 601 HD2 ARG 70 HD2 ARG 70 -7.646 3.074 -7.560 602 HD3 ARG 70 HD1 ARG 70 -7.691 4.753 -8.096 603 HE ARG 70 HE ARG 70 -5.272 4.342 -6.762 604 HH11 ARG 70 HH11 ARG 70 -6.895 3.249 -9.656 605 HH12 ARG 70 HH12 ARG 70 -5.427 3.040 -10.556 606 HH21 ARG 70 HH21 ARG 70 -3.333 4.057 -7.931 607 HH22 ARG 70 HH22 ARG 70 -3.394 3.490 -9.570 608 H ARG 71 HN ARG 71 -10.920 6.659 -3.090 609 HA ARG 71 HA ARG 71 -13.070 7.200 -2.642 610 HB2 ARG 71 HB2 ARG 71 -13.065 7.817 -5.026 611 HB3 ARG 71 HB1 ARG 71 -13.551 6.183 -5.450 612 HG2 ARG 71 HG2 ARG 71 -15.664 6.483 -4.298 613 HG3 ARG 71 HG1 ARG 71 -15.176 8.099 -3.788 614 HD2 ARG 71 HD2 ARG 71 -16.680 8.124 -5.742 615 HD3 ARG 71 HD1 ARG 71 -15.108 8.846 -6.082 616 HE ARG 71 HE ARG 71 -14.722 6.333 -6.903 617 HH11 ARG 71 HH11 ARG 71 -17.371 8.544 -7.495 618 HH12 ARG 71 HH12 ARG 71 -17.724 7.899 -9.066 619 HH21 ARG 71 HH21 ARG 71 -15.177 5.487 -8.960 620 HH22 ARG 71 HH22 ARG 71 -16.479 6.152 -9.899 621 H GLU 72 HN GLU 72 -12.915 5.444 -1.084 622 HA GLU 72 HA GLU 72 -14.340 2.996 -1.808 623 HB2 GLU 72 HB2 GLU 72 -13.586 2.157 0.390 624 HB3 GLU 72 HB1 GLU 72 -12.249 2.688 -0.618 625 HG2 GLU 72 HG2 GLU 72 -13.451 4.498 1.446 626 HG3 GLU 72 HG1 GLU 72 -12.238 3.298 1.875 627 H GLU 73 HN GLU 73 -15.482 5.770 -1.276 628 HA GLU 73 HA GLU 73 -17.332 6.717 -0.378 629 HB2 GLU 73 HB2 GLU 73 -18.424 4.703 -1.349 630 HB3 GLU 73 HB1 GLU 73 -18.191 3.870 0.182 631 HG2 GLU 73 HG2 GLU 73 -19.548 5.683 1.260 632 HG3 GLU 73 HG1 GLU 73 -19.921 6.267 -0.360 633 H LYS 74 HN LYS 74 -15.997 7.594 1.289 634 HA LYS 74 HA LYS 74 -15.674 6.259 3.794 635 HB2 LYS 74 HB2 LYS 74 -15.428 9.220 3.240 636 HB3 LYS 74 HB1 LYS 74 -14.701 8.321 4.564 637 HG2 LYS 74 HG2 LYS 74 -13.301 7.104 2.966 638 HG3 LYS 74 HG1 LYS 74 -14.025 8.020 1.644 639 HD2 LYS 74 HD2 LYS 74 -11.962 9.073 2.129 640 HD3 LYS 74 HD1 LYS 74 -13.217 10.107 2.810 641 HE2 LYS 74 HE2 LYS 74 -11.405 9.915 4.387 642 HE3 LYS 74 HE1 LYS 74 -12.817 9.075 5.021 643 HZ1 LYS 74 HZ1 LYS 74 -10.522 7.770 3.660 644 HZ2 LYS 74 HZ2 LYS 74 -11.855 6.981 4.334 645 HZ3 LYS 74 HZ3 LYS 74 -10.771 7.809 5.331 646 H VAL 75 HN VAL 75 -17.753 8.840 2.577 647 HA VAL 75 HA VAL 75 -19.574 8.324 4.824 648 HB VAL 75 HB VAL 75 -20.332 10.751 4.494 649 HG11 VAL 75 HG11 VAL 75 -19.086 9.966 6.450 650 HG12 VAL 75 HG12 VAL 75 -18.602 11.598 5.993 651 HG13 VAL 75 HG13 VAL 75 -17.567 10.228 5.588 652 HG21 VAL 75 HG21 VAL 75 -19.195 11.182 2.376 653 HG22 VAL 75 HG22 VAL 75 -17.633 10.919 3.149 654 HG23 VAL 75 HG23 VAL 75 -18.631 12.292 3.625 655 H GLY 76 HN GLY 76 -20.661 6.792 3.532 656 HA2 GLY 76 HA2 GLY 76 -22.073 7.838 1.186 657 HA3 GLY 76 HA1 GLY 76 -21.973 6.148 1.662 658 H LYS 77 HN LYS 77 -23.760 9.037 1.836 659 HA LYS 77 HA LYS 77 -25.737 9.635 2.775 660 HB2 LYS 77 HB2 LYS 77 -26.120 6.658 3.178 661 HB3 LYS 77 HB1 LYS 77 -27.382 7.877 3.254 662 HG2 LYS 77 HG2 LYS 77 -25.764 7.180 0.813 663 HG3 LYS 77 HG1 LYS 77 -27.413 6.654 1.141 664 HD2 LYS 77 HD2 LYS 77 -26.563 9.538 0.907 665 HD3 LYS 77 HD1 LYS 77 -27.253 8.595 -0.414 666 HE2 LYS 77 HE2 LYS 77 -29.295 8.268 0.852 667 HE3 LYS 77 HE1 LYS 77 -28.603 9.117 2.230 668 HZ1 LYS 77 HZ1 LYS 77 -28.486 11.120 0.893 669 HZ2 LYS 77 HZ2 LYS 77 -30.070 10.545 0.961 670 HZ3 LYS 77 HZ3 LYS 77 -29.146 10.306 -0.434 671 H LYS 78 HN LYS 78 -23.520 9.807 4.359 672 HA LYS 78 HA LYS 78 -23.985 8.595 6.929 673 HB2 LYS 78 HB2 LYS 78 -21.704 9.020 6.105 674 HB3 LYS 78 HB1 LYS 78 -22.031 10.746 6.092 675 HG2 LYS 78 HG2 LYS 78 -20.743 10.206 8.036 676 HG3 LYS 78 HG1 LYS 78 -22.372 10.663 8.538 677 HD2 LYS 78 HD2 LYS 78 -22.967 8.308 8.785 678 HD3 LYS 78 HD1 LYS 78 -21.358 7.834 8.240 679 HE2 LYS 78 HE2 LYS 78 -20.380 9.000 10.168 680 HE3 LYS 78 HE1 LYS 78 -21.997 9.431 10.717 681 HZ1 LYS 78 HZ1 LYS 78 -21.086 7.484 11.862 682 HZ2 LYS 78 HZ2 LYS 78 -21.004 6.653 10.392 683 HZ3 LYS 78 HZ3 LYS 78 -22.507 7.114 11.019 684 H GLU 79 HN GLU 79 -25.583 9.300 8.151 685 HA GLU 79 HA GLU 79 -26.338 12.120 8.044 686 HB2 GLU 79 HB2 GLU 79 -27.752 9.651 9.009 687 HB3 GLU 79 HB1 GLU 79 -28.336 11.263 9.394 688 HG2 GLU 79 HG2 GLU 79 -27.920 10.194 6.614 689 HG3 GLU 79 HG1 GLU 79 -29.467 10.265 7.457 690 H LYS 80 HN LYS 80 -26.519 9.765 10.708 691 HA LYS 80 HA LYS 80 -25.163 11.748 12.413 692 HB2 LYS 80 HB2 LYS 80 -27.679 10.224 13.106 693 HB3 LYS 80 HB1 LYS 80 -26.790 11.266 14.206 694 HG2 LYS 80 HG2 LYS 80 -27.291 13.193 12.825 695 HG3 LYS 80 HG1 LYS 80 -28.120 12.163 11.657 696 HD2 LYS 80 HD2 LYS 80 -29.736 11.523 13.391 697 HD3 LYS 80 HD1 LYS 80 -28.913 12.579 14.538 698 HE2 LYS 80 HE2 LYS 80 -30.185 13.488 11.962 699 HE3 LYS 80 HE1 LYS 80 -30.940 13.597 13.549 700 HZ1 LYS 80 HZ1 LYS 80 -28.452 14.961 12.685 701 HZ2 LYS 80 HZ2 LYS 80 -29.079 15.007 14.253 702 HZ3 LYS 80 HZ3 LYS 80 -29.951 15.688 12.978 703 H ILE 81 HN ILE 81 -26.585 8.491 12.715 704 HA ILE 81 HA ILE 81 -24.433 7.763 14.528 705 HB ILE 81 HB ILE 81 -25.711 5.659 14.857 706 HG12 ILE 81 HG12 ILE 81 -27.727 6.977 13.027 707 HG13 ILE 81 HG11 ILE 81 -26.772 5.554 12.634 708 HG21 ILE 81 HG21 ILE 81 -27.588 6.701 16.057 709 HG22 ILE 81 HG22 ILE 81 -27.264 8.219 15.218 710 HG23 ILE 81 HG23 ILE 81 -26.066 7.551 16.327 711 HD11 ILE 81 HD11 ILE 81 -28.835 5.748 14.814 712 HD12 ILE 81 HD12 ILE 81 -27.888 4.316 14.407 713 HD13 ILE 81 HD13 ILE 81 -29.045 4.967 13.245 714 H GLY 82 HN GLY 82 -23.807 5.274 14.257 715 HA2 GLY 82 HA2 GLY 82 -22.350 5.172 11.776 716 HA3 GLY 82 HA1 GLY 82 -22.296 3.984 13.071 717 H LYS 83 HN LYS 83 -24.039 2.445 13.214 718 HA LYS 83 HA LYS 83 -25.168 1.868 10.556 719 HB2 LYS 83 HB2 LYS 83 -24.315 -0.092 12.696 720 HB3 LYS 83 HB1 LYS 83 -24.985 -0.511 11.125 721 HG2 LYS 83 HG2 LYS 83 -23.057 0.459 10.014 722 HG3 LYS 83 HG1 LYS 83 -22.393 0.958 11.570 723 HD2 LYS 83 HD2 LYS 83 -21.280 -1.049 10.871 724 HD3 LYS 83 HD1 LYS 83 -22.320 -1.436 12.241 725 HE2 LYS 83 HE2 LYS 83 -22.460 -3.145 10.495 726 HE3 LYS 83 HE1 LYS 83 -24.005 -2.333 10.731 727 HZ1 LYS 83 HZ1 LYS 83 -22.069 -1.673 8.576 728 HZ2 LYS 83 HZ2 LYS 83 -23.617 -1.024 8.772 729 HZ3 LYS 83 HZ3 LYS 83 -23.430 -2.653 8.378 730 H LYS 84 HN LYS 84 -25.701 1.733 14.036 731 HA LYS 84 HA LYS 84 -28.519 2.111 13.707 732 HB2 LYS 84 HB2 LYS 84 -28.111 -0.393 13.342 733 HB3 LYS 84 HB1 LYS 84 -27.670 -0.458 15.039 734 HG2 LYS 84 HG2 LYS 84 -29.893 0.305 15.665 735 HG3 LYS 84 HG1 LYS 84 -30.341 0.417 13.961 736 HD2 LYS 84 HD2 LYS 84 -29.808 -2.024 13.755 737 HD3 LYS 84 HD1 LYS 84 -29.617 -2.067 15.508 738 HE2 LYS 84 HE2 LYS 84 -32.122 -1.237 14.049 739 HE3 LYS 84 HE1 LYS 84 -31.843 -2.823 14.762 740 HZ1 LYS 84 HZ1 LYS 84 -31.616 -1.726 16.930 741 HZ2 LYS 84 HZ2 LYS 84 -33.138 -1.477 16.243 742 HZ3 LYS 84 HZ3 LYS 84 -31.991 -0.238 16.216 743 H LYS 85 HN LYS 85 -29.555 2.555 15.763 744 HA LYS 85 HA LYS 85 -27.962 4.145 17.399 745 HB2 LYS 85 HB2 LYS 85 -30.401 4.419 17.148 746 HB3 LYS 85 HB1 LYS 85 -30.654 2.939 18.057 747 HG2 LYS 85 HG2 LYS 85 -31.036 4.776 19.520 748 HG3 LYS 85 HG1 LYS 85 -29.522 4.010 19.999 749 HD2 LYS 85 HD2 LYS 85 -29.216 6.385 20.059 750 HD3 LYS 85 HD1 LYS 85 -28.306 5.747 18.689 751 HE2 LYS 85 HE2 LYS 85 -29.479 7.790 18.072 752 HE3 LYS 85 HE1 LYS 85 -30.116 6.411 17.178 753 HZ1 LYS 85 HZ1 LYS 85 -31.356 7.632 19.586 754 HZ2 LYS 85 HZ2 LYS 85 -31.974 6.316 18.722 755 HZ3 LYS 85 HZ3 LYS 85 -31.886 7.838 17.992 756 H ARG 86 HN ARG 86 -29.583 1.119 18.398 757 HA ARG 86 HA ARG 86 -27.811 0.960 20.697 758 HB2 ARG 86 HB2 ARG 86 -30.117 -0.813 19.878 759 HB3 ARG 86 HB1 ARG 86 -29.252 -0.902 21.407 760 HG2 ARG 86 HG2 ARG 86 -30.018 1.323 21.997 761 HG3 ARG 86 HG1 ARG 86 -30.837 1.471 20.442 762 HD2 ARG 86 HD2 ARG 86 -32.195 -0.537 21.067 763 HD3 ARG 86 HD1 ARG 86 -31.471 -0.453 22.672 764 HE ARG 86 HE ARG 86 -32.607 2.040 21.951 765 HH11 ARG 86 HH11 ARG 86 -33.471 -1.172 23.032 766 HH12 ARG 86 HH12 ARG 86 -34.957 -0.663 23.769 767 HH21 ARG 86 HH21 ARG 86 -34.563 2.716 22.911 768 HH22 ARG 86 HH22 ARG 86 -35.576 1.554 23.706 769 H GLN 87 HN GLN 87 -26.371 0.653 18.414 770 HA GLN 87 HA GLN 87 -25.698 -2.214 18.445 771 HB2 GLN 87 HB2 GLN 87 -25.534 -0.125 16.335 772 HB3 GLN 87 HB1 GLN 87 -24.253 -1.330 16.374 773 HG2 GLN 87 HG2 GLN 87 -27.192 -1.957 16.236 774 HG3 GLN 87 HG1 GLN 87 -26.105 -1.905 14.849 775 HE21 GLN 87 HE21 GLN 87 -27.047 -3.654 17.693 776 HE22 GLN 87 HE22 GLN 87 -26.154 -5.094 17.346 777 H LYS 88 HN LYS 88 -23.149 -2.238 17.674 778 HA LYS 88 HA LYS 88 -21.001 -1.981 18.321 779 HB2 LYS 88 HB2 LYS 88 -21.316 0.366 17.698 780 HB3 LYS 88 HB1 LYS 88 -21.935 0.719 19.303 781 HG2 LYS 88 HG2 LYS 88 -19.774 0.187 20.275 782 HG3 LYS 88 HG1 LYS 88 -19.148 -0.233 18.679 783 HD2 LYS 88 HD2 LYS 88 -19.523 2.051 17.919 784 HD3 LYS 88 HD1 LYS 88 -20.184 2.479 19.498 785 HE2 LYS 88 HE2 LYS 88 -18.039 1.982 20.539 786 HE3 LYS 88 HE1 LYS 88 -17.377 1.516 18.974 787 HZ1 LYS 88 HZ1 LYS 88 -16.763 3.776 19.614 788 HZ2 LYS 88 HZ2 LYS 88 -18.393 4.219 19.654 789 HZ3 LYS 88 HZ3 LYS 88 -17.679 3.760 18.191 790 H LYS 89 HN LYS 89 -20.800 -3.551 19.795 791 HA LYS 89 HA LYS 89 -21.810 -3.472 22.434 792 HB2 LYS 89 HB2 LYS 89 -21.144 -5.551 21.232 793 HB3 LYS 89 HB1 LYS 89 -19.465 -5.052 21.352 794 HG2 LYS 89 HG2 LYS 89 -19.941 -6.697 23.036 795 HG3 LYS 89 HG1 LYS 89 -19.645 -5.139 23.809 796 HD2 LYS 89 HD2 LYS 89 -22.043 -4.789 24.054 797 HD3 LYS 89 HD1 LYS 89 -22.362 -6.317 23.233 798 HE2 LYS 89 HE2 LYS 89 -21.257 -7.535 25.014 799 HE3 LYS 89 HE1 LYS 89 -20.834 -6.024 25.815 800 HZ1 LYS 89 HZ1 LYS 89 -23.608 -6.967 25.331 801 HZ2 LYS 89 HZ2 LYS 89 -23.156 -5.573 26.175 802 HZ3 LYS 89 HZ3 LYS 89 -22.782 -7.101 26.800 803 H ARG 90 HN ARG 90 -21.262 -1.897 23.767 804 HA ARG 90 HA ARG 90 -19.012 -0.277 23.615 805 HB2 ARG 90 HB2 ARG 90 -20.748 -0.883 26.012 806 HB3 ARG 90 HB1 ARG 90 -19.610 0.455 25.906 807 HG2 ARG 90 HG2 ARG 90 -20.868 1.440 24.102 808 HG3 ARG 90 HG1 ARG 90 -21.960 0.058 24.069 809 HD2 ARG 90 HD2 ARG 90 -22.689 0.585 26.344 810 HD3 ARG 90 HD1 ARG 90 -21.596 1.966 26.374 811 HE ARG 90 HE ARG 90 -23.456 2.030 24.184 812 HH11 ARG 90 HH11 ARG 90 -22.999 2.799 27.565 813 HH12 ARG 90 HH12 ARG 90 -24.204 4.045 27.581 814 HH21 ARG 90 HH21 ARG 90 -25.039 3.695 24.196 815 HH22 ARG 90 HH22 ARG 90 -25.350 4.572 25.661 816 H LYS 91 HN LYS 91 -19.581 -3.115 25.655 817 HA LYS 91 HA LYS 91 -16.812 -3.795 25.536 818 HB2 LYS 91 HB2 LYS 91 -16.840 -2.072 27.366 819 HB3 LYS 91 HB1 LYS 91 -17.915 -3.128 28.270 820 HG2 LYS 91 HG2 LYS 91 -15.740 -3.483 29.122 821 HG3 LYS 91 HG1 LYS 91 -16.127 -4.893 28.134 822 HD2 LYS 91 HD2 LYS 91 -14.869 -3.861 26.260 823 HD3 LYS 91 HD1 LYS 91 -14.407 -2.543 27.335 824 HE2 LYS 91 HE2 LYS 91 -12.594 -4.093 27.256 825 HE3 LYS 91 HE1 LYS 91 -13.356 -4.239 28.837 826 HZ1 LYS 91 HZ1 LYS 91 -12.848 -6.399 27.895 827 HZ2 LYS 91 HZ2 LYS 91 -13.786 -6.064 26.532 828 HZ3 LYS 91 HZ3 LYS 91 -14.519 -6.208 28.048 829 H ALA 92 HN ALA 92 -16.812 -5.917 25.353 830 HA ALA 92 HA ALA 92 -19.059 -7.489 26.278 831 HB1 ALA 92 HB1 ALA 92 -16.518 -8.315 24.871 832 HB2 ALA 92 HB2 ALA 92 -18.072 -7.985 24.104 833 HB3 ALA 92 HB3 ALA 92 -17.898 -9.364 25.191 834 H ALA 93 HN ALA 93 -18.626 -6.864 28.539 835 HA ALA 93 HA ALA 93 -16.964 -8.864 29.825 836 HB1 ALA 93 HB1 ALA 93 -15.428 -6.976 29.506 837 HB2 ALA 93 HB2 ALA 93 -15.752 -7.284 31.211 838 HB3 ALA 93 HB3 ALA 93 -16.537 -5.932 30.396 839 H GLN 94 HN GLN 94 -18.294 -5.810 31.062 840 HA GLN 94 HA GLN 94 -19.629 -5.386 32.853 841 HB2 GLN 94 HB2 GLN 94 -21.135 -7.704 31.643 842 HB3 GLN 94 HB1 GLN 94 -21.766 -6.701 32.938 843 HG2 GLN 94 HG2 GLN 94 -21.548 -4.733 31.452 844 HG3 GLN 94 HG1 GLN 94 -21.059 -5.820 30.152 845 HE21 GLN 94 HE21 GLN 94 -22.570 -7.217 29.257 846 HE22 GLN 94 HE22 GLN 94 -24.272 -6.997 29.476 847 H LYS 95 HN LYS 95 -17.481 -6.515 33.742 848 HA LYS 95 HA LYS 95 -16.504 -7.663 35.425 849 HB2 LYS 95 HB2 LYS 95 -19.341 -8.281 36.283 850 HB3 LYS 95 HB1 LYS 95 -17.902 -8.586 37.245 851 HG2 LYS 95 HG2 LYS 95 -17.435 -6.218 37.372 852 HG3 LYS 95 HG1 LYS 95 -18.785 -5.865 36.296 853 HD2 LYS 95 HD2 LYS 95 -19.662 -5.414 38.397 854 HD3 LYS 95 HD1 LYS 95 -20.225 -7.053 38.081 855 HE2 LYS 95 HE2 LYS 95 -17.797 -6.335 39.723 856 HE3 LYS 95 HE1 LYS 95 -19.378 -6.732 40.385 857 HZ1 LYS 95 HZ1 LYS 95 -17.555 -8.522 38.884 858 HZ2 LYS 95 HZ2 LYS 95 -19.157 -8.923 39.243 859 HZ3 LYS 95 HZ3 LYS 95 -18.050 -8.667 40.492 860 H ARG 96 HN ARG 96 -19.283 -9.831 35.219 861 HA ARG 96 HA ARG 96 -19.517 -11.990 34.567 862 HB2 ARG 96 HB2 ARG 96 -19.336 -10.904 32.379 863 HB3 ARG 96 HB1 ARG 96 -17.593 -11.106 32.415 864 HG2 ARG 96 HG2 ARG 96 -17.900 -13.549 32.425 865 HG3 ARG 96 HG1 ARG 96 -19.645 -13.306 32.308 866 HD2 ARG 96 HD2 ARG 96 -18.623 -13.773 30.123 867 HD3 ARG 96 HD1 ARG 96 -19.371 -12.177 30.180 868 HE ARG 96 HE ARG 96 -16.692 -11.860 30.864 869 HH11 ARG 96 HH11 ARG 96 -18.563 -12.862 28.087 870 HH12 ARG 96 HH12 ARG 96 -17.385 -12.317 26.938 871 HH21 ARG 96 HH21 ARG 96 -15.135 -11.147 29.368 872 HH22 ARG 96 HH22 ARG 96 -15.426 -11.342 27.667 873 H LYS 97 HN LYS 97 -18.472 -12.759 36.492 874 HA LYS 97 HA LYS 97 -15.760 -13.764 36.130 875 HB2 LYS 97 HB2 LYS 97 -17.627 -13.859 38.502 876 HB3 LYS 97 HB1 LYS 97 -16.022 -14.573 38.486 877 HG2 LYS 97 HG2 LYS 97 -16.594 -11.652 38.047 878 HG3 LYS 97 HG1 LYS 97 -16.115 -12.365 39.587 879 HD2 LYS 97 HD2 LYS 97 -14.026 -13.151 38.542 880 HD3 LYS 97 HD1 LYS 97 -14.508 -12.374 37.034 881 HE2 LYS 97 HE2 LYS 97 -12.935 -10.989 38.298 882 HE3 LYS 97 HE1 LYS 97 -14.503 -10.204 38.129 883 HZ1 LYS 97 HZ1 LYS 97 -13.588 -11.682 40.535 884 HZ2 LYS 97 HZ2 LYS 97 -15.054 -10.860 40.374 885 HZ3 LYS 97 HZ3 LYS 97 -13.601 -10.000 40.376 886 H ASN 98 HN ASN 98 -18.570 -15.353 37.624 887 HA ASN 98 HA ASN 98 -18.401 -17.497 35.652 888 HB2 ASN 98 HB2 ASN 98 -18.192 -18.004 38.632 889 HB3 ASN 98 HB1 ASN 98 -18.347 -19.245 37.396 890 HD21 ASN 98 HD21 ASN 98 -16.591 -19.592 35.965 891 HD22 ASN 98 HD22 ASN 98 -14.985 -19.123 36.402 Start of MODEL 11 1 H1 LYS 1 HT1 LYS 1 24.584 3.680 -7.291 2 H2 LYS 1 HT2 LYS 1 25.362 4.681 -6.173 3 H3 LYS 1 HT3 LYS 1 25.243 5.151 -7.792 4 HA LYS 1 HA LYS 1 22.884 5.361 -7.632 5 HB2 LYS 1 HB2 LYS 1 23.326 4.477 -4.775 6 HB3 LYS 1 HB1 LYS 1 21.819 5.155 -5.372 7 HG2 LYS 1 HG2 LYS 1 23.101 2.622 -6.381 8 HG3 LYS 1 HG1 LYS 1 21.767 2.703 -5.230 9 HD2 LYS 1 HD2 LYS 1 20.358 3.765 -6.895 10 HD3 LYS 1 HD1 LYS 1 21.696 3.801 -8.041 11 HE2 LYS 1 HE2 LYS 1 20.209 1.970 -8.569 12 HE3 LYS 1 HE1 LYS 1 21.758 1.341 -8.015 13 HZ1 LYS 1 HZ1 LYS 1 19.295 1.561 -6.375 14 HZ2 LYS 1 HZ2 LYS 1 20.777 0.950 -5.845 15 HZ3 LYS 1 HZ3 LYS 1 19.909 0.135 -7.045 16 HA PRO 2 HA PRO 2 24.325 9.447 -6.509 17 HB2 PRO 2 HB2 PRO 2 21.775 10.419 -7.535 18 HB3 PRO 2 HB1 PRO 2 23.398 10.664 -8.179 19 HG2 PRO 2 HG2 PRO 2 21.541 9.135 -9.421 20 HG3 PRO 2 HG1 PRO 2 23.282 8.818 -9.533 21 HD2 PRO 2 HD2 PRO 2 21.216 7.480 -7.829 22 HD3 PRO 2 HD1 PRO 2 22.565 6.768 -8.739 23 H VAL 3 HN VAL 3 22.615 11.506 -5.842 24 HA VAL 3 HA VAL 3 22.131 11.157 -3.136 25 HB VAL 3 HB VAL 3 20.839 13.112 -5.048 26 HG11 VAL 3 HG11 VAL 3 19.490 12.861 -3.016 27 HG12 VAL 3 HG12 VAL 3 20.267 14.442 -3.090 28 HG13 VAL 3 HG13 VAL 3 20.919 13.189 -2.033 29 HG21 VAL 3 HG21 VAL 3 22.496 14.680 -4.203 30 HG22 VAL 3 HG22 VAL 3 23.286 13.261 -4.888 31 HG23 VAL 3 HG23 VAL 3 23.154 13.437 -3.141 32 H SER 4 HN SER 4 20.765 9.835 -2.168 33 HA SER 4 HA SER 4 18.413 8.886 -3.612 34 HB2 SER 4 HB2 SER 4 19.641 7.870 -1.037 35 HB3 SER 4 HB1 SER 4 18.400 7.066 -1.997 36 HG SER 4 HG SER 4 20.520 7.678 -3.545 37 H LEU 5 HN LEU 5 18.248 11.505 -2.678 38 HA LEU 5 HA LEU 5 16.427 11.313 -0.388 39 HB2 LEU 5 HB2 LEU 5 18.072 13.546 -1.505 40 HB3 LEU 5 HB1 LEU 5 16.622 13.921 -0.597 41 HG LEU 5 HG LEU 5 17.546 12.675 1.339 42 HD11 LEU 5 HD11 LEU 5 19.033 11.165 0.099 43 HD12 LEU 5 HD12 LEU 5 19.877 12.036 1.379 44 HD13 LEU 5 HD13 LEU 5 20.070 12.536 -0.300 45 HD21 LEU 5 HD21 LEU 5 17.794 15.077 1.203 46 HD22 LEU 5 HD22 LEU 5 19.265 14.893 0.250 47 HD23 LEU 5 HD23 LEU 5 19.231 14.357 1.929 48 H SER 6 HN SER 6 14.817 10.381 -1.794 49 HA SER 6 HA SER 6 13.761 11.845 -3.981 50 HB2 SER 6 HB2 SER 6 11.864 10.119 -3.693 51 HB3 SER 6 HB1 SER 6 13.468 9.536 -4.143 52 HG SER 6 HG SER 6 12.105 8.672 -2.160 53 H TYR 7 HN TYR 7 11.851 10.756 -1.307 54 HA TYR 7 HA TYR 7 10.908 13.479 -0.771 55 HB2 TYR 7 HB2 TYR 7 9.450 12.271 -2.493 56 HB3 TYR 7 HB1 TYR 7 8.963 11.210 -1.182 57 HD1 TYR 7 HD1 TYR 7 6.969 11.717 -0.148 58 HD2 TYR 7 HD2 TYR 7 9.259 14.883 -1.825 59 HE1 TYR 7 HE1 TYR 7 5.210 13.313 0.483 60 HE2 TYR 7 HE2 TYR 7 7.507 16.491 -1.198 61 HH TYR 7 HH TYR 7 5.023 15.765 0.952 62 H ARG 8 HN ARG 8 12.390 11.097 0.415 63 HA ARG 8 HA ARG 8 12.497 9.727 2.211 64 HB2 ARG 8 HB2 ARG 8 12.531 10.977 4.352 65 HB3 ARG 8 HB1 ARG 8 13.500 11.702 3.085 66 HG2 ARG 8 HG2 ARG 8 11.930 13.440 2.755 67 HG3 ARG 8 HG1 ARG 8 10.728 12.627 3.758 68 HD2 ARG 8 HD2 ARG 8 11.800 14.466 4.967 69 HD3 ARG 8 HD1 ARG 8 12.158 12.912 5.716 70 HE ARG 8 HE ARG 8 14.074 14.155 3.863 71 HH11 ARG 8 HH11 ARG 8 13.296 12.925 7.052 72 HH12 ARG 8 HH12 ARG 8 14.937 12.979 7.606 73 HH21 ARG 8 HH21 ARG 8 16.228 14.234 4.598 74 HH22 ARG 8 HH22 ARG 8 16.603 13.730 6.214 75 H CYS 9 HN CYS 9 10.245 9.061 1.173 76 HA CYS 9 HA CYS 9 8.047 9.199 3.004 77 HB2 CYS 9 HB2 CYS 9 8.617 7.724 0.452 78 HB3 CYS 9 HB1 CYS 9 7.192 7.353 1.405 79 HA PRO 10 HA PRO 10 8.308 6.287 6.138 80 HB2 PRO 10 HB2 PRO 10 6.634 4.496 4.427 81 HB3 PRO 10 HB1 PRO 10 6.520 4.796 6.164 82 HG2 PRO 10 HG2 PRO 10 4.932 6.069 4.423 83 HG3 PRO 10 HG1 PRO 10 5.544 6.863 5.881 84 HD2 PRO 10 HD2 PRO 10 6.252 7.358 3.066 85 HD3 PRO 10 HD1 PRO 10 6.534 8.373 4.494 86 H CYS 11 HN CYS 11 8.141 4.139 3.297 87 HA CYS 11 HA CYS 11 10.401 2.668 4.406 88 HB2 CYS 11 HB2 CYS 11 8.452 1.408 3.532 89 HB3 CYS 11 HB1 CYS 11 8.784 2.050 1.926 90 H ARG 12 HN ARG 12 12.361 2.568 3.594 91 HA ARG 12 HA ARG 12 13.265 4.413 1.609 92 HB2 ARG 12 HB2 ARG 12 14.731 2.128 2.945 93 HB3 ARG 12 HB1 ARG 12 15.472 3.376 1.949 94 HG2 ARG 12 HG2 ARG 12 14.039 3.833 4.559 95 HG3 ARG 12 HG1 ARG 12 15.787 3.814 4.328 96 HD2 ARG 12 HD2 ARG 12 13.888 5.733 2.986 97 HD3 ARG 12 HD1 ARG 12 14.832 6.096 4.427 98 HE ARG 12 HE ARG 12 16.707 5.305 2.640 99 HH11 ARG 12 HH11 ARG 12 14.125 7.665 2.498 100 HH12 ARG 12 HH12 ARG 12 14.997 8.741 1.454 101 HH21 ARG 12 HH21 ARG 12 17.853 6.715 1.253 102 HH22 ARG 12 HH22 ARG 12 17.105 8.191 0.721 103 H PHE 13 HN PHE 13 15.144 2.865 0.164 104 HA PHE 13 HA PHE 13 13.288 2.175 -1.907 105 HB2 PHE 13 HB2 PHE 13 16.311 1.992 -1.856 106 HB3 PHE 13 HB1 PHE 13 15.301 1.871 -3.292 107 HD1 PHE 13 HD1 PHE 13 14.295 3.826 -4.274 108 HD2 PHE 13 HD2 PHE 13 16.609 4.120 -0.718 109 HE1 PHE 13 HE1 PHE 13 14.373 6.262 -4.533 110 HE2 PHE 13 HE2 PHE 13 16.691 6.552 -0.965 111 HZ PHE 13 HZ PHE 13 15.574 7.639 -2.877 112 H PHE 14 HN PHE 14 13.020 0.200 -2.893 113 HA PHE 14 HA PHE 14 13.083 -1.879 -0.850 114 HB2 PHE 14 HB2 PHE 14 11.224 -2.484 -2.911 115 HB3 PHE 14 HB1 PHE 14 10.908 -2.034 -1.250 116 HD1 PHE 14 HD1 PHE 14 9.985 0.031 -0.703 117 HD2 PHE 14 HD2 PHE 14 11.482 -0.630 -4.631 118 HE1 PHE 14 HE1 PHE 14 9.012 2.162 -1.427 119 HE2 PHE 14 HE2 PHE 14 10.507 1.504 -5.363 120 HZ PHE 14 HZ PHE 14 9.268 2.907 -3.761 121 H GLU 15 HN GLU 15 12.782 -4.174 -1.807 122 HA GLU 15 HA GLU 15 15.206 -4.578 -3.373 123 HB2 GLU 15 HB2 GLU 15 13.534 -6.496 -1.744 124 HB3 GLU 15 HB1 GLU 15 15.050 -6.901 -2.535 125 HG2 GLU 15 HG2 GLU 15 14.666 -4.916 -0.310 126 HG3 GLU 15 HG1 GLU 15 15.390 -6.517 -0.175 127 H SER 16 HN SER 16 15.142 -5.136 -5.422 128 HA SER 16 HA SER 16 12.598 -5.926 -6.632 129 HB2 SER 16 HB2 SER 16 15.215 -5.209 -7.979 130 HB3 SER 16 HB1 SER 16 13.646 -5.381 -8.759 131 HG SER 16 HG SER 16 13.001 -3.499 -7.957 132 H HIS 17 HN HIS 17 13.933 -7.820 -5.007 133 HA HIS 17 HA HIS 17 14.541 -9.867 -7.023 134 HB2 HIS 17 HB2 HIS 17 16.643 -9.071 -5.991 135 HB3 HIS 17 HB1 HIS 17 16.015 -9.494 -4.408 136 HD1 HIS 17 HD1 HIS 17 16.626 -11.742 -3.590 137 HD2 HIS 17 HD2 HIS 17 16.862 -11.482 -7.729 138 HE1 HIS 17 HE1 HIS 17 17.567 -13.942 -4.348 139 HE2 HIS 17 HE2 HIS 17 17.461 -13.846 -6.861 140 H ILE 18 HN ILE 18 12.794 -8.899 -4.298 141 HA ILE 18 HA ILE 18 12.468 -11.379 -2.983 142 HB ILE 18 HB ILE 18 10.614 -9.007 -3.001 143 HG12 ILE 18 HG12 ILE 18 12.758 -9.786 -1.033 144 HG13 ILE 18 HG11 ILE 18 12.916 -8.512 -2.234 145 HG21 ILE 18 HG21 ILE 18 9.836 -9.958 -0.821 146 HG22 ILE 18 HG22 ILE 18 10.755 -11.420 -1.201 147 HG23 ILE 18 HG23 ILE 18 9.414 -10.926 -2.234 148 HD11 ILE 18 HD11 ILE 18 12.416 -7.584 -0.057 149 HD12 ILE 18 HD12 ILE 18 10.960 -8.570 0.054 150 HD13 ILE 18 HD13 ILE 18 11.075 -7.302 -1.167 151 H ALA 19 HN ALA 19 11.105 -12.999 -3.259 152 HA ALA 19 HA ALA 19 9.320 -12.955 -5.599 153 HB1 ALA 19 HB1 ALA 19 11.185 -14.577 -5.667 154 HB2 ALA 19 HB2 ALA 19 9.606 -15.361 -5.670 155 HB3 ALA 19 HB3 ALA 19 10.564 -15.315 -4.189 156 H ARG 20 HN ARG 20 7.315 -14.203 -5.407 157 HA ARG 20 HA ARG 20 5.829 -13.609 -3.128 158 HB2 ARG 20 HB2 ARG 20 4.867 -15.914 -4.606 159 HB3 ARG 20 HB1 ARG 20 4.161 -14.347 -4.362 160 HG2 ARG 20 HG2 ARG 20 5.464 -13.434 -6.198 161 HG3 ARG 20 HG1 ARG 20 6.158 -15.033 -6.470 162 HD2 ARG 20 HD2 ARG 20 3.258 -14.257 -6.695 163 HD3 ARG 20 HD1 ARG 20 4.342 -14.676 -8.017 164 HE ARG 20 HE ARG 20 4.457 -16.911 -6.624 165 HH11 ARG 20 HH11 ARG 20 1.671 -14.939 -7.390 166 HH12 ARG 20 HH12 ARG 20 0.558 -16.269 -7.345 167 HH21 ARG 20 HH21 ARG 20 2.999 -18.661 -6.553 168 HH22 ARG 20 HH22 ARG 20 1.310 -18.384 -6.847 169 H ALA 21 HN ALA 21 7.556 -16.428 -4.160 170 HA ALA 21 HA ALA 21 6.730 -18.126 -2.013 171 HB1 ALA 21 HB1 ALA 21 7.431 -19.009 -4.196 172 HB2 ALA 21 HB2 ALA 21 8.363 -19.690 -2.865 173 HB3 ALA 21 HB3 ALA 21 9.067 -18.433 -3.881 174 H ASN 22 HN ASN 22 8.758 -15.521 -2.113 175 HA ASN 22 HA ASN 22 10.478 -16.584 -0.007 176 HB2 ASN 22 HB2 ASN 22 11.254 -15.200 -2.167 177 HB3 ASN 22 HB1 ASN 22 10.914 -13.878 -1.074 178 HD21 ASN 22 HD21 ASN 22 13.437 -14.785 -2.176 179 HD22 ASN 22 HD22 ASN 22 14.461 -15.103 -0.826 180 H VAL 23 HN VAL 23 7.725 -14.733 -0.498 181 HA VAL 23 HA VAL 23 8.275 -13.124 1.880 182 HB VAL 23 HB VAL 23 7.656 -11.849 -0.094 183 HG11 VAL 23 HG11 VAL 23 5.349 -11.915 -0.941 184 HG12 VAL 23 HG12 VAL 23 5.025 -13.299 0.107 185 HG13 VAL 23 HG13 VAL 23 6.197 -13.442 -1.206 186 HG21 VAL 23 HG21 VAL 23 7.121 -11.093 2.182 187 HG22 VAL 23 HG22 VAL 23 5.495 -11.747 1.974 188 HG23 VAL 23 HG23 VAL 23 6.056 -10.430 0.939 189 H LYS 24 HN LYS 24 7.090 -13.062 3.558 190 HA LYS 24 HA LYS 24 4.954 -14.998 3.982 191 HB2 LYS 24 HB2 LYS 24 6.377 -13.199 5.962 192 HB3 LYS 24 HB1 LYS 24 5.213 -14.446 6.356 193 HG2 LYS 24 HG2 LYS 24 6.840 -16.100 5.345 194 HG3 LYS 24 HG1 LYS 24 7.996 -14.770 5.310 195 HD2 LYS 24 HD2 LYS 24 8.135 -14.632 7.589 196 HD3 LYS 24 HD1 LYS 24 6.555 -15.356 7.856 197 HE2 LYS 24 HE2 LYS 24 9.130 -16.732 7.107 198 HE3 LYS 24 HE1 LYS 24 8.214 -16.897 8.596 199 HZ1 LYS 24 HZ1 LYS 24 7.848 -18.788 7.153 200 HZ2 LYS 24 HZ2 LYS 24 7.296 -17.780 5.914 201 HZ3 LYS 24 HZ3 LYS 24 6.413 -17.916 7.346 202 H HIS 25 HN HIS 25 3.742 -13.515 6.064 203 HA HIS 25 HA HIS 25 1.704 -12.089 5.168 204 HB2 HIS 25 HB2 HIS 25 2.651 -10.394 7.198 205 HB3 HIS 25 HB1 HIS 25 1.464 -11.684 7.367 206 HD1 HIS 25 HD1 HIS 25 4.304 -10.472 8.950 207 HD2 HIS 25 HD2 HIS 25 3.174 -14.295 7.783 208 HE1 HIS 25 HE1 HIS 25 5.641 -12.041 10.385 209 HE2 HIS 25 HE2 HIS 25 4.749 -14.330 9.829 210 H LEU 26 HN LEU 26 1.478 -10.569 3.699 211 HA LEU 26 HA LEU 26 3.566 -8.526 3.408 212 HB2 LEU 26 HB2 LEU 26 3.441 -9.951 1.472 213 HB3 LEU 26 HB1 LEU 26 1.705 -9.746 1.368 214 HG LEU 26 HG LEU 26 1.954 -7.456 0.650 215 HD11 LEU 26 HD11 LEU 26 4.927 -7.817 0.891 216 HD12 LEU 26 HD12 LEU 26 3.947 -7.014 2.102 217 HD13 LEU 26 HD13 LEU 26 4.050 -6.348 0.479 218 HD21 LEU 26 HD21 LEU 26 2.723 -7.850 -1.487 219 HD22 LEU 26 HD22 LEU 26 2.465 -9.505 -0.930 220 HD23 LEU 26 HD23 LEU 26 4.098 -8.815 -0.934 221 H LYS 27 HN LYS 27 3.030 -6.427 3.438 222 HA LYS 27 HA LYS 27 0.211 -5.650 3.672 223 HB2 LYS 27 HB2 LYS 27 0.897 -5.817 5.946 224 HB3 LYS 27 HB1 LYS 27 2.448 -5.075 5.599 225 HG2 LYS 27 HG2 LYS 27 1.029 -3.535 6.797 226 HG3 LYS 27 HG1 LYS 27 1.340 -2.950 5.154 227 HD2 LYS 27 HD2 LYS 27 -0.855 -3.918 4.475 228 HD3 LYS 27 HD1 LYS 27 -1.157 -4.325 6.162 229 HE2 LYS 27 HE2 LYS 27 -1.165 -2.023 6.790 230 HE3 LYS 27 HE1 LYS 27 -0.597 -1.531 5.194 231 HZ1 LYS 27 HZ1 LYS 27 -2.674 -2.326 4.251 232 HZ2 LYS 27 HZ2 LYS 27 -2.966 -1.155 5.435 233 HZ3 LYS 27 HZ3 LYS 27 -3.220 -2.790 5.782 234 H ILE 28 HN ILE 28 -0.224 -3.568 2.891 235 HA ILE 28 HA ILE 28 2.042 -2.316 1.492 236 HB ILE 28 HB ILE 28 -0.867 -1.935 0.811 237 HG12 ILE 28 HG12 ILE 28 -0.396 -4.273 0.544 238 HG13 ILE 28 HG11 ILE 28 -0.416 -3.543 -1.050 239 HG21 ILE 28 HG21 ILE 28 0.039 -1.173 -1.346 240 HG22 ILE 28 HG22 ILE 28 1.674 -1.394 -0.725 241 HG23 ILE 28 HG23 ILE 28 0.611 -0.187 0.000 242 HD11 ILE 28 HD11 ILE 28 1.375 -5.168 -0.817 243 HD12 ILE 28 HD12 ILE 28 2.043 -4.232 0.522 244 HD13 ILE 28 HD13 ILE 28 2.003 -3.541 -1.099 245 H LEU 29 HN LEU 29 2.583 -0.295 1.905 246 HA LEU 29 HA LEU 29 1.189 1.044 4.096 247 HB2 LEU 29 HB2 LEU 29 3.777 0.697 3.841 248 HB3 LEU 29 HB1 LEU 29 3.670 2.094 2.788 249 HG LEU 29 HG LEU 29 4.366 2.679 5.085 250 HD11 LEU 29 HD11 LEU 29 2.806 4.522 5.450 251 HD12 LEU 29 HD12 LEU 29 1.657 3.791 4.320 252 HD13 LEU 29 HD13 LEU 29 3.228 4.362 3.746 253 HD21 LEU 29 HD21 LEU 29 2.841 2.514 6.937 254 HD22 LEU 29 HD22 LEU 29 3.067 0.913 6.231 255 HD23 LEU 29 HD23 LEU 29 1.594 1.823 5.901 256 H ASN 30 HN ASN 30 -0.121 2.697 3.805 257 HA ASN 30 HA ASN 30 -0.312 3.969 1.197 258 HB2 ASN 30 HB2 ASN 30 -1.964 3.908 3.671 259 HB3 ASN 30 HB1 ASN 30 -2.127 5.281 2.589 260 HD21 ASN 30 HD21 ASN 30 -1.328 2.092 1.445 261 HD22 ASN 30 HD22 ASN 30 -2.835 1.780 0.659 262 H THR 31 HN THR 31 1.480 5.199 0.994 263 HA THR 31 HA THR 31 2.590 6.756 3.047 264 HB THR 31 HB THR 31 3.742 7.734 0.923 265 HG1 THR 31 HG1 THR 31 3.437 5.461 -0.431 266 HG21 THR 31 HG21 THR 31 4.067 4.882 1.813 267 HG22 THR 31 HG22 THR 31 4.780 6.298 2.583 268 HG23 THR 31 HG23 THR 31 5.277 5.838 0.956 269 HA PRO 32 HA PRO 32 1.546 11.155 2.904 270 HB2 PRO 32 HB2 PRO 32 4.009 11.012 1.198 271 HB3 PRO 32 HB1 PRO 32 3.548 12.247 2.370 272 HG2 PRO 32 HG2 PRO 32 5.211 10.281 3.039 273 HG3 PRO 32 HG1 PRO 32 3.992 10.864 4.181 274 HD2 PRO 32 HD2 PRO 32 4.140 8.311 2.772 275 HD3 PRO 32 HD1 PRO 32 3.186 8.751 4.195 276 H ASN 33 HN ASN 33 1.074 9.271 0.217 277 HA ASN 33 HA ASN 33 0.634 9.560 -1.977 278 HB2 ASN 33 HB2 ASN 33 -0.400 11.526 -2.318 279 HB3 ASN 33 HB1 ASN 33 0.579 12.352 -1.122 280 HD21 ASN 33 HD21 ASN 33 2.233 13.597 -1.751 281 HD22 ASN 33 HD22 ASN 33 2.615 13.939 -3.398 282 H CYS 34 HN CYS 34 2.435 8.281 -1.395 283 HA CYS 34 HA CYS 34 4.598 8.854 -3.278 284 HB2 CYS 34 HB2 CYS 34 4.795 8.094 -0.486 285 HB3 CYS 34 HB1 CYS 34 5.544 6.902 -1.506 286 H ALA 35 HN ALA 35 5.523 6.499 -3.858 287 HA ALA 35 HA ALA 35 3.463 5.055 -5.099 288 HB1 ALA 35 HB1 ALA 35 5.793 4.899 -5.821 289 HB2 ALA 35 HB2 ALA 35 5.129 3.301 -5.473 290 HB3 ALA 35 HB3 ALA 35 6.211 4.080 -4.317 291 H LEU 36 HN LEU 36 2.635 2.928 -4.617 292 HA LEU 36 HA LEU 36 1.944 2.536 -1.911 293 HB2 LEU 36 HB2 LEU 36 1.554 1.037 -4.472 294 HB3 LEU 36 HB1 LEU 36 1.156 0.294 -2.952 295 HG LEU 36 HG LEU 36 -0.853 1.188 -3.883 296 HD11 LEU 36 HD11 LEU 36 -0.568 1.418 -1.455 297 HD12 LEU 36 HD12 LEU 36 -1.590 2.680 -2.138 298 HD13 LEU 36 HD13 LEU 36 0.078 3.040 -1.700 299 HD21 LEU 36 HD21 LEU 36 0.596 3.827 -4.057 300 HD22 LEU 36 HD22 LEU 36 -1.111 3.565 -4.412 301 HD23 LEU 36 HD23 LEU 36 0.124 2.804 -5.414 302 H GLN 37 HN GLN 37 3.365 1.860 -0.456 303 HA GLN 37 HA GLN 37 5.736 0.474 -1.357 304 HB2 GLN 37 HB2 GLN 37 5.098 1.425 1.427 305 HB3 GLN 37 HB1 GLN 37 6.681 1.004 0.777 306 HG2 GLN 37 HG2 GLN 37 6.445 2.849 -0.849 307 HG3 GLN 37 HG1 GLN 37 4.946 3.306 -0.055 308 HE21 GLN 37 HE21 GLN 37 7.113 4.966 -0.395 309 HE22 GLN 37 HE22 GLN 37 7.810 5.338 1.145 310 H ILE 38 HN ILE 38 6.000 -1.600 -1.253 311 HA ILE 38 HA ILE 38 3.939 -3.246 -0.040 312 HB ILE 38 HB ILE 38 6.279 -4.341 -1.558 313 HG12 ILE 38 HG12 ILE 38 5.500 -2.397 -2.880 314 HG13 ILE 38 HG11 ILE 38 5.200 -3.925 -3.696 315 HG21 ILE 38 HG21 ILE 38 4.150 -5.649 -2.484 316 HG22 ILE 38 HG22 ILE 38 3.512 -5.157 -0.912 317 HG23 ILE 38 HG23 ILE 38 5.003 -6.116 -1.013 318 HD11 ILE 38 HD11 ILE 38 3.341 -2.419 -3.967 319 HD12 ILE 38 HD12 ILE 38 3.176 -2.265 -2.218 320 HD13 ILE 38 HD13 ILE 38 2.858 -3.815 -3.002 321 H VAL 39 HN VAL 39 4.350 -3.458 2.170 322 HA VAL 39 HA VAL 39 7.122 -3.968 2.959 323 HB VAL 39 HB VAL 39 5.604 -2.223 4.159 324 HG11 VAL 39 HG11 VAL 39 4.428 -3.043 6.117 325 HG12 VAL 39 HG12 VAL 39 4.704 -4.703 5.590 326 HG13 VAL 39 HG13 VAL 39 3.698 -3.625 4.621 327 HG21 VAL 39 HG21 VAL 39 7.289 -4.227 5.662 328 HG22 VAL 39 HG22 VAL 39 6.819 -2.637 6.269 329 HG23 VAL 39 HG23 VAL 39 7.852 -2.765 4.846 330 H ALA 40 HN ALA 40 7.804 -5.894 3.359 331 HA ALA 40 HA ALA 40 5.836 -8.067 3.633 332 HB1 ALA 40 HB1 ALA 40 6.845 -7.757 1.344 333 HB2 ALA 40 HB2 ALA 40 7.046 -9.352 2.058 334 HB3 ALA 40 HB3 ALA 40 8.392 -8.212 2.056 335 H ARG 41 HN ARG 41 6.395 -9.747 5.005 336 HA ARG 41 HA ARG 41 9.026 -9.536 6.290 337 HB2 ARG 41 HB2 ARG 41 6.415 -10.764 7.084 338 HB3 ARG 41 HB1 ARG 41 7.910 -11.445 7.734 339 HG2 ARG 41 HG2 ARG 41 7.738 -8.524 7.870 340 HG3 ARG 41 HG1 ARG 41 6.553 -9.377 8.836 341 HD2 ARG 41 HD2 ARG 41 8.299 -10.616 9.959 342 HD3 ARG 41 HD1 ARG 41 9.518 -9.867 8.930 343 HE ARG 41 HE ARG 41 7.925 -7.965 10.381 344 HH11 ARG 41 HH11 ARG 41 10.704 -10.088 10.633 345 HH12 ARG 41 HH12 ARG 41 11.489 -9.113 11.842 346 HH21 ARG 41 HH21 ARG 41 8.966 -6.691 11.972 347 HH22 ARG 41 HH22 ARG 41 10.504 -7.191 12.594 348 H LEU 42 HN LEU 42 10.591 -10.828 5.644 349 HA LEU 42 HA LEU 42 10.125 -12.560 3.436 350 HB2 LEU 42 HB2 LEU 42 12.542 -11.959 5.109 351 HB3 LEU 42 HB1 LEU 42 12.586 -13.155 3.829 352 HG LEU 42 HG LEU 42 11.805 -10.280 3.385 353 HD11 LEU 42 HD11 LEU 42 14.140 -10.494 4.202 354 HD12 LEU 42 HD12 LEU 42 14.031 -9.900 2.545 355 HD13 LEU 42 HD13 LEU 42 14.472 -11.578 2.853 356 HD21 LEU 42 HD21 LEU 42 12.591 -12.489 1.487 357 HD22 LEU 42 HD22 LEU 42 12.241 -10.822 1.036 358 HD23 LEU 42 HD23 LEU 42 10.967 -11.836 1.709 359 H LYS 43 HN LYS 43 10.197 -14.692 3.237 360 HA LYS 43 HA LYS 43 9.305 -16.242 5.423 361 HB2 LYS 43 HB2 LYS 43 8.479 -16.863 3.322 362 HB3 LYS 43 HB1 LYS 43 10.072 -16.829 2.595 363 HG2 LYS 43 HG2 LYS 43 10.672 -18.837 3.909 364 HG3 LYS 43 HG1 LYS 43 9.010 -18.894 4.503 365 HD2 LYS 43 HD2 LYS 43 8.162 -19.236 2.294 366 HD3 LYS 43 HD1 LYS 43 9.749 -18.942 1.581 367 HE2 LYS 43 HE2 LYS 43 10.605 -20.946 2.720 368 HE3 LYS 43 HE1 LYS 43 8.998 -21.246 3.380 369 HZ1 LYS 43 HZ1 LYS 43 9.438 -22.574 1.403 370 HZ2 LYS 43 HZ2 LYS 43 9.674 -21.174 0.490 371 HZ3 LYS 43 HZ3 LYS 43 8.152 -21.507 1.147 372 H ASN 44 HN ASN 44 12.351 -16.080 3.637 373 HA ASN 44 HA ASN 44 13.559 -18.116 5.288 374 HB2 ASN 44 HB2 ASN 44 14.663 -16.380 3.101 375 HB3 ASN 44 HB1 ASN 44 15.625 -17.565 3.967 376 HD21 ASN 44 HD21 ASN 44 13.181 -17.034 1.579 377 HD22 ASN 44 HD22 ASN 44 13.072 -18.671 1.027 378 H ASN 45 HN ASN 45 13.991 -14.643 4.759 379 HA ASN 45 HA ASN 45 16.079 -14.439 6.699 380 HB2 ASN 45 HB2 ASN 45 15.832 -13.018 4.631 381 HB3 ASN 45 HB1 ASN 45 14.513 -12.204 5.442 382 HD21 ASN 45 HD21 ASN 45 17.055 -11.194 4.437 383 HD22 ASN 45 HD22 ASN 45 17.825 -10.428 5.782 384 H ASN 46 HN ASN 46 12.624 -13.977 6.694 385 HA ASN 46 HA ASN 46 11.110 -13.714 8.367 386 HB2 ASN 46 HB2 ASN 46 12.384 -15.188 9.780 387 HB3 ASN 46 HB1 ASN 46 13.540 -13.921 10.147 388 HD21 ASN 46 HD21 ASN 46 10.357 -15.171 10.781 389 HD22 ASN 46 HD22 ASN 46 10.050 -14.220 12.191 390 H ARG 47 HN ARG 47 13.448 -11.526 7.549 391 HA ARG 47 HA ARG 47 12.826 -9.433 9.400 392 HB2 ARG 47 HB2 ARG 47 14.450 -8.173 8.306 393 HB3 ARG 47 HB1 ARG 47 15.010 -9.813 8.007 394 HG2 ARG 47 HG2 ARG 47 14.225 -9.800 5.807 395 HG3 ARG 47 HG1 ARG 47 13.298 -8.324 6.054 396 HD2 ARG 47 HD2 ARG 47 16.294 -8.479 6.263 397 HD3 ARG 47 HD1 ARG 47 15.439 -8.070 4.777 398 HE ARG 47 HE ARG 47 14.734 -6.446 7.059 399 HH11 ARG 47 HH11 ARG 47 16.848 -6.805 4.297 400 HH12 ARG 47 HH12 ARG 47 17.242 -5.116 4.218 401 HH21 ARG 47 HH21 ARG 47 15.252 -4.228 6.968 402 HH22 ARG 47 HH22 ARG 47 16.337 -3.650 5.740 403 H GLN 48 HN GLN 48 11.901 -7.447 8.831 404 HA GLN 48 HA GLN 48 9.820 -7.589 6.821 405 HB2 GLN 48 HB2 GLN 48 9.355 -6.637 9.065 406 HB3 GLN 48 HB1 GLN 48 10.488 -5.338 8.723 407 HG2 GLN 48 HG2 GLN 48 9.132 -4.525 6.952 408 HG3 GLN 48 HG1 GLN 48 8.066 -5.926 7.058 409 HE21 GLN 48 HE21 GLN 48 6.597 -6.066 8.730 410 HE22 GLN 48 HE22 GLN 48 6.180 -4.711 9.716 411 H VAL 49 HN VAL 49 9.943 -6.587 4.913 412 HA VAL 49 HA VAL 49 12.079 -4.682 4.315 413 HB VAL 49 HB VAL 49 13.029 -6.963 3.929 414 HG11 VAL 49 HG11 VAL 49 10.984 -8.136 3.364 415 HG12 VAL 49 HG12 VAL 49 12.183 -8.332 2.087 416 HG13 VAL 49 HG13 VAL 49 10.843 -7.206 1.873 417 HG21 VAL 49 HG21 VAL 49 13.845 -6.579 1.643 418 HG22 VAL 49 HG22 VAL 49 13.866 -5.098 2.603 419 HG23 VAL 49 HG23 VAL 49 12.592 -5.358 1.410 420 H CYS 50 HN CYS 50 11.711 -3.815 2.005 421 HA CYS 50 HA CYS 50 8.858 -3.940 1.394 422 HB2 CYS 50 HB2 CYS 50 10.939 -1.846 0.833 423 HB3 CYS 50 HB1 CYS 50 9.400 -1.875 -0.004 424 H ILE 51 HN ILE 51 8.170 -4.766 -0.423 425 HA ILE 51 HA ILE 51 10.052 -5.906 -2.310 426 HB ILE 51 HB ILE 51 7.131 -5.877 -2.907 427 HG12 ILE 51 HG12 ILE 51 8.328 -7.576 -0.700 428 HG13 ILE 51 HG11 ILE 51 7.122 -6.310 -0.488 429 HG21 ILE 51 HG21 ILE 51 8.918 -8.264 -2.904 430 HG22 ILE 51 HG22 ILE 51 9.097 -7.046 -4.164 431 HG23 ILE 51 HG23 ILE 51 7.557 -7.882 -3.957 432 HD11 ILE 51 HD11 ILE 51 5.547 -7.629 -1.862 433 HD12 ILE 51 HD12 ILE 51 6.066 -8.474 -0.406 434 HD13 ILE 51 HD13 ILE 51 6.754 -8.907 -1.966 435 H ASP 52 HN ASP 52 10.378 -5.186 -4.369 436 HA ASP 52 HA ASP 52 9.916 -2.454 -4.934 437 HB2 ASP 52 HB2 ASP 52 11.843 -3.692 -5.816 438 HB3 ASP 52 HB1 ASP 52 10.767 -4.707 -6.760 439 HA PRO 53 HA PRO 53 5.677 -2.851 -6.341 440 HB2 PRO 53 HB2 PRO 53 5.544 -0.346 -7.442 441 HB3 PRO 53 HB1 PRO 53 5.316 -0.689 -5.726 442 HG2 PRO 53 HG2 PRO 53 7.761 0.275 -7.150 443 HG3 PRO 53 HG1 PRO 53 7.078 0.813 -5.603 444 HD2 PRO 53 HD2 PRO 53 9.161 -0.843 -5.681 445 HD3 PRO 53 HD1 PRO 53 7.892 -1.037 -4.460 446 H LYS 54 HN LYS 54 8.484 -2.390 -8.181 447 HA LYS 54 HA LYS 54 7.158 -2.220 -10.752 448 HB2 LYS 54 HB2 LYS 54 9.993 -2.104 -9.856 449 HB3 LYS 54 HB1 LYS 54 9.580 -2.290 -11.562 450 HG2 LYS 54 HG2 LYS 54 8.196 -0.286 -11.419 451 HG3 LYS 54 HG1 LYS 54 8.672 -0.095 -9.734 452 HD2 LYS 54 HD2 LYS 54 10.592 -0.130 -12.047 453 HD3 LYS 54 HD1 LYS 54 9.896 1.308 -11.325 454 HE2 LYS 54 HE2 LYS 54 11.967 1.137 -10.293 455 HE3 LYS 54 HE1 LYS 54 10.826 0.474 -9.136 456 HZ1 LYS 54 HZ1 LYS 54 11.512 -1.716 -9.620 457 HZ2 LYS 54 HZ2 LYS 54 12.933 -0.813 -9.464 458 HZ3 LYS 54 HZ3 LYS 54 12.368 -1.229 -11.001 459 H LEU 55 HN LEU 55 8.219 -4.639 -8.658 460 HA LEU 55 HA LEU 55 9.095 -6.658 -10.366 461 HB2 LEU 55 HB2 LEU 55 7.783 -6.512 -7.693 462 HB3 LEU 55 HB1 LEU 55 7.994 -8.084 -8.437 463 HG LEU 55 HG LEU 55 10.290 -6.173 -8.050 464 HD11 LEU 55 HD11 LEU 55 9.375 -6.502 -5.873 465 HD12 LEU 55 HD12 LEU 55 10.835 -7.483 -6.019 466 HD13 LEU 55 HD13 LEU 55 9.245 -8.243 -6.131 467 HD21 LEU 55 HD21 LEU 55 11.589 -8.269 -8.145 468 HD22 LEU 55 HD22 LEU 55 10.678 -7.949 -9.619 469 HD23 LEU 55 HD23 LEU 55 10.093 -9.149 -8.469 470 H LYS 56 HN LYS 56 8.056 -8.067 -11.664 471 HA LYS 56 HA LYS 56 5.578 -7.227 -12.707 472 HB2 LYS 56 HB2 LYS 56 7.197 -9.715 -13.223 473 HB3 LYS 56 HB1 LYS 56 5.751 -9.285 -14.127 474 HG2 LYS 56 HG2 LYS 56 8.271 -7.643 -13.957 475 HG3 LYS 56 HG1 LYS 56 7.783 -8.651 -15.320 476 HD2 LYS 56 HD2 LYS 56 5.791 -7.265 -15.636 477 HD3 LYS 56 HD1 LYS 56 6.261 -6.268 -14.258 478 HE2 LYS 56 HE2 LYS 56 8.309 -5.624 -15.430 479 HE3 LYS 56 HE1 LYS 56 7.833 -6.613 -16.807 480 HZ1 LYS 56 HZ1 LYS 56 7.313 -4.261 -17.125 481 HZ2 LYS 56 HZ2 LYS 56 6.305 -4.288 -15.770 482 HZ3 LYS 56 HZ3 LYS 56 5.914 -5.207 -17.132 483 H TRP 57 HN TRP 57 6.397 -9.647 -10.318 484 HA TRP 57 HA TRP 57 3.713 -10.734 -10.381 485 HB2 TRP 57 HB2 TRP 57 4.389 -12.221 -8.686 486 HB3 TRP 57 HB1 TRP 57 5.795 -12.048 -9.709 487 HD1 TRP 57 HD1 TRP 57 7.961 -11.069 -8.615 488 HE1 TRP 57 HE1 TRP 57 8.654 -10.594 -6.174 489 HE3 TRP 57 HE3 TRP 57 3.359 -11.308 -6.436 490 HZ2 TRP 57 HZ2 TRP 57 7.387 -10.351 -3.662 491 HZ3 TRP 57 HZ3 TRP 57 3.172 -10.926 -4.018 492 HH2 TRP 57 HH2 TRP 57 5.147 -10.466 -2.654 493 H ILE 58 HN ILE 58 5.444 -8.220 -8.866 494 HA ILE 58 HA ILE 58 3.631 -7.772 -6.692 495 HB ILE 58 HB ILE 58 5.907 -6.223 -7.884 496 HG12 ILE 58 HG12 ILE 58 6.355 -8.165 -6.412 497 HG13 ILE 58 HG11 ILE 58 6.950 -6.648 -5.743 498 HG21 ILE 58 HG21 ILE 58 4.021 -5.320 -5.734 499 HG22 ILE 58 HG22 ILE 58 4.363 -4.527 -7.275 500 HG23 ILE 58 HG23 ILE 58 5.608 -4.611 -6.020 501 HD11 ILE 58 HD11 ILE 58 5.802 -8.208 -4.146 502 HD12 ILE 58 HD12 ILE 58 4.305 -7.822 -4.983 503 HD13 ILE 58 HD13 ILE 58 5.212 -6.550 -4.172 504 H GLN 59 HN GLN 59 4.125 -6.358 -9.906 505 HA GLN 59 HA GLN 59 2.253 -4.318 -9.844 506 HB2 GLN 59 HB2 GLN 59 3.154 -6.175 -11.995 507 HB3 GLN 59 HB1 GLN 59 1.955 -4.937 -12.332 508 HG2 GLN 59 HG2 GLN 59 4.660 -4.363 -11.169 509 HG3 GLN 59 HG1 GLN 59 4.326 -4.352 -12.901 510 HE21 GLN 59 HE21 GLN 59 3.927 -2.687 -9.899 511 HE22 GLN 59 HE22 GLN 59 3.220 -1.246 -10.549 512 H GLU 60 HN GLU 60 1.815 -7.738 -10.243 513 HA GLU 60 HA GLU 60 -0.957 -7.702 -10.830 514 HB2 GLU 60 HB2 GLU 60 0.635 -9.876 -9.454 515 HB3 GLU 60 HB1 GLU 60 -0.923 -10.070 -10.239 516 HG2 GLU 60 HG2 GLU 60 1.624 -9.285 -11.624 517 HG3 GLU 60 HG1 GLU 60 0.952 -10.915 -11.583 518 H TYR 61 HN TYR 61 0.892 -7.881 -7.840 519 HA TYR 61 HA TYR 61 -1.390 -8.240 -6.149 520 HB2 TYR 61 HB2 TYR 61 0.856 -9.017 -5.484 521 HB3 TYR 61 HB1 TYR 61 1.445 -7.364 -5.507 522 HD1 TYR 61 HD1 TYR 61 0.061 -9.918 -3.510 523 HD2 TYR 61 HD2 TYR 61 0.280 -5.705 -3.925 524 HE1 TYR 61 HE1 TYR 61 -0.550 -9.651 -1.162 525 HE2 TYR 61 HE2 TYR 61 -0.362 -5.433 -1.567 526 HH TYR 61 HH TYR 61 -1.520 -6.695 0.188 527 H LEU 62 HN LEU 62 0.541 -5.649 -7.352 528 HA LEU 62 HA LEU 62 -0.223 -3.475 -5.865 529 HB2 LEU 62 HB2 LEU 62 1.033 -4.045 -8.346 530 HB3 LEU 62 HB1 LEU 62 -0.067 -2.691 -8.575 531 HG LEU 62 HG LEU 62 2.234 -1.974 -8.074 532 HD11 LEU 62 HD11 LEU 62 0.304 -1.333 -5.857 533 HD12 LEU 62 HD12 LEU 62 0.352 -0.548 -7.434 534 HD13 LEU 62 HD13 LEU 62 1.712 -0.381 -6.326 535 HD21 LEU 62 HD21 LEU 62 3.294 -2.410 -6.032 536 HD22 LEU 62 HD22 LEU 62 2.683 -3.968 -6.605 537 HD23 LEU 62 HD23 LEU 62 1.829 -3.099 -5.332 538 H GLU 63 HN GLU 63 -1.813 -4.932 -8.653 539 HA GLU 63 HA GLU 63 -3.829 -3.113 -9.067 540 HB2 GLU 63 HB2 GLU 63 -3.886 -6.102 -9.250 541 HB3 GLU 63 HB1 GLU 63 -5.123 -5.049 -9.903 542 HG2 GLU 63 HG2 GLU 63 -3.352 -3.926 -11.218 543 HG3 GLU 63 HG1 GLU 63 -2.251 -5.185 -10.697 544 H LYS 64 HN LYS 64 -3.688 -5.734 -6.755 545 HA LYS 64 HA LYS 64 -6.301 -5.351 -5.673 546 HB2 LYS 64 HB2 LYS 64 -3.872 -6.727 -4.545 547 HB3 LYS 64 HB1 LYS 64 -5.458 -6.761 -3.791 548 HG2 LYS 64 HG2 LYS 64 -5.473 -8.755 -4.912 549 HG3 LYS 64 HG1 LYS 64 -6.209 -7.690 -6.109 550 HD2 LYS 64 HD2 LYS 64 -4.086 -7.451 -7.245 551 HD3 LYS 64 HD1 LYS 64 -3.304 -8.457 -6.024 552 HE2 LYS 64 HE2 LYS 64 -5.510 -9.336 -7.882 553 HE3 LYS 64 HE1 LYS 64 -3.798 -9.718 -8.068 554 HZ1 LYS 64 HZ1 LYS 64 -3.869 -10.909 -5.971 555 HZ2 LYS 64 HZ2 LYS 64 -5.011 -11.539 -7.045 556 HZ3 LYS 64 HZ3 LYS 64 -5.506 -10.536 -5.780 557 H ALA 65 HN ALA 65 -3.051 -4.400 -4.787 558 HA ALA 65 HA ALA 65 -3.573 -3.210 -2.316 559 HB1 ALA 65 HB1 ALA 65 -1.462 -2.490 -4.339 560 HB2 ALA 65 HB2 ALA 65 -1.336 -3.779 -3.142 561 HB3 ALA 65 HB3 ALA 65 -1.430 -2.095 -2.620 562 H LEU 66 HN LEU 66 -4.061 -2.112 -5.543 563 HA LEU 66 HA LEU 66 -4.508 0.647 -4.699 564 HB2 LEU 66 HB2 LEU 66 -4.298 -0.741 -7.312 565 HB3 LEU 66 HB1 LEU 66 -5.269 0.716 -7.260 566 HG LEU 66 HG LEU 66 -2.992 1.168 -7.984 567 HD11 LEU 66 HD11 LEU 66 -3.559 2.298 -5.248 568 HD12 LEU 66 HD12 LEU 66 -4.232 2.896 -6.765 569 HD13 LEU 66 HD13 LEU 66 -2.497 2.998 -6.468 570 HD21 LEU 66 HD21 LEU 66 -1.822 -0.589 -6.867 571 HD22 LEU 66 HD22 LEU 66 -2.265 0.060 -5.289 572 HD23 LEU 66 HD23 LEU 66 -1.151 0.957 -6.329 573 H ASN 67 HN ASN 67 -6.277 -2.178 -5.482 574 HA ASN 67 HA ASN 67 -8.780 -0.788 -5.778 575 HB2 ASN 67 HB2 ASN 67 -7.891 -3.567 -6.127 576 HB3 ASN 67 HB1 ASN 67 -9.576 -3.317 -5.750 577 HD21 ASN 67 HD21 ASN 67 -7.060 -2.816 -8.079 578 HD22 ASN 67 HD22 ASN 67 -8.099 -2.354 -9.385 579 H LYS 68 HN LYS 68 -7.075 -2.460 -3.307 580 HA LYS 68 HA LYS 68 -9.392 -2.136 -1.521 581 HB2 LYS 68 HB2 LYS 68 -7.441 -4.440 -1.616 582 HB3 LYS 68 HB1 LYS 68 -8.608 -4.188 -0.325 583 HG2 LYS 68 HG2 LYS 68 -9.293 -4.620 -3.227 584 HG3 LYS 68 HG1 LYS 68 -9.356 -5.852 -1.969 585 HD2 LYS 68 HD2 LYS 68 -10.957 -3.295 -1.946 586 HD3 LYS 68 HD1 LYS 68 -11.567 -4.854 -2.492 587 HE2 LYS 68 HE2 LYS 68 -10.484 -4.321 0.267 588 HE3 LYS 68 HE1 LYS 68 -12.192 -4.259 -0.157 589 HZ1 LYS 68 HZ1 LYS 68 -11.598 -6.390 0.807 590 HZ2 LYS 68 HZ2 LYS 68 -10.437 -6.642 -0.399 591 HZ3 LYS 68 HZ3 LYS 68 -12.077 -6.582 -0.808 592 H GLY 69 HN GLY 69 -8.980 -1.531 0.579 593 HA2 GLY 69 HA2 GLY 69 -6.816 -1.545 2.121 594 HA3 GLY 69 HA1 GLY 69 -6.412 -0.240 1.013 595 H ARG 70 HN ARG 70 -8.669 1.111 0.656 596 HA ARG 70 HA ARG 70 -9.326 2.031 3.373 597 HB2 ARG 70 HB2 ARG 70 -9.432 3.594 0.787 598 HB3 ARG 70 HB1 ARG 70 -9.725 4.227 2.400 599 HG2 ARG 70 HG2 ARG 70 -7.412 3.781 3.008 600 HG3 ARG 70 HG1 ARG 70 -7.113 3.115 1.401 601 HD2 ARG 70 HD2 ARG 70 -7.720 5.302 0.424 602 HD3 ARG 70 HD1 ARG 70 -7.911 5.949 2.054 603 HE ARG 70 HE ARG 70 -5.333 4.753 1.536 604 HH11 ARG 70 HH11 ARG 70 -7.236 7.688 1.372 605 HH12 ARG 70 HH12 ARG 70 -5.857 8.735 1.429 606 HH21 ARG 70 HH21 ARG 70 -3.524 6.124 1.597 607 HH22 ARG 70 HH22 ARG 70 -3.737 7.844 1.573 608 H ARG 71 HN ARG 71 -11.413 2.441 3.932 609 HA ARG 71 HA ARG 71 -13.653 2.228 4.011 610 HB2 ARG 71 HB2 ARG 71 -13.419 2.688 1.042 611 HB3 ARG 71 HB1 ARG 71 -14.943 2.653 1.916 612 HG2 ARG 71 HG2 ARG 71 -14.009 4.519 3.345 613 HG3 ARG 71 HG1 ARG 71 -12.711 4.643 2.157 614 HD2 ARG 71 HD2 ARG 71 -14.465 6.238 1.647 615 HD3 ARG 71 HD1 ARG 71 -14.386 4.999 0.394 616 HE ARG 71 HE ARG 71 -16.351 4.815 2.574 617 HH11 ARG 71 HH11 ARG 71 -15.613 5.030 -0.838 618 HH12 ARG 71 HH12 ARG 71 -17.226 4.644 -1.339 619 HH21 ARG 71 HH21 ARG 71 -18.477 4.305 1.919 620 HH22 ARG 71 HH22 ARG 71 -18.854 4.236 0.226 621 H GLU 72 HN GLU 72 -13.792 0.184 4.734 622 HA GLU 72 HA GLU 72 -14.338 -2.002 4.799 623 HB2 GLU 72 HB2 GLU 72 -16.395 -1.157 3.740 624 HB3 GLU 72 HB1 GLU 72 -15.679 -1.408 2.154 625 HG2 GLU 72 HG2 GLU 72 -15.497 -3.833 2.696 626 HG3 GLU 72 HG1 GLU 72 -16.388 -3.515 4.182 627 H GLU 73 HN GLU 73 -11.921 -2.228 4.436 628 HA GLU 73 HA GLU 73 -11.197 -3.515 1.967 629 HB2 GLU 73 HB2 GLU 73 -9.509 -2.322 3.325 630 HB3 GLU 73 HB1 GLU 73 -9.747 -3.482 4.624 631 HG2 GLU 73 HG2 GLU 73 -8.931 -5.275 3.194 632 HG3 GLU 73 HG1 GLU 73 -8.722 -4.133 1.868 633 H LYS 74 HN LYS 74 -12.402 -4.388 5.086 634 HA LYS 74 HA LYS 74 -12.484 -7.215 4.292 635 HB2 LYS 74 HB2 LYS 74 -11.249 -6.932 6.347 636 HB3 LYS 74 HB1 LYS 74 -12.519 -5.927 7.028 637 HG2 LYS 74 HG2 LYS 74 -12.523 -8.162 7.993 638 HG3 LYS 74 HG1 LYS 74 -14.017 -7.839 7.114 639 HD2 LYS 74 HD2 LYS 74 -13.195 -9.123 5.214 640 HD3 LYS 74 HD1 LYS 74 -11.668 -9.408 6.052 641 HE2 LYS 74 HE2 LYS 74 -13.176 -11.340 6.201 642 HE3 LYS 74 HE1 LYS 74 -12.821 -10.653 7.785 643 HZ1 LYS 74 HZ1 LYS 74 -14.955 -9.548 7.776 644 HZ2 LYS 74 HZ2 LYS 74 -15.174 -11.206 7.510 645 HZ3 LYS 74 HZ3 LYS 74 -15.290 -10.125 6.216 646 H VAL 75 HN VAL 75 -14.389 -7.701 3.446 647 HA VAL 75 HA VAL 75 -16.804 -6.282 4.220 648 HB VAL 75 HB VAL 75 -16.529 -8.618 2.317 649 HG11 VAL 75 HG11 VAL 75 -18.807 -8.216 3.101 650 HG12 VAL 75 HG12 VAL 75 -18.641 -7.830 1.388 651 HG13 VAL 75 HG13 VAL 75 -18.691 -6.534 2.583 652 HG21 VAL 75 HG21 VAL 75 -16.456 -5.667 1.697 653 HG22 VAL 75 HG22 VAL 75 -16.487 -6.970 0.509 654 HG23 VAL 75 HG23 VAL 75 -15.099 -6.787 1.582 655 H GLY 76 HN GLY 76 -18.426 -7.120 5.499 656 HA2 GLY 76 HA2 GLY 76 -18.541 -9.911 6.155 657 HA3 GLY 76 HA1 GLY 76 -17.861 -8.953 7.459 658 H LYS 77 HN LYS 77 -19.512 -6.629 6.991 659 HA LYS 77 HA LYS 77 -21.474 -5.732 7.696 660 HB2 LYS 77 HB2 LYS 77 -22.630 -8.474 7.147 661 HB3 LYS 77 HB1 LYS 77 -23.573 -7.045 7.545 662 HG2 LYS 77 HG2 LYS 77 -22.910 -5.967 5.510 663 HG3 LYS 77 HG1 LYS 77 -21.781 -7.270 5.138 664 HD2 LYS 77 HD2 LYS 77 -24.671 -7.902 5.542 665 HD3 LYS 77 HD1 LYS 77 -24.148 -7.192 4.017 666 HE2 LYS 77 HE2 LYS 77 -24.197 -9.603 3.830 667 HE3 LYS 77 HE1 LYS 77 -22.537 -9.027 3.732 668 HZ1 LYS 77 HZ1 LYS 77 -22.157 -9.724 5.982 669 HZ2 LYS 77 HZ2 LYS 77 -22.805 -11.021 5.116 670 HZ3 LYS 77 HZ3 LYS 77 -23.782 -10.151 6.184 671 H LYS 78 HN LYS 78 -22.271 -8.955 8.927 672 HA LYS 78 HA LYS 78 -21.895 -8.001 11.654 673 HB2 LYS 78 HB2 LYS 78 -22.858 -10.659 10.576 674 HB3 LYS 78 HB1 LYS 78 -22.696 -10.294 12.285 675 HG2 LYS 78 HG2 LYS 78 -24.335 -8.467 12.013 676 HG3 LYS 78 HG1 LYS 78 -24.541 -8.944 10.326 677 HD2 LYS 78 HD2 LYS 78 -25.333 -11.130 11.005 678 HD3 LYS 78 HD1 LYS 78 -25.036 -10.738 12.700 679 HE2 LYS 78 HE2 LYS 78 -27.392 -10.510 12.202 680 HE3 LYS 78 HE1 LYS 78 -26.695 -8.929 12.551 681 HZ1 LYS 78 HZ1 LYS 78 -28.172 -8.858 10.644 682 HZ2 LYS 78 HZ2 LYS 78 -27.233 -10.010 9.841 683 HZ3 LYS 78 HZ3 LYS 78 -26.589 -8.487 10.187 684 H GLU 79 HN GLU 79 -19.658 -7.640 11.353 685 HA GLU 79 HA GLU 79 -17.849 -9.501 10.331 686 HB2 GLU 79 HB2 GLU 79 -17.491 -7.047 10.548 687 HB3 GLU 79 HB1 GLU 79 -17.272 -7.271 12.277 688 HG2 GLU 79 HG2 GLU 79 -15.167 -7.080 10.955 689 HG3 GLU 79 HG1 GLU 79 -15.293 -8.527 11.956 690 H LYS 80 HN LYS 80 -16.409 -10.888 11.238 691 HA LYS 80 HA LYS 80 -16.818 -11.569 14.076 692 HB2 LYS 80 HB2 LYS 80 -16.509 -13.514 11.779 693 HB3 LYS 80 HB1 LYS 80 -16.629 -13.948 13.478 694 HG2 LYS 80 HG2 LYS 80 -18.883 -13.119 13.584 695 HG3 LYS 80 HG1 LYS 80 -18.771 -12.507 11.933 696 HD2 LYS 80 HD2 LYS 80 -18.521 -14.770 11.089 697 HD3 LYS 80 HD1 LYS 80 -18.557 -15.405 12.734 698 HE2 LYS 80 HE2 LYS 80 -20.794 -13.898 11.389 699 HE3 LYS 80 HE1 LYS 80 -20.721 -15.648 11.586 700 HZ1 LYS 80 HZ1 LYS 80 -20.649 -15.270 14.015 701 HZ2 LYS 80 HZ2 LYS 80 -22.083 -14.736 13.299 702 HZ3 LYS 80 HZ3 LYS 80 -20.896 -13.619 13.746 703 H ILE 81 HN ILE 81 -14.692 -11.158 11.382 704 HA ILE 81 HA ILE 81 -12.405 -12.252 12.851 705 HB ILE 81 HB ILE 81 -12.626 -11.275 9.993 706 HG12 ILE 81 HG12 ILE 81 -12.017 -13.760 9.587 707 HG13 ILE 81 HG11 ILE 81 -12.534 -14.011 11.249 708 HG21 ILE 81 HG21 ILE 81 -10.259 -12.487 11.414 709 HG22 ILE 81 HG22 ILE 81 -10.402 -10.823 10.846 710 HG23 ILE 81 HG23 ILE 81 -10.355 -12.151 9.686 711 HD11 ILE 81 HD11 ILE 81 -14.219 -12.930 9.001 712 HD12 ILE 81 HD12 ILE 81 -14.747 -13.126 10.672 713 HD13 ILE 81 HD13 ILE 81 -14.316 -14.542 9.713 714 H GLY 82 HN GLY 82 -13.639 -9.271 11.456 715 HA2 GLY 82 HA2 GLY 82 -11.373 -7.680 12.217 716 HA3 GLY 82 HA1 GLY 82 -12.925 -7.081 11.650 717 H LYS 83 HN LYS 83 -11.515 -5.857 13.738 718 HA LYS 83 HA LYS 83 -12.801 -6.795 16.193 719 HB2 LYS 83 HB2 LYS 83 -10.377 -6.350 16.257 720 HB3 LYS 83 HB1 LYS 83 -10.676 -4.682 15.803 721 HG2 LYS 83 HG2 LYS 83 -10.250 -4.857 18.179 722 HG3 LYS 83 HG1 LYS 83 -11.907 -4.329 17.887 723 HD2 LYS 83 HD2 LYS 83 -11.845 -5.981 19.669 724 HD3 LYS 83 HD1 LYS 83 -12.691 -6.630 18.264 725 HE2 LYS 83 HE2 LYS 83 -10.690 -7.854 17.612 726 HE3 LYS 83 HE1 LYS 83 -9.811 -7.176 18.979 727 HZ1 LYS 83 HZ1 LYS 83 -12.196 -8.933 19.172 728 HZ2 LYS 83 HZ2 LYS 83 -11.322 -8.307 20.474 729 HZ3 LYS 83 HZ3 LYS 83 -10.599 -9.420 19.427 730 H LYS 84 HN LYS 84 -12.098 -3.552 14.869 731 HA LYS 84 HA LYS 84 -14.156 -2.245 16.244 732 HB2 LYS 84 HB2 LYS 84 -12.694 -1.554 13.703 733 HB3 LYS 84 HB1 LYS 84 -13.901 -0.490 14.407 734 HG2 LYS 84 HG2 LYS 84 -12.583 -0.262 16.417 735 HG3 LYS 84 HG1 LYS 84 -11.402 -1.419 15.801 736 HD2 LYS 84 HD2 LYS 84 -10.847 0.073 13.974 737 HD3 LYS 84 HD1 LYS 84 -12.093 1.209 14.491 738 HE2 LYS 84 HE2 LYS 84 -9.890 1.958 15.203 739 HE3 LYS 84 HE1 LYS 84 -10.895 1.560 16.595 740 HZ1 LYS 84 HZ1 LYS 84 -8.885 -0.276 15.421 741 HZ2 LYS 84 HZ2 LYS 84 -9.747 -0.497 16.859 742 HZ3 LYS 84 HZ3 LYS 84 -8.590 0.731 16.745 743 H LYS 85 HN LYS 85 -14.070 -3.342 12.872 744 HA LYS 85 HA LYS 85 -16.670 -4.331 12.792 745 HB2 LYS 85 HB2 LYS 85 -17.279 -1.916 13.037 746 HB3 LYS 85 HB1 LYS 85 -16.444 -1.591 11.528 747 HG2 LYS 85 HG2 LYS 85 -18.811 -1.725 11.141 748 HG3 LYS 85 HG1 LYS 85 -18.004 -3.080 10.358 749 HD2 LYS 85 HD2 LYS 85 -19.982 -3.924 11.380 750 HD3 LYS 85 HD1 LYS 85 -18.620 -4.479 12.348 751 HE2 LYS 85 HE2 LYS 85 -20.043 -1.954 13.083 752 HE3 LYS 85 HE1 LYS 85 -20.754 -3.509 13.501 753 HZ1 LYS 85 HZ1 LYS 85 -18.081 -2.514 14.347 754 HZ2 LYS 85 HZ2 LYS 85 -18.691 -4.052 14.690 755 HZ3 LYS 85 HZ3 LYS 85 -19.451 -2.683 15.323 756 H ARG 86 HN ARG 86 -14.253 -2.561 10.920 757 HA ARG 86 HA ARG 86 -14.216 -4.797 9.011 758 HB2 ARG 86 HB2 ARG 86 -14.021 -1.870 8.261 759 HB3 ARG 86 HB1 ARG 86 -13.945 -3.233 7.154 760 HG2 ARG 86 HG2 ARG 86 -16.236 -3.793 7.588 761 HG3 ARG 86 HG1 ARG 86 -16.336 -2.569 8.856 762 HD2 ARG 86 HD2 ARG 86 -15.835 -0.848 7.121 763 HD3 ARG 86 HD1 ARG 86 -15.956 -2.116 5.903 764 HE ARG 86 HE ARG 86 -18.305 -2.347 7.162 765 HH11 ARG 86 HH11 ARG 86 -16.610 0.450 5.931 766 HH12 ARG 86 HH12 ARG 86 -18.057 1.332 5.569 767 HH21 ARG 86 HH21 ARG 86 -20.222 -1.172 6.696 768 HH22 ARG 86 HH22 ARG 86 -20.101 0.418 6.016 769 H GLN 87 HN GLN 87 -12.607 -2.887 11.170 770 HA GLN 87 HA GLN 87 -9.997 -3.285 9.880 771 HB2 GLN 87 HB2 GLN 87 -10.753 -1.384 12.107 772 HB3 GLN 87 HB1 GLN 87 -9.170 -1.511 11.353 773 HG2 GLN 87 HG2 GLN 87 -10.038 -0.708 9.265 774 HG3 GLN 87 HG1 GLN 87 -11.684 -0.728 9.898 775 HE21 GLN 87 HE21 GLN 87 -12.307 0.835 11.397 776 HE22 GLN 87 HE22 GLN 87 -11.408 2.296 11.621 777 H LYS 88 HN LYS 88 -8.226 -3.898 11.271 778 HA LYS 88 HA LYS 88 -8.690 -4.867 13.917 779 HB2 LYS 88 HB2 LYS 88 -8.133 -7.227 13.461 780 HB3 LYS 88 HB1 LYS 88 -9.641 -6.757 12.701 781 HG2 LYS 88 HG2 LYS 88 -8.370 -6.446 10.570 782 HG3 LYS 88 HG1 LYS 88 -6.973 -7.154 11.378 783 HD2 LYS 88 HD2 LYS 88 -9.631 -8.557 11.200 784 HD3 LYS 88 HD1 LYS 88 -8.395 -8.714 9.957 785 HE2 LYS 88 HE2 LYS 88 -8.042 -10.570 11.313 786 HE3 LYS 88 HE1 LYS 88 -6.839 -9.418 11.878 787 HZ1 LYS 88 HZ1 LYS 88 -8.027 -10.591 13.672 788 HZ2 LYS 88 HZ2 LYS 88 -9.472 -9.857 13.185 789 HZ3 LYS 88 HZ3 LYS 88 -8.195 -8.912 13.767 790 H LYS 89 HN LYS 89 -6.626 -5.883 14.775 791 HA LYS 89 HA LYS 89 -4.558 -4.004 14.121 792 HB2 LYS 89 HB2 LYS 89 -4.752 -6.172 16.208 793 HB3 LYS 89 HB1 LYS 89 -3.362 -5.106 16.049 794 HG2 LYS 89 HG2 LYS 89 -4.754 -3.173 16.489 795 HG3 LYS 89 HG1 LYS 89 -6.189 -4.196 16.560 796 HD2 LYS 89 HD2 LYS 89 -3.827 -4.512 18.405 797 HD3 LYS 89 HD1 LYS 89 -5.233 -3.518 18.788 798 HE2 LYS 89 HE2 LYS 89 -6.673 -5.498 18.546 799 HE3 LYS 89 HE1 LYS 89 -5.247 -6.481 18.218 800 HZ1 LYS 89 HZ1 LYS 89 -5.975 -6.639 20.529 801 HZ2 LYS 89 HZ2 LYS 89 -5.733 -4.979 20.734 802 HZ3 LYS 89 HZ3 LYS 89 -4.418 -5.990 20.412 803 H ARG 90 HN ARG 90 -5.301 -6.654 12.532 804 HA ARG 90 HA ARG 90 -2.586 -7.658 12.165 805 HB2 ARG 90 HB2 ARG 90 -5.235 -8.477 10.972 806 HB3 ARG 90 HB1 ARG 90 -3.702 -9.175 10.479 807 HG2 ARG 90 HG2 ARG 90 -4.814 -9.259 13.271 808 HG3 ARG 90 HG1 ARG 90 -4.916 -10.567 12.092 809 HD2 ARG 90 HD2 ARG 90 -2.378 -9.374 13.200 810 HD3 ARG 90 HD1 ARG 90 -3.081 -10.922 13.664 811 HE ARG 90 HE ARG 90 -2.596 -10.744 10.852 812 HH11 ARG 90 HH11 ARG 90 -1.067 -11.354 13.939 813 HH12 ARG 90 HH12 ARG 90 0.169 -12.368 13.268 814 HH21 ARG 90 HH21 ARG 90 -0.968 -12.075 9.961 815 HH22 ARG 90 HH22 ARG 90 0.229 -12.777 11.001 816 H LYS 91 HN LYS 91 -4.491 -5.185 11.020 817 HA LYS 91 HA LYS 91 -3.480 -5.262 8.294 818 HB2 LYS 91 HB2 LYS 91 -5.344 -3.338 9.693 819 HB3 LYS 91 HB1 LYS 91 -4.861 -3.193 8.007 820 HG2 LYS 91 HG2 LYS 91 -5.861 -5.382 7.545 821 HG3 LYS 91 HG1 LYS 91 -6.373 -5.492 9.229 822 HD2 LYS 91 HD2 LYS 91 -7.794 -3.557 8.965 823 HD3 LYS 91 HD1 LYS 91 -7.205 -3.309 7.320 824 HE2 LYS 91 HE2 LYS 91 -8.764 -5.696 8.312 825 HE3 LYS 91 HE1 LYS 91 -9.396 -4.385 7.317 826 HZ1 LYS 91 HZ1 LYS 91 -7.299 -6.338 6.544 827 HZ2 LYS 91 HZ2 LYS 91 -7.759 -5.013 5.601 828 HZ3 LYS 91 HZ3 LYS 91 -8.872 -6.250 5.930 829 H ALA 92 HN ALA 92 -3.500 -2.865 10.941 830 HA ALA 92 HA ALA 92 -0.820 -2.040 10.086 831 HB1 ALA 92 HB1 ALA 92 -1.417 0.317 10.277 832 HB2 ALA 92 HB2 ALA 92 -3.087 -0.126 10.628 833 HB3 ALA 92 HB3 ALA 92 -2.392 -0.488 9.049 834 H ALA 93 HN ALA 93 -0.288 -3.347 11.975 835 HA ALA 93 HA ALA 93 -1.004 -2.246 14.565 836 HB1 ALA 93 HB1 ALA 93 -0.836 -4.676 14.293 837 HB2 ALA 93 HB2 ALA 93 0.315 -4.077 15.489 838 HB3 ALA 93 HB3 ALA 93 0.870 -4.509 13.871 839 H GLN 94 HN GLN 94 2.002 -2.848 12.766 840 HA GLN 94 HA GLN 94 3.321 -0.770 14.377 841 HB2 GLN 94 HB2 GLN 94 4.122 -3.319 13.969 842 HB3 GLN 94 HB1 GLN 94 4.901 -2.545 12.600 843 HG2 GLN 94 HG2 GLN 94 5.249 -1.668 15.457 844 HG3 GLN 94 HG1 GLN 94 6.328 -2.778 14.624 845 HE21 GLN 94 HE21 GLN 94 7.629 -2.001 12.953 846 HE22 GLN 94 HE22 GLN 94 7.979 -0.315 12.783 847 H LYS 95 HN LYS 95 1.513 -0.334 12.130 848 HA LYS 95 HA LYS 95 3.312 1.277 10.479 849 HB2 LYS 95 HB2 LYS 95 1.135 -0.538 9.415 850 HB3 LYS 95 HB1 LYS 95 1.944 0.698 8.461 851 HG2 LYS 95 HG2 LYS 95 3.327 -1.630 9.777 852 HG3 LYS 95 HG1 LYS 95 2.836 -1.573 8.084 853 HD2 LYS 95 HD2 LYS 95 4.344 0.216 7.627 854 HD3 LYS 95 HD1 LYS 95 4.674 0.459 9.340 855 HE2 LYS 95 HE2 LYS 95 5.351 -2.059 7.834 856 HE3 LYS 95 HE1 LYS 95 6.480 -0.730 8.090 857 HZ1 LYS 95 HZ1 LYS 95 6.251 -1.042 10.475 858 HZ2 LYS 95 HZ2 LYS 95 6.786 -2.465 9.734 859 HZ3 LYS 95 HZ3 LYS 95 5.174 -2.323 10.228 860 H ARG 96 HN ARG 96 2.437 3.229 9.812 861 HA ARG 96 HA ARG 96 0.251 4.069 11.529 862 HB2 ARG 96 HB2 ARG 96 2.134 5.676 9.801 863 HB3 ARG 96 HB1 ARG 96 0.937 6.355 10.896 864 HG2 ARG 96 HG2 ARG 96 2.076 5.257 12.781 865 HG3 ARG 96 HG1 ARG 96 3.304 4.664 11.662 866 HD2 ARG 96 HD2 ARG 96 2.657 7.550 12.245 867 HD3 ARG 96 HD1 ARG 96 4.076 6.666 12.795 868 HE ARG 96 HE ARG 96 3.611 6.933 9.917 869 HH11 ARG 96 HH11 ARG 96 5.497 7.735 12.757 870 HH12 ARG 96 HH12 ARG 96 6.798 8.433 11.847 871 HH21 ARG 96 HH21 ARG 96 5.314 7.839 8.719 872 HH22 ARG 96 HH22 ARG 96 6.705 8.481 9.542 873 H LYS 97 HN LYS 97 -1.727 4.415 10.891 874 HA LYS 97 HA LYS 97 -2.295 5.617 8.334 875 HB2 LYS 97 HB2 LYS 97 -3.776 3.971 7.488 876 HB3 LYS 97 HB1 LYS 97 -2.337 3.080 7.959 877 HG2 LYS 97 HG2 LYS 97 -3.398 2.295 9.953 878 HG3 LYS 97 HG1 LYS 97 -4.796 3.333 9.674 879 HD2 LYS 97 HD2 LYS 97 -5.100 2.063 7.487 880 HD3 LYS 97 HD1 LYS 97 -3.935 0.902 8.127 881 HE2 LYS 97 HE2 LYS 97 -6.157 0.115 8.604 882 HE3 LYS 97 HE1 LYS 97 -5.392 0.611 10.114 883 HZ1 LYS 97 HZ1 LYS 97 -6.600 2.713 9.978 884 HZ2 LYS 97 HZ2 LYS 97 -7.667 1.402 9.994 885 HZ3 LYS 97 HZ3 LYS 97 -7.342 2.210 8.547 886 H ASN 98 HN ASN 98 -4.902 5.782 8.275 887 HA ASN 98 HA ASN 98 -5.702 6.912 10.815 888 HB2 ASN 98 HB2 ASN 98 -6.320 7.942 8.604 889 HB3 ASN 98 HB1 ASN 98 -7.354 6.552 8.300 890 HD21 ASN 98 HD21 ASN 98 -8.036 9.355 8.500 891 HD22 ASN 98 HD22 ASN 98 -9.215 9.481 9.760 Start of MODEL 12 1 H1 LYS 1 HT1 LYS 1 18.916 3.201 -8.187 2 H2 LYS 1 HT2 LYS 1 17.723 2.727 -7.092 3 H3 LYS 1 HT3 LYS 1 19.350 2.470 -6.724 4 HA LYS 1 HA LYS 1 18.557 4.323 -5.474 5 HB2 LYS 1 HB2 LYS 1 20.443 4.916 -7.737 6 HB3 LYS 1 HB1 LYS 1 20.007 6.173 -6.593 7 HG2 LYS 1 HG2 LYS 1 21.994 5.338 -5.752 8 HG3 LYS 1 HG1 LYS 1 20.770 4.516 -4.787 9 HD2 LYS 1 HD2 LYS 1 20.977 2.541 -6.227 10 HD3 LYS 1 HD1 LYS 1 22.209 3.368 -7.179 11 HE2 LYS 1 HE2 LYS 1 23.259 1.872 -5.590 12 HE3 LYS 1 HE1 LYS 1 23.614 3.545 -5.165 13 HZ1 LYS 1 HZ1 LYS 1 21.559 1.821 -3.890 14 HZ2 LYS 1 HZ2 LYS 1 21.855 3.436 -3.491 15 HZ3 LYS 1 HZ3 LYS 1 23.042 2.267 -3.212 16 HA PRO 2 HA PRO 2 15.070 6.485 -7.266 17 HB2 PRO 2 HB2 PRO 2 15.664 8.343 -5.020 18 HB3 PRO 2 HB1 PRO 2 14.141 7.563 -5.461 19 HG2 PRO 2 HG2 PRO 2 15.519 6.702 -3.366 20 HG3 PRO 2 HG1 PRO 2 14.732 5.552 -4.467 21 HD2 PRO 2 HD2 PRO 2 17.621 6.329 -4.291 22 HD3 PRO 2 HD1 PRO 2 16.898 4.725 -4.533 23 H VAL 3 HN VAL 3 14.840 8.203 -8.605 24 HA VAL 3 HA VAL 3 17.254 9.793 -9.102 25 HB VAL 3 HB VAL 3 14.784 9.488 -10.825 26 HG11 VAL 3 HG11 VAL 3 17.459 10.743 -11.432 27 HG12 VAL 3 HG12 VAL 3 15.933 11.600 -11.213 28 HG13 VAL 3 HG13 VAL 3 16.146 10.512 -12.585 29 HG21 VAL 3 HG21 VAL 3 17.504 8.212 -11.084 30 HG22 VAL 3 HG22 VAL 3 16.187 8.073 -12.248 31 HG23 VAL 3 HG23 VAL 3 16.011 7.391 -10.631 32 H SER 4 HN SER 4 17.202 11.451 -7.681 33 HA SER 4 HA SER 4 16.606 13.404 -6.690 34 HB2 SER 4 HB2 SER 4 14.959 13.729 -9.211 35 HB3 SER 4 HB1 SER 4 15.385 15.024 -8.091 36 HG SER 4 HG SER 4 17.599 14.576 -8.557 37 H LEU 5 HN LEU 5 15.296 11.344 -5.616 38 HA LEU 5 HA LEU 5 12.570 12.368 -5.219 39 HB2 LEU 5 HB2 LEU 5 13.275 9.904 -6.330 40 HB3 LEU 5 HB1 LEU 5 12.804 9.536 -4.683 41 HG LEU 5 HG LEU 5 10.901 9.288 -6.143 42 HD11 LEU 5 HD11 LEU 5 10.470 10.134 -3.902 43 HD12 LEU 5 HD12 LEU 5 9.323 10.801 -5.063 44 HD13 LEU 5 HD13 LEU 5 10.661 11.790 -4.480 45 HD21 LEU 5 HD21 LEU 5 11.359 12.167 -6.916 46 HD22 LEU 5 HD22 LEU 5 10.001 11.161 -7.420 47 HD23 LEU 5 HD23 LEU 5 11.636 10.760 -7.942 48 H SER 6 HN SER 6 14.974 10.153 -3.796 49 HA SER 6 HA SER 6 15.318 9.464 -1.681 50 HB2 SER 6 HB2 SER 6 14.935 12.388 -1.035 51 HB3 SER 6 HB1 SER 6 15.945 11.211 -0.209 52 HG SER 6 HG SER 6 16.845 11.077 -2.573 53 H TYR 7 HN TYR 7 13.317 8.286 -1.596 54 HA TYR 7 HA TYR 7 10.889 9.377 -0.685 55 HB2 TYR 7 HB2 TYR 7 11.881 6.546 -0.409 56 HB3 TYR 7 HB1 TYR 7 10.218 7.064 -0.216 57 HD1 TYR 7 HD1 TYR 7 8.938 7.867 -2.190 58 HD2 TYR 7 HD2 TYR 7 12.807 6.138 -2.578 59 HE1 TYR 7 HE1 TYR 7 8.521 7.485 -4.582 60 HE2 TYR 7 HE2 TYR 7 12.400 5.759 -4.976 61 HH TYR 7 HH TYR 7 10.479 5.490 -6.499 62 H ARG 8 HN ARG 8 10.753 10.411 1.154 63 HA ARG 8 HA ARG 8 12.074 9.358 3.541 64 HB2 ARG 8 HB2 ARG 8 11.377 11.531 4.584 65 HB3 ARG 8 HB1 ARG 8 12.465 11.706 3.215 66 HG2 ARG 8 HG2 ARG 8 10.632 12.333 1.782 67 HG3 ARG 8 HG1 ARG 8 9.475 12.035 3.080 68 HD2 ARG 8 HD2 ARG 8 11.665 14.107 3.099 69 HD3 ARG 8 HD1 ARG 8 9.951 14.419 2.829 70 HE ARG 8 HE ARG 8 10.062 13.124 5.241 71 HH11 ARG 8 HH11 ARG 8 11.498 16.025 3.921 72 HH12 ARG 8 HH12 ARG 8 11.543 16.849 5.446 73 HH21 ARG 8 HH21 ARG 8 10.128 14.195 7.246 74 HH22 ARG 8 HH22 ARG 8 10.761 15.807 7.346 75 H CYS 9 HN CYS 9 10.178 7.823 2.612 76 HA CYS 9 HA CYS 9 7.732 8.306 4.138 77 HB2 CYS 9 HB2 CYS 9 8.218 6.391 1.859 78 HB3 CYS 9 HB1 CYS 9 6.682 6.875 2.540 79 HA PRO 10 HA PRO 10 7.965 5.038 7.089 80 HB2 PRO 10 HB2 PRO 10 6.162 3.524 5.263 81 HB3 PRO 10 HB1 PRO 10 6.082 3.699 7.016 82 HG2 PRO 10 HG2 PRO 10 4.561 5.170 5.341 83 HG3 PRO 10 HG1 PRO 10 5.129 5.769 6.898 84 HD2 PRO 10 HD2 PRO 10 5.898 6.622 4.228 85 HD3 PRO 10 HD1 PRO 10 6.246 7.387 5.783 86 H CYS 11 HN CYS 11 7.889 3.658 3.799 87 HA CYS 11 HA CYS 11 9.494 1.414 4.720 88 HB2 CYS 11 HB2 CYS 11 7.573 1.778 2.694 89 HB3 CYS 11 HB1 CYS 11 9.091 1.439 1.876 90 H ARG 12 HN ARG 12 11.458 0.854 3.999 91 HA ARG 12 HA ARG 12 13.247 2.883 3.061 92 HB2 ARG 12 HB2 ARG 12 13.536 -0.021 3.768 93 HB3 ARG 12 HB1 ARG 12 14.807 0.823 2.919 94 HG2 ARG 12 HG2 ARG 12 15.153 0.707 5.356 95 HG3 ARG 12 HG1 ARG 12 15.133 2.347 4.709 96 HD2 ARG 12 HD2 ARG 12 12.768 2.515 5.370 97 HD3 ARG 12 HD1 ARG 12 12.893 0.940 6.147 98 HE ARG 12 HE ARG 12 14.909 2.312 7.289 99 HH11 ARG 12 HH11 ARG 12 11.496 3.058 6.900 100 HH12 ARG 12 HH12 ARG 12 11.428 4.028 8.331 101 HH21 ARG 12 HH21 ARG 12 14.802 3.595 9.158 102 HH22 ARG 12 HH22 ARG 12 13.310 4.358 9.599 103 H PHE 13 HN PHE 13 14.879 1.685 1.220 104 HA PHE 13 HA PHE 13 13.218 1.963 -1.097 105 HB2 PHE 13 HB2 PHE 13 15.268 1.850 -2.387 106 HB3 PHE 13 HB1 PHE 13 15.491 2.934 -1.018 107 HD1 PHE 13 HD1 PHE 13 16.634 -0.003 -2.694 108 HD2 PHE 13 HD2 PHE 13 16.707 2.078 1.006 109 HE1 PHE 13 HE1 PHE 13 18.582 -1.300 -2.012 110 HE2 PHE 13 HE2 PHE 13 18.654 0.785 1.700 111 HZ PHE 13 HZ PHE 13 19.615 -0.915 0.196 112 H PHE 14 HN PHE 14 12.958 0.396 -2.759 113 HA PHE 14 HA PHE 14 12.153 -2.009 -1.455 114 HB2 PHE 14 HB2 PHE 14 11.722 -1.199 -4.319 115 HB3 PHE 14 HB1 PHE 14 10.764 -2.285 -3.339 116 HD1 PHE 14 HD1 PHE 14 9.296 -1.418 -1.570 117 HD2 PHE 14 HD2 PHE 14 11.401 1.161 -4.217 118 HE1 PHE 14 HE1 PHE 14 7.818 0.437 -0.930 119 HE2 PHE 14 HE2 PHE 14 9.926 3.023 -3.580 120 HZ PHE 14 HZ PHE 14 8.143 2.676 -1.945 121 H GLU 15 HN GLU 15 12.685 -4.069 -1.955 122 HA GLU 15 HA GLU 15 15.142 -4.476 -3.486 123 HB2 GLU 15 HB2 GLU 15 13.584 -6.345 -1.688 124 HB3 GLU 15 HB1 GLU 15 15.114 -6.726 -2.461 125 HG2 GLU 15 HG2 GLU 15 14.746 -4.479 -0.505 126 HG3 GLU 15 HG1 GLU 15 15.260 -6.102 -0.053 127 H SER 16 HN SER 16 15.084 -5.300 -5.475 128 HA SER 16 HA SER 16 12.544 -6.361 -6.466 129 HB2 SER 16 HB2 SER 16 13.590 -4.528 -7.742 130 HB3 SER 16 HB1 SER 16 15.027 -5.516 -7.985 131 HG SER 16 HG SER 16 12.481 -5.724 -9.136 132 H HIS 17 HN HIS 17 14.137 -7.897 -4.701 133 HA HIS 17 HA HIS 17 14.531 -10.222 -6.448 134 HB2 HIS 17 HB2 HIS 17 16.319 -9.284 -4.222 135 HB3 HIS 17 HB1 HIS 17 16.262 -10.979 -4.688 136 HD1 HIS 17 HD1 HIS 17 17.586 -11.661 -6.707 137 HD2 HIS 17 HD2 HIS 17 17.290 -7.536 -6.307 138 HE1 HIS 17 HE1 HIS 17 19.136 -10.701 -8.434 139 HE2 HIS 17 HE2 HIS 17 18.786 -8.212 -8.301 140 H ILE 18 HN ILE 18 12.708 -8.851 -4.186 141 HA ILE 18 HA ILE 18 12.317 -11.067 -2.407 142 HB ILE 18 HB ILE 18 10.669 -8.600 -2.887 143 HG12 ILE 18 HG12 ILE 18 12.494 -9.332 -0.603 144 HG13 ILE 18 HG11 ILE 18 12.930 -8.256 -1.920 145 HG21 ILE 18 HG21 ILE 18 10.363 -10.688 -0.744 146 HG22 ILE 18 HG22 ILE 18 9.235 -10.367 -2.063 147 HG23 ILE 18 HG23 ILE 18 9.495 -9.154 -0.806 148 HD11 ILE 18 HD11 ILE 18 11.238 -6.678 -1.224 149 HD12 ILE 18 HD12 ILE 18 12.319 -7.050 0.125 150 HD13 ILE 18 HD13 ILE 18 10.708 -7.776 0.050 151 H ALA 19 HN ALA 19 11.129 -12.756 -2.739 152 HA ALA 19 HA ALA 19 9.561 -12.915 -5.218 153 HB1 ALA 19 HB1 ALA 19 10.807 -15.140 -3.608 154 HB2 ALA 19 HB2 ALA 19 11.506 -14.418 -5.058 155 HB3 ALA 19 HB3 ALA 19 9.984 -15.304 -5.159 156 H ARG 20 HN ARG 20 7.575 -13.971 -5.223 157 HA ARG 20 HA ARG 20 5.893 -13.570 -3.009 158 HB2 ARG 20 HB2 ARG 20 5.478 -13.936 -5.619 159 HB3 ARG 20 HB1 ARG 20 5.189 -15.585 -5.077 160 HG2 ARG 20 HG2 ARG 20 3.414 -14.878 -3.654 161 HG3 ARG 20 HG1 ARG 20 3.786 -13.179 -3.953 162 HD2 ARG 20 HD2 ARG 20 3.383 -13.735 -6.420 163 HD3 ARG 20 HD1 ARG 20 2.612 -15.204 -5.827 164 HE ARG 20 HE ARG 20 1.353 -13.304 -4.411 165 HH11 ARG 20 HH11 ARG 20 2.009 -13.657 -7.825 166 HH12 ARG 20 HH12 ARG 20 0.621 -12.748 -8.326 167 HH21 ARG 20 HH21 ARG 20 -0.477 -12.083 -5.063 168 HH22 ARG 20 HH22 ARG 20 -0.785 -11.841 -6.754 169 H ALA 21 HN ALA 21 7.914 -16.175 -3.982 170 HA ALA 21 HA ALA 21 6.631 -18.112 -2.249 171 HB1 ALA 21 HB1 ALA 21 9.114 -18.386 -3.931 172 HB2 ALA 21 HB2 ALA 21 7.480 -18.814 -4.440 173 HB3 ALA 21 HB3 ALA 21 8.251 -19.694 -3.122 174 H ASN 22 HN ASN 22 8.992 -15.725 -1.950 175 HA ASN 22 HA ASN 22 10.111 -17.090 0.387 176 HB2 ASN 22 HB2 ASN 22 11.280 -15.228 -1.590 177 HB3 ASN 22 HB1 ASN 22 11.735 -14.955 0.078 178 HD21 ASN 22 HD21 ASN 22 13.427 -15.788 -2.057 179 HD22 ASN 22 HD22 ASN 22 14.056 -17.345 -1.642 180 H VAL 23 HN VAL 23 7.722 -15.054 -0.290 181 HA VAL 23 HA VAL 23 8.343 -13.290 1.956 182 HB VAL 23 HB VAL 23 7.753 -12.118 -0.093 183 HG11 VAL 23 HG11 VAL 23 5.102 -13.526 0.165 184 HG12 VAL 23 HG12 VAL 23 6.280 -13.737 -1.138 185 HG13 VAL 23 HG13 VAL 23 5.439 -12.193 -0.942 186 HG21 VAL 23 HG21 VAL 23 6.134 -10.627 0.837 187 HG22 VAL 23 HG22 VAL 23 7.239 -11.190 2.102 188 HG23 VAL 23 HG23 VAL 23 5.614 -11.865 1.983 189 H LYS 24 HN LYS 24 7.035 -12.974 3.577 190 HA LYS 24 HA LYS 24 4.933 -14.926 4.129 191 HB2 LYS 24 HB2 LYS 24 6.400 -13.059 6.002 192 HB3 LYS 24 HB1 LYS 24 5.188 -14.232 6.473 193 HG2 LYS 24 HG2 LYS 24 6.777 -15.951 5.399 194 HG3 LYS 24 HG1 LYS 24 7.982 -14.673 5.571 195 HD2 LYS 24 HD2 LYS 24 6.248 -15.649 7.830 196 HD3 LYS 24 HD1 LYS 24 7.855 -16.272 7.497 197 HE2 LYS 24 HE2 LYS 24 8.780 -14.027 7.774 198 HE3 LYS 24 HE1 LYS 24 7.167 -13.413 8.130 199 HZ1 LYS 24 HZ1 LYS 24 8.289 -13.773 10.178 200 HZ2 LYS 24 HZ2 LYS 24 8.753 -15.338 9.739 201 HZ3 LYS 24 HZ3 LYS 24 7.123 -14.992 10.038 202 H HIS 25 HN HIS 25 3.780 -13.352 6.160 203 HA HIS 25 HA HIS 25 1.607 -12.160 5.217 204 HB2 HIS 25 HB2 HIS 25 2.988 -10.480 7.238 205 HB3 HIS 25 HB1 HIS 25 1.338 -11.074 7.231 206 HD1 HIS 25 HD1 HIS 25 2.679 -11.088 9.813 207 HD2 HIS 25 HD2 HIS 25 3.133 -14.316 7.225 208 HE1 HIS 25 HE1 HIS 25 3.394 -13.011 11.243 209 HE2 HIS 25 HE2 HIS 25 3.362 -15.005 9.703 210 H LEU 26 HN LEU 26 1.406 -10.772 3.531 211 HA LEU 26 HA LEU 26 3.428 -8.677 3.243 212 HB2 LEU 26 HB2 LEU 26 3.156 -10.114 1.312 213 HB3 LEU 26 HB1 LEU 26 1.443 -9.749 1.236 214 HG LEU 26 HG LEU 26 1.868 -7.505 0.528 215 HD11 LEU 26 HD11 LEU 26 4.125 -6.603 0.374 216 HD12 LEU 26 HD12 LEU 26 4.770 -8.087 1.066 217 HD13 LEU 26 HD13 LEU 26 3.729 -7.047 2.022 218 HD21 LEU 26 HD21 LEU 26 2.547 -9.657 -1.007 219 HD22 LEU 26 HD22 LEU 26 4.038 -8.698 -1.069 220 HD23 LEU 26 HD23 LEU 26 2.500 -7.990 -1.582 221 H LYS 27 HN LYS 27 3.003 -6.639 3.516 222 HA LYS 27 HA LYS 27 0.224 -5.781 3.962 223 HB2 LYS 27 HB2 LYS 27 1.169 -5.945 6.123 224 HB3 LYS 27 HB1 LYS 27 2.698 -5.284 5.581 225 HG2 LYS 27 HG2 LYS 27 1.693 -3.604 6.859 226 HG3 LYS 27 HG1 LYS 27 1.501 -3.118 5.171 227 HD2 LYS 27 HD2 LYS 27 -0.629 -2.731 5.931 228 HD3 LYS 27 HD1 LYS 27 -0.797 -4.420 5.450 229 HE2 LYS 27 HE2 LYS 27 -0.260 -3.395 8.239 230 HE3 LYS 27 HE1 LYS 27 -1.785 -4.041 7.644 231 HZ1 LYS 27 HZ1 LYS 27 0.756 -5.559 7.887 232 HZ2 LYS 27 HZ2 LYS 27 -0.711 -6.183 7.325 233 HZ3 LYS 27 HZ3 LYS 27 -0.568 -5.675 8.932 234 H ILE 28 HN ILE 28 -0.309 -3.795 3.165 235 HA ILE 28 HA ILE 28 1.783 -2.347 1.700 236 HB ILE 28 HB ILE 28 -1.213 -2.204 1.347 237 HG12 ILE 28 HG12 ILE 28 -0.437 -4.352 0.615 238 HG13 ILE 28 HG11 ILE 28 -0.706 -3.375 -0.810 239 HG21 ILE 28 HG21 ILE 28 -0.674 -0.956 -0.713 240 HG22 ILE 28 HG22 ILE 28 1.028 -0.961 -0.245 241 HG23 ILE 28 HG23 ILE 28 -0.161 -0.112 0.750 242 HD11 ILE 28 HD11 ILE 28 1.940 -3.960 0.447 243 HD12 ILE 28 HD12 ILE 28 1.683 -2.938 -0.966 244 HD13 ILE 28 HD13 ILE 28 1.304 -4.662 -1.041 245 H LEU 29 HN LEU 29 2.424 -0.456 2.482 246 HA LEU 29 HA LEU 29 1.075 0.611 4.811 247 HB2 LEU 29 HB2 LEU 29 3.663 0.463 4.296 248 HB3 LEU 29 HB1 LEU 29 3.368 1.996 3.495 249 HG LEU 29 HG LEU 29 4.184 2.373 5.747 250 HD11 LEU 29 HD11 LEU 29 2.355 3.770 6.648 251 HD12 LEU 29 HD12 LEU 29 1.262 3.077 5.444 252 HD13 LEU 29 HD13 LEU 29 2.653 4.034 4.932 253 HD21 LEU 29 HD21 LEU 29 1.769 0.838 6.697 254 HD22 LEU 29 HD22 LEU 29 2.961 1.649 7.712 255 HD23 LEU 29 HD23 LEU 29 3.434 0.261 6.735 256 H ASN 30 HN ASN 30 -0.529 1.979 4.639 257 HA ASN 30 HA ASN 30 -1.052 3.547 2.317 258 HB2 ASN 30 HB2 ASN 30 -2.133 3.651 5.130 259 HB3 ASN 30 HB1 ASN 30 -2.709 4.675 3.831 260 HD21 ASN 30 HD21 ASN 30 -3.804 3.701 2.067 261 HD22 ASN 30 HD22 ASN 30 -4.546 2.150 2.232 262 H THR 31 HN THR 31 0.726 4.827 1.875 263 HA THR 31 HA THR 31 1.952 6.365 3.948 264 HB THR 31 HB THR 31 3.282 7.164 1.916 265 HG1 THR 31 HG1 THR 31 2.449 4.784 0.695 266 HG21 THR 31 HG21 THR 31 4.590 5.045 1.949 267 HG22 THR 31 HG22 THR 31 3.281 4.317 2.879 268 HG23 THR 31 HG23 THR 31 4.189 5.676 3.544 269 HA PRO 32 HA PRO 32 0.728 10.603 3.455 270 HB2 PRO 32 HB2 PRO 32 3.166 11.316 2.099 271 HB3 PRO 32 HB1 PRO 32 2.588 11.724 3.709 272 HG2 PRO 32 HG2 PRO 32 4.519 9.748 2.954 273 HG3 PRO 32 HG1 PRO 32 4.039 10.303 4.558 274 HD2 PRO 32 HD2 PRO 32 3.514 7.816 3.511 275 HD3 PRO 32 HD1 PRO 32 2.683 8.551 4.861 276 H ASN 33 HN ASN 33 0.802 8.625 0.905 277 HA ASN 33 HA ASN 33 0.288 8.694 -1.289 278 HB2 ASN 33 HB2 ASN 33 0.490 11.714 -1.130 279 HB3 ASN 33 HB1 ASN 33 0.005 10.793 -2.549 280 HD21 ASN 33 HD21 ASN 33 -0.916 11.947 0.567 281 HD22 ASN 33 HD22 ASN 33 -2.589 11.534 0.467 282 H CYS 34 HN CYS 34 2.477 7.928 -0.417 283 HA CYS 34 HA CYS 34 4.655 8.993 -2.036 284 HB2 CYS 34 HB2 CYS 34 4.430 6.856 0.104 285 HB3 CYS 34 HB1 CYS 34 5.896 7.115 -0.802 286 H ALA 35 HN ALA 35 5.824 7.153 -3.296 287 HA ALA 35 HA ALA 35 4.150 5.534 -4.832 288 HB1 ALA 35 HB1 ALA 35 6.150 4.196 -5.324 289 HB2 ALA 35 HB2 ALA 35 7.003 4.980 -3.994 290 HB3 ALA 35 HB3 ALA 35 6.509 5.922 -5.400 291 H LEU 36 HN LEU 36 2.738 4.086 -4.045 292 HA LEU 36 HA LEU 36 2.422 3.207 -1.572 293 HB2 LEU 36 HB2 LEU 36 1.279 1.154 -2.516 294 HB3 LEU 36 HB1 LEU 36 0.689 2.734 -2.977 295 HG LEU 36 HG LEU 36 0.590 1.141 -4.818 296 HD11 LEU 36 HD11 LEU 36 1.450 2.531 -6.512 297 HD12 LEU 36 HD12 LEU 36 2.679 3.193 -5.437 298 HD13 LEU 36 HD13 LEU 36 0.982 3.589 -5.176 299 HD21 LEU 36 HD21 LEU 36 2.393 -0.322 -4.354 300 HD22 LEU 36 HD22 LEU 36 3.564 0.991 -4.475 301 HD23 LEU 36 HD23 LEU 36 2.709 0.435 -5.917 302 H GLN 37 HN GLN 37 3.135 1.738 -0.186 303 HA GLN 37 HA GLN 37 5.669 0.517 -0.997 304 HB2 GLN 37 HB2 GLN 37 4.832 1.776 1.601 305 HB3 GLN 37 HB1 GLN 37 6.308 0.827 1.419 306 HG2 GLN 37 HG2 GLN 37 7.307 2.383 0.073 307 HG3 GLN 37 HG1 GLN 37 5.773 3.042 -0.493 308 HE21 GLN 37 HE21 GLN 37 6.186 5.060 -0.119 309 HE22 GLN 37 HE22 GLN 37 6.391 5.759 1.437 310 H ILE 38 HN ILE 38 5.724 -1.507 -1.061 311 HA ILE 38 HA ILE 38 3.681 -3.115 0.216 312 HB ILE 38 HB ILE 38 5.776 -3.966 -1.799 313 HG12 ILE 38 HG12 ILE 38 3.692 -3.803 -3.389 314 HG13 ILE 38 HG11 ILE 38 3.130 -2.615 -2.231 315 HG21 ILE 38 HG21 ILE 38 3.794 -5.568 -2.345 316 HG22 ILE 38 HG22 ILE 38 3.294 -5.186 -0.694 317 HG23 ILE 38 HG23 ILE 38 4.888 -5.909 -1.006 318 HD11 ILE 38 HD11 ILE 38 4.319 -1.743 -4.268 319 HD12 ILE 38 HD12 ILE 38 5.802 -2.414 -3.584 320 HD13 ILE 38 HD13 ILE 38 4.911 -1.162 -2.716 321 H VAL 39 HN VAL 39 4.290 -3.583 2.319 322 HA VAL 39 HA VAL 39 7.143 -4.023 2.834 323 HB VAL 39 HB VAL 39 5.737 -2.338 4.191 324 HG11 VAL 39 HG11 VAL 39 3.819 -3.707 4.663 325 HG12 VAL 39 HG12 VAL 39 4.606 -3.200 6.158 326 HG13 VAL 39 HG13 VAL 39 4.826 -4.844 5.559 327 HG21 VAL 39 HG21 VAL 39 7.393 -4.408 5.633 328 HG22 VAL 39 HG22 VAL 39 7.007 -2.797 6.237 329 HG23 VAL 39 HG23 VAL 39 8.002 -2.982 4.793 330 H ALA 40 HN ALA 40 7.924 -5.974 3.293 331 HA ALA 40 HA ALA 40 5.976 -8.150 3.646 332 HB1 ALA 40 HB1 ALA 40 6.687 -7.841 1.260 333 HB2 ALA 40 HB2 ALA 40 6.981 -9.441 1.935 334 HB3 ALA 40 HB3 ALA 40 8.312 -8.298 1.761 335 H ARG 41 HN ARG 41 6.586 -9.746 5.000 336 HA ARG 41 HA ARG 41 9.283 -9.623 6.128 337 HB2 ARG 41 HB2 ARG 41 6.709 -10.909 6.950 338 HB3 ARG 41 HB1 ARG 41 8.234 -11.541 7.569 339 HG2 ARG 41 HG2 ARG 41 7.891 -8.626 7.751 340 HG3 ARG 41 HG1 ARG 41 6.834 -9.595 8.762 341 HD2 ARG 41 HD2 ARG 41 8.801 -10.772 9.661 342 HD3 ARG 41 HD1 ARG 41 9.837 -9.726 8.690 343 HE ARG 41 HE ARG 41 8.204 -8.068 10.197 344 HH11 ARG 41 HH11 ARG 41 10.718 -10.435 10.786 345 HH12 ARG 41 HH12 ARG 41 11.186 -9.733 12.304 346 HH21 ARG 41 HH21 ARG 41 8.819 -7.156 12.191 347 HH22 ARG 41 HH22 ARG 41 10.103 -7.880 13.106 348 H LEU 42 HN LEU 42 10.812 -11.052 5.558 349 HA LEU 42 HA LEU 42 10.254 -12.797 3.369 350 HB2 LEU 42 HB2 LEU 42 12.699 -12.263 5.019 351 HB3 LEU 42 HB1 LEU 42 12.677 -13.548 3.829 352 HG LEU 42 HG LEU 42 12.106 -10.659 3.191 353 HD11 LEU 42 HD11 LEU 42 14.640 -12.230 2.735 354 HD12 LEU 42 HD12 LEU 42 14.422 -11.013 3.995 355 HD13 LEU 42 HD13 LEU 42 14.347 -10.547 2.293 356 HD21 LEU 42 HD21 LEU 42 12.630 -13.065 1.444 357 HD22 LEU 42 HD22 LEU 42 12.492 -11.405 0.871 358 HD23 LEU 42 HD23 LEU 42 11.104 -12.198 1.610 359 H LYS 43 HN LYS 43 10.586 -15.024 3.272 360 HA LYS 43 HA LYS 43 9.327 -16.422 5.425 361 HB2 LYS 43 HB2 LYS 43 8.885 -16.836 3.026 362 HB3 LYS 43 HB1 LYS 43 10.515 -17.455 2.873 363 HG2 LYS 43 HG2 LYS 43 9.941 -19.218 4.524 364 HG3 LYS 43 HG1 LYS 43 8.271 -18.642 4.475 365 HD2 LYS 43 HD2 LYS 43 8.351 -20.429 2.940 366 HD3 LYS 43 HD1 LYS 43 8.409 -18.966 1.952 367 HE2 LYS 43 HE2 LYS 43 10.933 -19.199 2.009 368 HE3 LYS 43 HE1 LYS 43 10.671 -20.806 2.682 369 HZ1 LYS 43 HZ1 LYS 43 10.954 -20.842 0.267 370 HZ2 LYS 43 HZ2 LYS 43 9.583 -19.867 0.084 371 HZ3 LYS 43 HZ3 LYS 43 9.435 -21.424 0.731 372 H ASN 44 HN ASN 44 12.489 -16.651 3.814 373 HA ASN 44 HA ASN 44 13.432 -18.536 5.786 374 HB2 ASN 44 HB2 ASN 44 14.775 -17.214 3.450 375 HB3 ASN 44 HB1 ASN 44 15.615 -18.302 4.540 376 HD21 ASN 44 HD21 ASN 44 15.027 -18.516 1.668 377 HD22 ASN 44 HD22 ASN 44 14.176 -20.012 1.476 378 H ASN 45 HN ASN 45 14.217 -15.235 4.787 379 HA ASN 45 HA ASN 45 16.180 -14.850 6.805 380 HB2 ASN 45 HB2 ASN 45 16.057 -13.616 4.622 381 HB3 ASN 45 HB1 ASN 45 14.692 -12.735 5.272 382 HD21 ASN 45 HD21 ASN 45 17.279 -11.786 4.343 383 HD22 ASN 45 HD22 ASN 45 17.976 -10.919 5.665 384 H ASN 46 HN ASN 46 12.759 -14.191 6.535 385 HA ASN 46 HA ASN 46 11.152 -13.637 8.017 386 HB2 ASN 46 HB2 ASN 46 13.315 -14.373 9.961 387 HB3 ASN 46 HB1 ASN 46 11.775 -13.733 10.517 388 HD21 ASN 46 HD21 ASN 46 13.400 -16.418 9.055 389 HD22 ASN 46 HD22 ASN 46 12.087 -17.533 9.179 390 H ARG 47 HN ARG 47 13.451 -11.695 7.141 391 HA ARG 47 HA ARG 47 13.105 -9.601 9.099 392 HB2 ARG 47 HB2 ARG 47 14.723 -8.377 7.907 393 HB3 ARG 47 HB1 ARG 47 15.254 -10.044 7.747 394 HG2 ARG 47 HG2 ARG 47 14.729 -10.164 5.543 395 HG3 ARG 47 HG1 ARG 47 13.536 -8.869 5.633 396 HD2 ARG 47 HD2 ARG 47 16.468 -8.426 6.073 397 HD3 ARG 47 HD1 ARG 47 15.727 -8.335 4.472 398 HE ARG 47 HE ARG 47 14.191 -6.668 5.957 399 HH11 ARG 47 HH11 ARG 47 17.653 -6.902 5.484 400 HH12 ARG 47 HH12 ARG 47 17.916 -5.197 5.682 401 HH21 ARG 47 HH21 ARG 47 14.535 -4.432 6.204 402 HH22 ARG 47 HH22 ARG 47 16.146 -3.793 6.091 403 H GLN 48 HN GLN 48 12.273 -7.555 8.568 404 HA GLN 48 HA GLN 48 10.017 -7.621 6.757 405 HB2 GLN 48 HB2 GLN 48 9.858 -6.575 9.014 406 HB3 GLN 48 HB1 GLN 48 11.007 -5.352 8.497 407 HG2 GLN 48 HG2 GLN 48 9.437 -4.695 6.718 408 HG3 GLN 48 HG1 GLN 48 8.269 -5.836 7.382 409 HE21 GLN 48 HE21 GLN 48 9.926 -2.825 7.850 410 HE22 GLN 48 HE22 GLN 48 8.942 -2.250 9.153 411 H VAL 49 HN VAL 49 10.014 -6.669 4.800 412 HA VAL 49 HA VAL 49 12.224 -4.884 4.022 413 HB VAL 49 HB VAL 49 11.331 -6.525 1.838 414 HG11 VAL 49 HG11 VAL 49 13.254 -5.150 1.616 415 HG12 VAL 49 HG12 VAL 49 13.770 -6.833 1.502 416 HG13 VAL 49 HG13 VAL 49 14.034 -5.928 2.993 417 HG21 VAL 49 HG21 VAL 49 12.472 -8.592 2.462 418 HG22 VAL 49 HG22 VAL 49 11.064 -8.254 3.470 419 HG23 VAL 49 HG23 VAL 49 12.687 -7.954 4.092 420 H CYS 50 HN CYS 50 11.670 -4.173 1.657 421 HA CYS 50 HA CYS 50 8.806 -3.665 1.388 422 HB2 CYS 50 HB2 CYS 50 11.030 -1.754 0.630 423 HB3 CYS 50 HB1 CYS 50 9.309 -1.449 0.582 424 H ILE 51 HN ILE 51 8.068 -4.496 -0.474 425 HA ILE 51 HA ILE 51 9.935 -5.674 -2.330 426 HB ILE 51 HB ILE 51 7.027 -5.572 -2.966 427 HG12 ILE 51 HG12 ILE 51 8.193 -7.258 -0.735 428 HG13 ILE 51 HG11 ILE 51 6.974 -5.997 -0.558 429 HG21 ILE 51 HG21 ILE 51 8.911 -6.767 -4.258 430 HG22 ILE 51 HG22 ILE 51 7.415 -7.644 -3.945 431 HG23 ILE 51 HG23 ILE 51 8.840 -7.956 -2.954 432 HD11 ILE 51 HD11 ILE 51 6.668 -8.648 -1.947 433 HD12 ILE 51 HD12 ILE 51 5.465 -7.365 -2.005 434 HD13 ILE 51 HD13 ILE 51 5.881 -8.113 -0.466 435 H ASP 52 HN ASP 52 10.338 -5.070 -4.416 436 HA ASP 52 HA ASP 52 10.000 -2.353 -5.121 437 HB2 ASP 52 HB2 ASP 52 11.875 -3.748 -5.930 438 HB3 ASP 52 HB1 ASP 52 10.747 -4.683 -6.894 439 HA PRO 53 HA PRO 53 5.802 -2.570 -6.477 440 HB2 PRO 53 HB2 PRO 53 5.727 -0.140 -7.711 441 HB3 PRO 53 HB1 PRO 53 5.628 -0.358 -5.961 442 HG2 PRO 53 HG2 PRO 53 7.994 0.359 -7.637 443 HG3 PRO 53 HG1 PRO 53 7.471 1.036 -6.093 444 HD2 PRO 53 HD2 PRO 53 9.450 -0.748 -6.249 445 HD3 PRO 53 HD1 PRO 53 8.314 -0.726 -4.895 446 H LYS 54 HN LYS 54 8.526 -2.299 -8.548 447 HA LYS 54 HA LYS 54 6.889 -2.390 -10.965 448 HB2 LYS 54 HB2 LYS 54 9.876 -2.088 -10.617 449 HB3 LYS 54 HB1 LYS 54 9.045 -2.125 -12.166 450 HG2 LYS 54 HG2 LYS 54 8.017 -0.150 -10.257 451 HG3 LYS 54 HG1 LYS 54 9.663 0.132 -10.826 452 HD2 LYS 54 HD2 LYS 54 7.713 1.159 -12.156 453 HD3 LYS 54 HD1 LYS 54 8.985 0.335 -13.057 454 HE2 LYS 54 HE2 LYS 54 7.606 -1.603 -13.310 455 HE3 LYS 54 HE1 LYS 54 6.413 -0.939 -12.207 456 HZ1 LYS 54 HZ1 LYS 54 7.116 0.246 -14.827 457 HZ2 LYS 54 HZ2 LYS 54 5.883 0.759 -13.793 458 HZ3 LYS 54 HZ3 LYS 54 5.777 -0.747 -14.554 459 H LEU 55 HN LEU 55 8.202 -4.538 -8.822 460 HA LEU 55 HA LEU 55 9.109 -6.653 -10.384 461 HB2 LEU 55 HB2 LEU 55 7.768 -6.343 -7.750 462 HB3 LEU 55 HB1 LEU 55 7.933 -7.965 -8.398 463 HG LEU 55 HG LEU 55 10.264 -6.087 -8.090 464 HD11 LEU 55 HD11 LEU 55 9.129 -8.048 -6.117 465 HD12 LEU 55 HD12 LEU 55 9.415 -6.318 -5.905 466 HD13 LEU 55 HD13 LEU 55 10.778 -7.428 -6.037 467 HD21 LEU 55 HD21 LEU 55 11.551 -8.170 -8.150 468 HD22 LEU 55 HD22 LEU 55 10.611 -7.915 -9.620 469 HD23 LEU 55 HD23 LEU 55 10.054 -9.071 -8.410 470 H LYS 56 HN LYS 56 8.133 -8.161 -11.602 471 HA LYS 56 HA LYS 56 5.732 -7.427 -12.849 472 HB2 LYS 56 HB2 LYS 56 7.246 -10.040 -12.959 473 HB3 LYS 56 HB1 LYS 56 5.925 -9.611 -14.032 474 HG2 LYS 56 HG2 LYS 56 8.538 -8.130 -13.801 475 HG3 LYS 56 HG1 LYS 56 8.117 -9.277 -15.071 476 HD2 LYS 56 HD2 LYS 56 6.653 -6.703 -14.491 477 HD3 LYS 56 HD1 LYS 56 7.837 -6.931 -15.777 478 HE2 LYS 56 HE2 LYS 56 6.409 -8.651 -16.777 479 HE3 LYS 56 HE1 LYS 56 5.222 -8.407 -15.497 480 HZ1 LYS 56 HZ1 LYS 56 4.917 -6.142 -16.247 481 HZ2 LYS 56 HZ2 LYS 56 4.631 -7.217 -17.518 482 HZ3 LYS 56 HZ3 LYS 56 6.080 -6.348 -17.457 483 H TRP 57 HN TRP 57 6.369 -9.632 -10.195 484 HA TRP 57 HA TRP 57 3.658 -10.649 -10.313 485 HB2 TRP 57 HB2 TRP 57 4.226 -12.075 -8.518 486 HB3 TRP 57 HB1 TRP 57 5.644 -12.024 -9.539 487 HD1 TRP 57 HD1 TRP 57 7.841 -11.053 -8.495 488 HE1 TRP 57 HE1 TRP 57 8.555 -10.505 -6.073 489 HE3 TRP 57 HE3 TRP 57 3.241 -11.072 -6.315 490 HZ2 TRP 57 HZ2 TRP 57 7.293 -10.139 -3.568 491 HZ3 TRP 57 HZ3 TRP 57 3.064 -10.600 -3.914 492 HH2 TRP 57 HH2 TRP 57 5.048 -10.152 -2.563 493 H ILE 58 HN ILE 58 5.394 -8.100 -8.863 494 HA ILE 58 HA ILE 58 3.535 -7.563 -6.746 495 HB ILE 58 HB ILE 58 5.853 -6.055 -7.917 496 HG12 ILE 58 HG12 ILE 58 6.265 -7.981 -6.409 497 HG13 ILE 58 HG11 ILE 58 6.851 -6.456 -5.750 498 HG21 ILE 58 HG21 ILE 58 4.034 -5.126 -5.712 499 HG22 ILE 58 HG22 ILE 58 4.160 -4.421 -7.326 500 HG23 ILE 58 HG23 ILE 58 5.536 -4.352 -6.216 501 HD11 ILE 58 HD11 ILE 58 5.075 -6.331 -4.216 502 HD12 ILE 58 HD12 ILE 58 5.665 -7.994 -4.154 503 HD13 ILE 58 HD13 ILE 58 4.189 -7.616 -5.027 504 H GLN 59 HN GLN 59 4.111 -6.277 -9.997 505 HA GLN 59 HA GLN 59 2.267 -4.199 -10.052 506 HB2 GLN 59 HB2 GLN 59 3.131 -6.185 -12.104 507 HB3 GLN 59 HB1 GLN 59 2.027 -4.885 -12.513 508 HG2 GLN 59 HG2 GLN 59 4.733 -4.432 -11.307 509 HG3 GLN 59 HG1 GLN 59 4.471 -4.535 -13.046 510 HE21 GLN 59 HE21 GLN 59 4.070 -2.607 -10.204 511 HE22 GLN 59 HE22 GLN 59 3.493 -1.185 -11.000 512 H GLU 60 HN GLU 60 1.790 -7.624 -10.276 513 HA GLU 60 HA GLU 60 -0.992 -7.554 -10.885 514 HB2 GLU 60 HB2 GLU 60 0.633 -9.734 -9.558 515 HB3 GLU 60 HB1 GLU 60 -0.956 -9.927 -10.273 516 HG2 GLU 60 HG2 GLU 60 1.515 -9.129 -11.791 517 HG3 GLU 60 HG1 GLU 60 0.894 -10.773 -11.681 518 H TYR 61 HN TYR 61 0.905 -7.625 -7.929 519 HA TYR 61 HA TYR 61 -1.363 -8.010 -6.203 520 HB2 TYR 61 HB2 TYR 61 0.891 -8.734 -5.507 521 HB3 TYR 61 HB1 TYR 61 1.457 -7.075 -5.580 522 HD1 TYR 61 HD1 TYR 61 0.083 -9.577 -3.511 523 HD2 TYR 61 HD2 TYR 61 0.270 -5.377 -4.061 524 HE1 TYR 61 HE1 TYR 61 -0.562 -9.246 -1.176 525 HE2 TYR 61 HE2 TYR 61 -0.396 -5.039 -1.721 526 HH TYR 61 HH TYR 61 -0.316 -7.459 0.584 527 H LEU 62 HN LEU 62 0.505 -5.425 -7.510 528 HA LEU 62 HA LEU 62 -0.274 -3.230 -6.055 529 HB2 LEU 62 HB2 LEU 62 0.971 -3.790 -8.521 530 HB3 LEU 62 HB1 LEU 62 -0.252 -2.559 -8.820 531 HG LEU 62 HG LEU 62 0.876 -1.420 -6.719 532 HD11 LEU 62 HD11 LEU 62 3.225 -1.826 -6.580 533 HD12 LEU 62 HD12 LEU 62 3.144 -2.977 -7.918 534 HD13 LEU 62 HD13 LEU 62 2.376 -3.363 -6.377 535 HD21 LEU 62 HD21 LEU 62 2.319 -0.167 -8.261 536 HD22 LEU 62 HD22 LEU 62 0.702 -0.410 -8.918 537 HD23 LEU 62 HD23 LEU 62 2.044 -1.394 -9.498 538 H GLU 63 HN GLU 63 -1.868 -4.801 -8.764 539 HA GLU 63 HA GLU 63 -3.936 -3.068 -9.226 540 HB2 GLU 63 HB2 GLU 63 -3.987 -6.064 -9.212 541 HB3 GLU 63 HB1 GLU 63 -5.196 -5.043 -9.956 542 HG2 GLU 63 HG2 GLU 63 -3.425 -4.052 -11.343 543 HG3 GLU 63 HG1 GLU 63 -2.314 -5.241 -10.691 544 H LYS 64 HN LYS 64 -3.677 -5.516 -6.749 545 HA LYS 64 HA LYS 64 -6.259 -5.080 -5.597 546 HB2 LYS 64 HB2 LYS 64 -3.787 -6.405 -4.500 547 HB3 LYS 64 HB1 LYS 64 -5.338 -6.385 -3.671 548 HG2 LYS 64 HG2 LYS 64 -5.441 -8.429 -4.688 549 HG3 LYS 64 HG1 LYS 64 -6.190 -7.418 -5.924 550 HD2 LYS 64 HD2 LYS 64 -4.047 -7.254 -7.086 551 HD3 LYS 64 HD1 LYS 64 -3.311 -8.294 -5.864 552 HE2 LYS 64 HE2 LYS 64 -5.556 -9.048 -7.731 553 HE3 LYS 64 HE1 LYS 64 -3.876 -9.563 -7.865 554 HZ1 LYS 64 HZ1 LYS 64 -5.786 -10.257 -5.702 555 HZ2 LYS 64 HZ2 LYS 64 -4.139 -10.638 -5.666 556 HZ3 LYS 64 HZ3 LYS 64 -5.135 -11.301 -6.861 557 H ALA 65 HN ALA 65 -2.981 -4.052 -4.876 558 HA ALA 65 HA ALA 65 -3.508 -2.694 -2.476 559 HB1 ALA 65 HB1 ALA 65 -1.322 -1.670 -2.814 560 HB2 ALA 65 HB2 ALA 65 -1.330 -2.204 -4.496 561 HB3 ALA 65 HB3 ALA 65 -1.275 -3.392 -3.195 562 H LEU 66 HN LEU 66 -3.757 -1.793 -5.797 563 HA LEU 66 HA LEU 66 -4.192 1.021 -5.163 564 HB2 LEU 66 HB2 LEU 66 -3.818 -0.530 -7.680 565 HB3 LEU 66 HB1 LEU 66 -4.618 1.024 -7.767 566 HG LEU 66 HG LEU 66 -2.259 1.216 -8.290 567 HD11 LEU 66 HD11 LEU 66 -1.676 3.011 -6.767 568 HD12 LEU 66 HD12 LEU 66 -2.895 2.459 -5.621 569 HD13 LEU 66 HD13 LEU 66 -3.386 3.096 -7.189 570 HD21 LEU 66 HD21 LEU 66 -0.568 0.812 -6.548 571 HD22 LEU 66 HD22 LEU 66 -1.419 -0.662 -7.028 572 HD23 LEU 66 HD23 LEU 66 -1.837 0.145 -5.513 573 H ASN 67 HN ASN 67 -5.898 -1.812 -5.909 574 HA ASN 67 HA ASN 67 -7.999 -2.049 -6.956 575 HB2 ASN 67 HB2 ASN 67 -9.419 -2.599 -5.140 576 HB3 ASN 67 HB1 ASN 67 -7.794 -3.062 -4.771 577 HD21 ASN 67 HD21 ASN 67 -6.884 -0.475 -3.959 578 HD22 ASN 67 HD22 ASN 67 -7.660 -0.113 -2.463 579 H LYS 68 HN LYS 68 -9.219 -1.037 -8.138 580 HA LYS 68 HA LYS 68 -9.813 1.654 -8.137 581 HB2 LYS 68 HB2 LYS 68 -11.936 0.789 -9.480 582 HB3 LYS 68 HB1 LYS 68 -10.319 0.786 -10.169 583 HG2 LYS 68 HG2 LYS 68 -11.370 -1.294 -10.687 584 HG3 LYS 68 HG1 LYS 68 -10.099 -1.603 -9.510 585 HD2 LYS 68 HD2 LYS 68 -11.764 -1.709 -7.731 586 HD3 LYS 68 HD1 LYS 68 -13.045 -1.362 -8.894 587 HE2 LYS 68 HE2 LYS 68 -11.256 -3.785 -8.834 588 HE3 LYS 68 HE1 LYS 68 -12.965 -3.735 -8.420 589 HZ1 LYS 68 HZ1 LYS 68 -13.455 -3.122 -10.716 590 HZ2 LYS 68 HZ2 LYS 68 -12.642 -4.603 -10.642 591 HZ3 LYS 68 HZ3 LYS 68 -11.811 -3.207 -11.107 592 H GLY 69 HN GLY 69 -11.467 2.926 -7.472 593 HA2 GLY 69 HA2 GLY 69 -13.730 3.145 -6.634 594 HA3 GLY 69 HA1 GLY 69 -13.458 1.690 -5.688 595 H ARG 70 HN ARG 70 -13.720 2.432 -3.652 596 HA ARG 70 HA ARG 70 -11.663 4.275 -2.682 597 HB2 ARG 70 HB2 ARG 70 -14.611 4.529 -2.074 598 HB3 ARG 70 HB1 ARG 70 -13.351 5.340 -1.158 599 HG2 ARG 70 HG2 ARG 70 -12.656 6.497 -3.236 600 HG3 ARG 70 HG1 ARG 70 -14.031 5.755 -4.059 601 HD2 ARG 70 HD2 ARG 70 -14.142 7.622 -1.691 602 HD3 ARG 70 HD1 ARG 70 -14.599 8.001 -3.350 603 HE ARG 70 HE ARG 70 -16.017 5.819 -2.035 604 HH11 ARG 70 HH11 ARG 70 -16.015 9.146 -3.120 605 HH12 ARG 70 HH12 ARG 70 -17.736 9.319 -2.991 606 HH21 ARG 70 HH21 ARG 70 -18.272 6.035 -1.871 607 HH22 ARG 70 HH22 ARG 70 -19.023 7.544 -2.279 608 H ARG 71 HN ARG 71 -10.602 2.534 -1.750 609 HA ARG 71 HA ARG 71 -12.031 0.997 0.280 610 HB2 ARG 71 HB2 ARG 71 -10.403 -0.099 -1.306 611 HB3 ARG 71 HB1 ARG 71 -9.120 0.803 -0.514 612 HG2 ARG 71 HG2 ARG 71 -9.764 -0.289 1.630 613 HG3 ARG 71 HG1 ARG 71 -10.893 -1.290 0.718 614 HD2 ARG 71 HD2 ARG 71 -8.828 -2.496 1.071 615 HD3 ARG 71 HD1 ARG 71 -9.019 -2.123 -0.642 616 HE ARG 71 HE ARG 71 -7.478 -0.166 0.792 617 HH11 ARG 71 HH11 ARG 71 -7.358 -3.201 -0.951 618 HH12 ARG 71 HH12 ARG 71 -5.664 -3.079 -1.298 619 HH21 ARG 71 HH21 ARG 71 -5.258 0.006 0.329 620 HH22 ARG 71 HH22 ARG 71 -4.464 -1.262 -0.554 621 H GLU 72 HN GLU 72 -12.252 3.321 1.242 622 HA GLU 72 HA GLU 72 -10.342 3.496 3.399 623 HB2 GLU 72 HB2 GLU 72 -9.835 5.879 3.026 624 HB3 GLU 72 HB1 GLU 72 -9.234 4.866 1.723 625 HG2 GLU 72 HG2 GLU 72 -10.258 6.204 0.288 626 HG3 GLU 72 HG1 GLU 72 -11.803 5.661 0.943 627 H GLU 73 HN GLU 73 -10.999 5.199 4.981 628 HA GLU 73 HA GLU 73 -13.880 5.777 4.879 629 HB2 GLU 73 HB2 GLU 73 -12.367 4.666 7.254 630 HB3 GLU 73 HB1 GLU 73 -14.035 5.219 7.289 631 HG2 GLU 73 HG2 GLU 73 -14.679 3.475 5.743 632 HG3 GLU 73 HG1 GLU 73 -13.001 2.950 5.608 633 H LYS 74 HN LYS 74 -11.795 7.518 4.208 634 HA LYS 74 HA LYS 74 -11.234 9.137 6.571 635 HB2 LYS 74 HB2 LYS 74 -10.297 9.480 3.715 636 HB3 LYS 74 HB1 LYS 74 -9.729 10.398 5.101 637 HG2 LYS 74 HG2 LYS 74 -9.345 7.453 4.613 638 HG3 LYS 74 HG1 LYS 74 -8.112 8.713 4.538 639 HD2 LYS 74 HD2 LYS 74 -8.434 9.162 6.925 640 HD3 LYS 74 HD1 LYS 74 -9.666 7.902 6.995 641 HE2 LYS 74 HE2 LYS 74 -7.586 7.027 7.833 642 HE3 LYS 74 HE1 LYS 74 -7.973 6.252 6.299 643 HZ1 LYS 74 HZ1 LYS 74 -6.094 8.529 6.591 644 HZ2 LYS 74 HZ2 LYS 74 -6.384 7.629 5.189 645 HZ3 LYS 74 HZ3 LYS 74 -5.621 6.908 6.513 646 H VAL 75 HN VAL 75 -13.071 9.209 3.598 647 HA VAL 75 HA VAL 75 -14.203 11.799 4.408 648 HB VAL 75 HB VAL 75 -15.247 11.852 2.144 649 HG11 VAL 75 HG11 VAL 75 -13.170 12.377 0.933 650 HG12 VAL 75 HG12 VAL 75 -12.243 11.606 2.221 651 HG13 VAL 75 HG13 VAL 75 -13.191 13.054 2.561 652 HG21 VAL 75 HG21 VAL 75 -13.515 9.432 1.636 653 HG22 VAL 75 HG22 VAL 75 -14.409 10.332 0.412 654 HG23 VAL 75 HG23 VAL 75 -15.278 9.461 1.674 655 H GLY 76 HN GLY 76 -16.317 12.007 4.938 656 HA2 GLY 76 HA2 GLY 76 -17.779 9.525 5.410 657 HA3 GLY 76 HA1 GLY 76 -18.177 11.109 6.061 658 H LYS 77 HN LYS 77 -17.866 9.510 2.911 659 HA LYS 77 HA LYS 77 -19.185 9.429 1.074 660 HB2 LYS 77 HB2 LYS 77 -21.319 10.630 2.845 661 HB3 LYS 77 HB1 LYS 77 -21.586 9.960 1.242 662 HG2 LYS 77 HG2 LYS 77 -20.878 7.761 2.039 663 HG3 LYS 77 HG1 LYS 77 -20.604 8.432 3.646 664 HD2 LYS 77 HD2 LYS 77 -23.254 8.372 2.202 665 HD3 LYS 77 HD1 LYS 77 -22.761 7.261 3.479 666 HE2 LYS 77 HE2 LYS 77 -22.566 9.137 5.036 667 HE3 LYS 77 HE1 LYS 77 -23.054 10.250 3.760 668 HZ1 LYS 77 HZ1 LYS 77 -24.711 8.060 4.889 669 HZ2 LYS 77 HZ2 LYS 77 -25.179 9.088 3.632 670 HZ3 LYS 77 HZ3 LYS 77 -24.912 9.715 5.179 671 H LYS 78 HN LYS 78 -20.222 12.436 2.686 672 HA LYS 78 HA LYS 78 -19.252 13.910 0.330 673 HB2 LYS 78 HB2 LYS 78 -21.753 14.490 1.929 674 HB3 LYS 78 HB1 LYS 78 -21.135 15.480 0.616 675 HG2 LYS 78 HG2 LYS 78 -21.431 13.541 -0.909 676 HG3 LYS 78 HG1 LYS 78 -22.188 12.668 0.424 677 HD2 LYS 78 HD2 LYS 78 -23.158 15.284 -0.722 678 HD3 LYS 78 HD1 LYS 78 -23.842 13.700 -1.085 679 HE2 LYS 78 HE2 LYS 78 -24.450 13.416 1.258 680 HE3 LYS 78 HE1 LYS 78 -23.725 14.975 1.648 681 HZ1 LYS 78 HZ1 LYS 78 -25.348 16.035 0.192 682 HZ2 LYS 78 HZ2 LYS 78 -26.110 15.167 1.424 683 HZ3 LYS 78 HZ3 LYS 78 -26.053 14.537 -0.143 684 H GLU 79 HN GLU 79 -17.648 15.202 0.883 685 HA GLU 79 HA GLU 79 -17.264 15.942 3.665 686 HB2 GLU 79 HB2 GLU 79 -15.380 15.099 2.283 687 HB3 GLU 79 HB1 GLU 79 -15.537 16.511 1.249 688 HG2 GLU 79 HG2 GLU 79 -13.710 16.750 2.841 689 HG3 GLU 79 HG1 GLU 79 -14.961 17.964 3.096 690 H LYS 80 HN LYS 80 -17.571 17.908 4.500 691 HA LYS 80 HA LYS 80 -18.327 20.020 4.763 692 HB2 LYS 80 HB2 LYS 80 -17.138 20.379 2.007 693 HB3 LYS 80 HB1 LYS 80 -17.703 21.698 3.024 694 HG2 LYS 80 HG2 LYS 80 -15.506 19.771 3.759 695 HG3 LYS 80 HG1 LYS 80 -15.262 21.394 3.112 696 HD2 LYS 80 HD2 LYS 80 -16.300 22.377 5.047 697 HD3 LYS 80 HD1 LYS 80 -16.758 20.790 5.661 698 HE2 LYS 80 HE2 LYS 80 -13.930 21.754 5.270 699 HE3 LYS 80 HE1 LYS 80 -14.787 21.721 6.809 700 HZ1 LYS 80 HZ1 LYS 80 -13.364 19.799 6.575 701 HZ2 LYS 80 HZ2 LYS 80 -14.125 19.357 5.134 702 HZ3 LYS 80 HZ3 LYS 80 -14.981 19.312 6.593 703 H ILE 81 HN ILE 81 -20.477 19.533 4.898 704 HA ILE 81 HA ILE 81 -22.111 19.172 2.564 705 HB ILE 81 HB ILE 81 -22.948 19.566 5.444 706 HG12 ILE 81 HG12 ILE 81 -21.513 17.592 5.163 707 HG13 ILE 81 HG11 ILE 81 -23.171 17.124 5.521 708 HG21 ILE 81 HG21 ILE 81 -24.491 18.489 3.085 709 HG22 ILE 81 HG22 ILE 81 -24.755 20.041 3.881 710 HG23 ILE 81 HG23 ILE 81 -25.064 18.537 4.752 711 HD11 ILE 81 HD11 ILE 81 -22.222 15.689 3.825 712 HD12 ILE 81 HD12 ILE 81 -21.858 17.086 2.813 713 HD13 ILE 81 HD13 ILE 81 -23.535 16.652 3.145 714 H GLY 82 HN GLY 82 -22.216 20.968 1.317 715 HA2 GLY 82 HA2 GLY 82 -22.894 23.532 2.560 716 HA3 GLY 82 HA1 GLY 82 -22.411 23.288 0.887 717 H LYS 83 HN LYS 83 -24.498 20.897 1.437 718 HA LYS 83 HA LYS 83 -26.606 21.945 -0.082 719 HB2 LYS 83 HB2 LYS 83 -26.096 19.525 0.205 720 HB3 LYS 83 HB1 LYS 83 -26.690 19.624 1.855 721 HG2 LYS 83 HG2 LYS 83 -28.382 18.663 0.450 722 HG3 LYS 83 HG1 LYS 83 -28.909 20.257 0.988 723 HD2 LYS 83 HD2 LYS 83 -28.277 21.216 -1.153 724 HD3 LYS 83 HD1 LYS 83 -27.657 19.655 -1.692 725 HE2 LYS 83 HE2 LYS 83 -29.864 20.069 -2.621 726 HE3 LYS 83 HE1 LYS 83 -29.904 18.705 -1.508 727 HZ1 LYS 83 HZ1 LYS 83 -30.770 21.473 -0.884 728 HZ2 LYS 83 HZ2 LYS 83 -30.800 20.171 0.195 729 HZ3 LYS 83 HZ3 LYS 83 -31.789 20.158 -1.174 730 H LYS 84 HN LYS 84 -26.072 21.745 3.371 731 HA LYS 84 HA LYS 84 -28.055 23.789 3.837 732 HB2 LYS 84 HB2 LYS 84 -29.292 21.576 3.923 733 HB3 LYS 84 HB1 LYS 84 -28.290 21.152 5.302 734 HG2 LYS 84 HG2 LYS 84 -30.399 21.931 6.107 735 HG3 LYS 84 HG1 LYS 84 -29.182 23.149 6.489 736 HD2 LYS 84 HD2 LYS 84 -29.908 24.545 4.698 737 HD3 LYS 84 HD1 LYS 84 -30.947 23.276 4.052 738 HE2 LYS 84 HE2 LYS 84 -32.281 24.930 5.210 739 HE3 LYS 84 HE1 LYS 84 -32.331 23.400 6.078 740 HZ1 LYS 84 HZ1 LYS 84 -30.688 24.276 7.627 741 HZ2 LYS 84 HZ2 LYS 84 -32.066 25.251 7.588 742 HZ3 LYS 84 HZ3 LYS 84 -30.662 25.748 6.793 743 H LYS 85 HN LYS 85 -26.820 25.181 4.950 744 HA LYS 85 HA LYS 85 -24.681 24.228 6.647 745 HB2 LYS 85 HB2 LYS 85 -24.300 26.688 7.065 746 HB3 LYS 85 HB1 LYS 85 -24.154 26.168 5.393 747 HG2 LYS 85 HG2 LYS 85 -26.392 27.020 4.929 748 HG3 LYS 85 HG1 LYS 85 -26.543 27.537 6.609 749 HD2 LYS 85 HD2 LYS 85 -24.351 28.492 4.779 750 HD3 LYS 85 HD1 LYS 85 -25.892 29.332 4.958 751 HE2 LYS 85 HE2 LYS 85 -24.011 28.710 7.229 752 HE3 LYS 85 HE1 LYS 85 -24.073 30.252 6.378 753 HZ1 LYS 85 HZ1 LYS 85 -25.361 30.275 8.437 754 HZ2 LYS 85 HZ2 LYS 85 -26.344 29.032 7.846 755 HZ3 LYS 85 HZ3 LYS 85 -26.341 30.540 7.086 756 H ARG 86 HN ARG 86 -27.425 23.613 7.329 757 HA ARG 86 HA ARG 86 -28.771 23.381 9.122 758 HB2 ARG 86 HB2 ARG 86 -26.367 24.121 10.787 759 HB3 ARG 86 HB1 ARG 86 -27.710 23.081 11.238 760 HG2 ARG 86 HG2 ARG 86 -25.622 22.480 9.152 761 HG3 ARG 86 HG1 ARG 86 -25.707 21.789 10.771 762 HD2 ARG 86 HD2 ARG 86 -27.749 20.659 10.251 763 HD3 ARG 86 HD1 ARG 86 -27.882 21.500 8.707 764 HE ARG 86 HE ARG 86 -25.472 19.956 8.973 765 HH11 ARG 86 HH11 ARG 86 -28.859 19.823 8.101 766 HH12 ARG 86 HH12 ARG 86 -28.662 18.471 7.032 767 HH21 ARG 86 HH21 ARG 86 -25.214 18.163 7.556 768 HH22 ARG 86 HH22 ARG 86 -26.601 17.530 6.725 769 H GLN 87 HN GLN 87 -26.954 25.616 11.037 770 HA GLN 87 HA GLN 87 -28.625 27.885 10.435 771 HB2 GLN 87 HB2 GLN 87 -29.405 28.129 12.790 772 HB3 GLN 87 HB1 GLN 87 -30.087 26.725 11.982 773 HG2 GLN 87 HG2 GLN 87 -28.463 25.287 13.107 774 HG3 GLN 87 HG1 GLN 87 -27.783 26.695 13.919 775 HE21 GLN 87 HE21 GLN 87 -31.200 26.318 13.352 776 HE22 GLN 87 HE22 GLN 87 -31.648 26.079 15.004 777 H LYS 88 HN LYS 88 -25.802 27.052 10.416 778 HA LYS 88 HA LYS 88 -24.699 29.159 12.121 779 HB2 LYS 88 HB2 LYS 88 -22.889 27.651 12.881 780 HB3 LYS 88 HB1 LYS 88 -24.469 27.125 13.445 781 HG2 LYS 88 HG2 LYS 88 -24.545 25.452 11.656 782 HG3 LYS 88 HG1 LYS 88 -22.949 25.972 11.115 783 HD2 LYS 88 HD2 LYS 88 -21.993 25.315 13.254 784 HD3 LYS 88 HD1 LYS 88 -23.589 24.839 13.835 785 HE2 LYS 88 HE2 LYS 88 -22.349 22.883 13.130 786 HE3 LYS 88 HE1 LYS 88 -23.715 23.152 12.050 787 HZ1 LYS 88 HZ1 LYS 88 -21.686 22.576 10.848 788 HZ2 LYS 88 HZ2 LYS 88 -20.908 23.938 11.478 789 HZ3 LYS 88 HZ3 LYS 88 -22.223 24.125 10.435 790 H LYS 89 HN LYS 89 -22.766 30.037 11.364 791 HA LYS 89 HA LYS 89 -22.089 29.383 8.602 792 HB2 LYS 89 HB2 LYS 89 -21.029 31.584 10.390 793 HB3 LYS 89 HB1 LYS 89 -20.701 31.407 8.673 794 HG2 LYS 89 HG2 LYS 89 -23.098 31.722 8.212 795 HG3 LYS 89 HG1 LYS 89 -23.374 31.972 9.934 796 HD2 LYS 89 HD2 LYS 89 -21.555 33.666 8.224 797 HD3 LYS 89 HD1 LYS 89 -23.220 34.078 8.623 798 HE2 LYS 89 HE2 LYS 89 -22.059 35.272 10.211 799 HE3 LYS 89 HE1 LYS 89 -22.409 33.784 11.084 800 HZ1 LYS 89 HZ1 LYS 89 -20.108 34.531 11.356 801 HZ2 LYS 89 HZ2 LYS 89 -19.853 34.375 9.694 802 HZ3 LYS 89 HZ3 LYS 89 -20.185 33.010 10.629 803 H ARG 90 HN ARG 90 -19.860 30.485 11.094 804 HA ARG 90 HA ARG 90 -17.869 29.701 11.832 805 HB2 ARG 90 HB2 ARG 90 -19.452 27.132 11.833 806 HB3 ARG 90 HB1 ARG 90 -17.907 27.348 12.642 807 HG2 ARG 90 HG2 ARG 90 -18.884 29.076 14.060 808 HG3 ARG 90 HG1 ARG 90 -20.434 28.873 13.239 809 HD2 ARG 90 HD2 ARG 90 -20.506 26.537 13.979 810 HD3 ARG 90 HD1 ARG 90 -18.974 26.760 14.820 811 HE ARG 90 HE ARG 90 -20.708 28.697 15.785 812 HH11 ARG 90 HH11 ARG 90 -20.512 25.205 15.706 813 HH12 ARG 90 HH12 ARG 90 -21.373 24.992 17.199 814 HH21 ARG 90 HH21 ARG 90 -21.853 28.427 17.754 815 HH22 ARG 90 HH22 ARG 90 -22.128 26.827 18.367 816 H LYS 91 HN LYS 91 -18.123 29.796 8.940 817 HA LYS 91 HA LYS 91 -16.574 27.505 8.032 818 HB2 LYS 91 HB2 LYS 91 -18.369 28.526 6.611 819 HB3 LYS 91 HB1 LYS 91 -17.383 29.974 6.483 820 HG2 LYS 91 HG2 LYS 91 -15.657 28.760 5.329 821 HG3 LYS 91 HG1 LYS 91 -16.516 27.240 5.570 822 HD2 LYS 91 HD2 LYS 91 -17.527 29.588 3.966 823 HD3 LYS 91 HD1 LYS 91 -16.814 28.121 3.295 824 HE2 LYS 91 HE2 LYS 91 -18.622 26.811 4.371 825 HE3 LYS 91 HE1 LYS 91 -19.356 28.321 4.903 826 HZ1 LYS 91 HZ1 LYS 91 -18.911 27.500 2.087 827 HZ2 LYS 91 HZ2 LYS 91 -19.584 28.972 2.579 828 HZ3 LYS 91 HZ3 LYS 91 -20.397 27.524 2.895 829 H ALA 92 HN ALA 92 -16.199 30.779 9.018 830 HA ALA 92 HA ALA 92 -13.350 30.798 8.392 831 HB1 ALA 92 HB1 ALA 92 -14.639 32.858 8.047 832 HB2 ALA 92 HB2 ALA 92 -13.389 33.080 9.270 833 HB3 ALA 92 HB3 ALA 92 -15.071 32.871 9.756 834 H ALA 93 HN ALA 93 -14.907 29.083 10.407 835 HA ALA 93 HA ALA 93 -13.230 29.682 12.747 836 HB1 ALA 93 HB1 ALA 93 -15.939 28.351 12.714 837 HB2 ALA 93 HB2 ALA 93 -15.606 30.006 13.225 838 HB3 ALA 93 HB3 ALA 93 -14.950 28.652 14.143 839 H GLN 94 HN GLN 94 -12.369 28.174 10.515 840 HA GLN 94 HA GLN 94 -12.533 25.395 10.895 841 HB2 GLN 94 HB2 GLN 94 -10.263 27.046 9.761 842 HB3 GLN 94 HB1 GLN 94 -10.412 25.303 9.610 843 HG2 GLN 94 HG2 GLN 94 -12.440 25.558 8.311 844 HG3 GLN 94 HG1 GLN 94 -12.374 27.308 8.516 845 HE21 GLN 94 HE21 GLN 94 -10.968 24.550 6.942 846 HE22 GLN 94 HE22 GLN 94 -10.067 25.432 5.758 847 H LYS 95 HN LYS 95 -11.279 23.964 12.075 848 HA LYS 95 HA LYS 95 -10.291 25.097 14.535 849 HB2 LYS 95 HB2 LYS 95 -11.731 23.041 14.403 850 HB3 LYS 95 HB1 LYS 95 -10.358 22.192 13.708 851 HG2 LYS 95 HG2 LYS 95 -10.530 21.697 16.058 852 HG3 LYS 95 HG1 LYS 95 -9.071 22.642 15.753 853 HD2 LYS 95 HD2 LYS 95 -10.189 24.658 16.522 854 HD3 LYS 95 HD1 LYS 95 -11.688 23.760 16.757 855 HE2 LYS 95 HE2 LYS 95 -9.089 23.317 18.218 856 HE3 LYS 95 HE1 LYS 95 -10.534 24.082 18.874 857 HZ1 LYS 95 HZ1 LYS 95 -10.315 21.261 17.973 858 HZ2 LYS 95 HZ2 LYS 95 -11.723 21.993 18.557 859 HZ3 LYS 95 HZ3 LYS 95 -10.390 21.795 19.577 860 H ARG 96 HN ARG 96 -8.572 26.197 13.296 861 HA ARG 96 HA ARG 96 -6.474 26.554 12.623 862 HB2 ARG 96 HB2 ARG 96 -4.698 25.638 14.088 863 HB3 ARG 96 HB1 ARG 96 -6.026 26.400 14.939 864 HG2 ARG 96 HG2 ARG 96 -6.940 24.115 15.386 865 HG3 ARG 96 HG1 ARG 96 -5.453 23.459 14.701 866 HD2 ARG 96 HD2 ARG 96 -5.242 23.540 17.094 867 HD3 ARG 96 HD1 ARG 96 -4.161 24.735 16.379 868 HE ARG 96 HE ARG 96 -6.588 25.996 16.980 869 HH11 ARG 96 HH11 ARG 96 -3.893 24.511 18.644 870 HH12 ARG 96 HH12 ARG 96 -4.069 25.489 20.066 871 HH21 ARG 96 HH21 ARG 96 -6.809 27.298 18.837 872 HH22 ARG 96 HH22 ARG 96 -5.733 27.070 20.181 873 H LYS 97 HN LYS 97 -6.137 23.026 13.206 874 HA LYS 97 HA LYS 97 -5.211 21.378 11.970 875 HB2 LYS 97 HB2 LYS 97 -6.327 23.146 9.875 876 HB3 LYS 97 HB1 LYS 97 -5.103 22.001 9.350 877 HG2 LYS 97 HG2 LYS 97 -7.308 21.070 9.042 878 HG3 LYS 97 HG1 LYS 97 -6.435 20.163 10.276 879 HD2 LYS 97 HD2 LYS 97 -7.636 21.398 12.020 880 HD3 LYS 97 HD1 LYS 97 -8.515 22.289 10.778 881 HE2 LYS 97 HE2 LYS 97 -9.507 20.222 9.969 882 HE3 LYS 97 HE1 LYS 97 -8.583 19.296 11.149 883 HZ1 LYS 97 HZ1 LYS 97 -9.762 20.487 12.914 884 HZ2 LYS 97 HZ2 LYS 97 -10.825 19.632 11.921 885 HZ3 LYS 97 HZ3 LYS 97 -10.685 21.306 11.757 886 H ASN 98 HN ASN 98 -3.219 20.724 11.478 887 HA ASN 98 HA ASN 98 -0.970 20.748 11.283 888 HB2 ASN 98 HB2 ASN 98 -1.519 23.217 9.628 889 HB3 ASN 98 HB1 ASN 98 0.055 22.442 9.755 890 HD21 ASN 98 HD21 ASN 98 -1.590 22.861 7.414 891 HD22 ASN 98 HD22 ASN 98 -1.891 21.295 6.745 Start of MODEL 13 1 H1 LYS 1 HT1 LYS 1 7.588 10.894 21.564 2 H2 LYS 1 HT2 LYS 1 6.902 9.644 22.470 3 H3 LYS 1 HT3 LYS 1 6.091 10.252 21.119 4 HA LYS 1 HA LYS 1 8.687 8.843 21.060 5 HB2 LYS 1 HB2 LYS 1 5.939 7.911 20.208 6 HB3 LYS 1 HB1 LYS 1 7.434 7.021 19.972 7 HG2 LYS 1 HG2 LYS 1 7.725 6.904 22.412 8 HG3 LYS 1 HG1 LYS 1 6.184 7.734 22.614 9 HD2 LYS 1 HD2 LYS 1 6.387 5.189 21.038 10 HD3 LYS 1 HD1 LYS 1 6.234 5.165 22.793 11 HE2 LYS 1 HE2 LYS 1 4.053 4.912 21.845 12 HE3 LYS 1 HE1 LYS 1 4.155 6.510 22.572 13 HZ1 LYS 1 HZ1 LYS 1 4.327 7.512 20.462 14 HZ2 LYS 1 HZ2 LYS 1 3.077 6.387 20.331 15 HZ3 LYS 1 HZ3 LYS 1 4.591 6.036 19.680 16 HA PRO 2 HA PRO 2 8.693 11.261 17.259 17 HB2 PRO 2 HB2 PRO 2 11.311 10.951 16.716 18 HB3 PRO 2 HB1 PRO 2 10.741 12.060 17.968 19 HG2 PRO 2 HG2 PRO 2 11.856 9.299 18.248 20 HG3 PRO 2 HG1 PRO 2 12.183 10.742 19.224 21 HD2 PRO 2 HD2 PRO 2 10.461 8.768 19.985 22 HD3 PRO 2 HD1 PRO 2 10.299 10.460 20.495 23 H VAL 3 HN VAL 3 9.385 10.802 15.009 24 HA VAL 3 HA VAL 3 9.274 7.916 14.421 25 HB VAL 3 HB VAL 3 8.274 10.177 12.673 26 HG11 VAL 3 HG11 VAL 3 8.090 7.182 12.383 27 HG12 VAL 3 HG12 VAL 3 8.965 8.304 11.342 28 HG13 VAL 3 HG13 VAL 3 7.205 8.337 11.390 29 HG21 VAL 3 HG21 VAL 3 6.022 9.365 13.215 30 HG22 VAL 3 HG22 VAL 3 6.874 9.957 14.642 31 HG23 VAL 3 HG23 VAL 3 6.720 8.222 14.362 32 H SER 4 HN SER 4 11.174 7.189 13.708 33 HA SER 4 HA SER 4 13.131 9.013 12.626 34 HB2 SER 4 HB2 SER 4 14.499 6.821 12.503 35 HB3 SER 4 HB1 SER 4 14.082 7.458 14.093 36 HG SER 4 HG SER 4 13.381 5.106 12.940 37 H LEU 5 HN LEU 5 10.589 7.958 11.237 38 HA LEU 5 HA LEU 5 11.889 7.376 8.667 39 HB2 LEU 5 HB2 LEU 5 9.255 6.473 9.787 40 HB3 LEU 5 HB1 LEU 5 9.485 6.575 8.056 41 HG LEU 5 HG LEU 5 9.827 4.307 8.734 42 HD11 LEU 5 HD11 LEU 5 11.304 5.184 6.983 43 HD12 LEU 5 HD12 LEU 5 12.055 3.888 7.911 44 HD13 LEU 5 HD13 LEU 5 12.513 5.563 8.209 45 HD21 LEU 5 HD21 LEU 5 11.890 5.352 10.665 46 HD22 LEU 5 HD22 LEU 5 11.552 3.651 10.339 47 HD23 LEU 5 HD23 LEU 5 10.320 4.667 11.087 48 H SER 6 HN SER 6 11.610 9.958 9.781 49 HA SER 6 HA SER 6 9.409 11.234 8.426 50 HB2 SER 6 HB2 SER 6 10.275 12.090 10.609 51 HB3 SER 6 HB1 SER 6 11.783 12.509 9.801 52 HG SER 6 HG SER 6 10.722 14.031 8.599 53 H TYR 7 HN TYR 7 12.574 10.324 7.833 54 HA TYR 7 HA TYR 7 12.917 11.932 5.446 55 HB2 TYR 7 HB2 TYR 7 14.924 11.315 6.692 56 HB3 TYR 7 HB1 TYR 7 14.499 9.611 6.588 57 HD1 TYR 7 HD1 TYR 7 15.216 8.303 4.779 58 HD2 TYR 7 HD2 TYR 7 15.492 12.539 4.529 59 HE1 TYR 7 HE1 TYR 7 16.518 8.090 2.705 60 HE2 TYR 7 HE2 TYR 7 16.793 12.338 2.455 61 HH TYR 7 HH TYR 7 18.215 10.678 1.330 62 H ARG 8 HN ARG 8 12.536 11.212 3.394 63 HA ARG 8 HA ARG 8 11.277 10.224 1.798 64 HB2 ARG 8 HB2 ARG 8 11.843 7.992 1.244 65 HB3 ARG 8 HB1 ARG 8 13.284 8.708 1.946 66 HG2 ARG 8 HG2 ARG 8 13.070 7.477 3.915 67 HG3 ARG 8 HG1 ARG 8 11.398 7.056 3.580 68 HD2 ARG 8 HD2 ARG 8 12.702 5.119 3.185 69 HD3 ARG 8 HD1 ARG 8 12.250 5.766 1.615 70 HE ARG 8 HE ARG 8 14.882 6.371 2.766 71 HH11 ARG 8 HH11 ARG 8 12.927 4.951 0.236 72 HH12 ARG 8 HH12 ARG 8 14.265 4.676 -0.829 73 HH21 ARG 8 HH21 ARG 8 16.660 6.003 1.372 74 HH22 ARG 8 HH22 ARG 8 16.397 5.275 -0.181 75 H CYS 9 HN CYS 9 9.768 8.105 1.471 76 HA CYS 9 HA CYS 9 7.622 8.424 3.351 77 HB2 CYS 9 HB2 CYS 9 7.971 6.615 0.959 78 HB3 CYS 9 HB1 CYS 9 6.485 6.791 1.867 79 HA PRO 10 HA PRO 10 8.047 5.473 6.519 80 HB2 PRO 10 HB2 PRO 10 5.920 3.951 5.078 81 HB3 PRO 10 HB1 PRO 10 6.079 4.280 6.803 82 HG2 PRO 10 HG2 PRO 10 4.469 5.733 5.225 83 HG3 PRO 10 HG1 PRO 10 5.328 6.426 6.608 84 HD2 PRO 10 HD2 PRO 10 5.756 6.883 3.754 85 HD3 PRO 10 HD1 PRO 10 6.360 7.813 5.133 86 H CYS 11 HN CYS 11 7.747 3.866 3.345 87 HA CYS 11 HA CYS 11 9.186 1.563 4.378 88 HB2 CYS 11 HB2 CYS 11 7.286 1.860 2.378 89 HB3 CYS 11 HB1 CYS 11 8.785 1.580 1.505 90 H ARG 12 HN ARG 12 11.175 0.968 3.878 91 HA ARG 12 HA ARG 12 13.068 2.901 3.014 92 HB2 ARG 12 HB2 ARG 12 13.279 -0.028 3.675 93 HB3 ARG 12 HB1 ARG 12 14.650 0.903 3.121 94 HG2 ARG 12 HG2 ARG 12 14.720 0.748 5.508 95 HG3 ARG 12 HG1 ARG 12 14.370 2.417 5.051 96 HD2 ARG 12 HD2 ARG 12 12.143 2.252 5.688 97 HD3 ARG 12 HD1 ARG 12 12.174 0.495 5.613 98 HE ARG 12 HE ARG 12 13.953 1.280 7.605 99 HH11 ARG 12 HH11 ARG 12 10.509 1.455 6.992 100 HH12 ARG 12 HH12 ARG 12 10.084 1.387 8.673 101 HH21 ARG 12 HH21 ARG 12 13.393 1.183 9.808 102 HH22 ARG 12 HH22 ARG 12 11.722 1.228 10.272 103 H PHE 13 HN PHE 13 14.849 1.618 1.381 104 HA PHE 13 HA PHE 13 13.472 1.924 -1.105 105 HB2 PHE 13 HB2 PHE 13 15.758 1.421 -2.088 106 HB3 PHE 13 HB1 PHE 13 15.653 2.843 -1.056 107 HD1 PHE 13 HD1 PHE 13 16.952 -0.546 -1.376 108 HD2 PHE 13 HD2 PHE 13 16.698 2.892 1.104 109 HE1 PHE 13 HE1 PHE 13 18.741 -1.430 0.024 110 HE2 PHE 13 HE2 PHE 13 18.489 2.018 2.508 111 HZ PHE 13 HZ PHE 13 19.531 -0.153 1.982 112 H PHE 14 HN PHE 14 13.152 0.372 -2.693 113 HA PHE 14 HA PHE 14 12.257 -2.023 -1.434 114 HB2 PHE 14 HB2 PHE 14 11.931 -1.171 -4.303 115 HB3 PHE 14 HB1 PHE 14 10.934 -2.268 -3.377 116 HD1 PHE 14 HD1 PHE 14 9.344 -1.444 -1.726 117 HD2 PHE 14 HD2 PHE 14 11.688 1.209 -4.084 118 HE1 PHE 14 HE1 PHE 14 7.862 0.417 -1.101 119 HE2 PHE 14 HE2 PHE 14 10.214 3.073 -3.462 120 HZ PHE 14 HZ PHE 14 8.295 2.678 -1.969 121 H GLU 15 HN GLU 15 12.825 -4.065 -1.848 122 HA GLU 15 HA GLU 15 15.305 -4.513 -3.326 123 HB2 GLU 15 HB2 GLU 15 13.663 -6.386 -1.611 124 HB3 GLU 15 HB1 GLU 15 15.220 -6.767 -2.327 125 HG2 GLU 15 HG2 GLU 15 14.749 -4.591 -0.308 126 HG3 GLU 15 HG1 GLU 15 15.330 -6.211 0.069 127 H SER 16 HN SER 16 15.188 -5.089 -5.396 128 HA SER 16 HA SER 16 12.710 -6.167 -6.464 129 HB2 SER 16 HB2 SER 16 15.296 -5.553 -7.918 130 HB3 SER 16 HB1 SER 16 13.713 -5.816 -8.644 131 HG SER 16 HG SER 16 13.154 -3.836 -8.173 132 H HIS 17 HN HIS 17 14.099 -7.827 -4.637 133 HA HIS 17 HA HIS 17 14.752 -10.082 -6.411 134 HB2 HIS 17 HB2 HIS 17 16.091 -9.391 -3.788 135 HB3 HIS 17 HB1 HIS 17 16.320 -10.908 -4.649 136 HD1 HIS 17 HD1 HIS 17 17.518 -10.714 -7.029 137 HD2 HIS 17 HD2 HIS 17 17.672 -7.325 -4.628 138 HE1 HIS 17 HE1 HIS 17 19.339 -9.276 -8.001 139 HE2 HIS 17 HE2 HIS 17 19.502 -7.299 -6.454 140 H ILE 18 HN ILE 18 12.833 -8.815 -3.995 141 HA ILE 18 HA ILE 18 12.280 -11.115 -2.448 142 HB ILE 18 HB ILE 18 10.627 -8.635 -2.897 143 HG12 ILE 18 HG12 ILE 18 12.488 -9.368 -0.639 144 HG13 ILE 18 HG11 ILE 18 12.874 -8.247 -1.934 145 HG21 ILE 18 HG21 ILE 18 9.468 -9.243 -0.821 146 HG22 ILE 18 HG22 ILE 18 10.368 -10.761 -0.778 147 HG23 ILE 18 HG23 ILE 18 9.231 -10.446 -2.090 148 HD11 ILE 18 HD11 ILE 18 12.257 -7.085 0.121 149 HD12 ILE 18 HD12 ILE 18 10.683 -7.892 0.097 150 HD13 ILE 18 HD13 ILE 18 11.110 -6.758 -1.182 151 H ALA 19 HN ALA 19 10.823 -12.692 -2.703 152 HA ALA 19 HA ALA 19 9.236 -12.707 -5.191 153 HB1 ALA 19 HB1 ALA 19 9.594 -15.113 -5.298 154 HB2 ALA 19 HB2 ALA 19 10.532 -15.054 -3.805 155 HB3 ALA 19 HB3 ALA 19 11.140 -14.266 -5.262 156 H ARG 20 HN ARG 20 7.197 -13.679 -5.112 157 HA ARG 20 HA ARG 20 5.700 -13.395 -2.759 158 HB2 ARG 20 HB2 ARG 20 4.963 -13.422 -5.237 159 HB3 ARG 20 HB1 ARG 20 4.897 -15.168 -5.036 160 HG2 ARG 20 HG2 ARG 20 3.200 -15.027 -3.415 161 HG3 ARG 20 HG1 ARG 20 3.430 -13.286 -3.223 162 HD2 ARG 20 HD2 ARG 20 1.472 -13.579 -4.528 163 HD3 ARG 20 HD1 ARG 20 2.751 -13.033 -5.613 164 HE ARG 20 HE ARG 20 2.910 -15.676 -5.923 165 HH11 ARG 20 HH11 ARG 20 0.145 -13.529 -5.890 166 HH12 ARG 20 HH12 ARG 20 -0.793 -14.510 -6.971 167 HH21 ARG 20 HH21 ARG 20 1.686 -16.968 -7.361 168 HH22 ARG 20 HH22 ARG 20 0.093 -16.462 -7.821 169 H ALA 21 HN ALA 21 7.503 -16.012 -4.074 170 HA ALA 21 HA ALA 21 6.251 -18.023 -2.435 171 HB1 ALA 21 HB1 ALA 21 7.878 -19.551 -3.403 172 HB2 ALA 21 HB2 ALA 21 8.734 -18.191 -4.128 173 HB3 ALA 21 HB3 ALA 21 7.102 -18.590 -4.662 174 H ASN 22 HN ASN 22 8.749 -15.749 -2.126 175 HA ASN 22 HA ASN 22 9.939 -17.229 0.085 176 HB2 ASN 22 HB2 ASN 22 10.913 -15.062 -1.723 177 HB3 ASN 22 HB1 ASN 22 11.618 -15.235 -0.132 178 HD21 ASN 22 HD21 ASN 22 13.131 -15.486 -2.367 179 HD22 ASN 22 HD22 ASN 22 13.636 -17.129 -2.556 180 H VAL 23 HN VAL 23 7.549 -15.087 -0.325 181 HA VAL 23 HA VAL 23 8.349 -13.428 1.943 182 HB VAL 23 HB VAL 23 7.716 -12.193 -0.059 183 HG11 VAL 23 HG11 VAL 23 4.983 -13.398 0.323 184 HG12 VAL 23 HG12 VAL 23 6.103 -13.791 -0.984 185 HG13 VAL 23 HG13 VAL 23 5.422 -12.166 -0.863 186 HG21 VAL 23 HG21 VAL 23 5.720 -11.881 2.150 187 HG22 VAL 23 HG22 VAL 23 6.176 -10.657 0.964 188 HG23 VAL 23 HG23 VAL 23 7.362 -11.238 2.143 189 H LYS 24 HN LYS 24 7.116 -13.097 3.637 190 HA LYS 24 HA LYS 24 4.947 -14.967 4.208 191 HB2 LYS 24 HB2 LYS 24 6.491 -13.161 6.080 192 HB3 LYS 24 HB1 LYS 24 5.247 -14.306 6.551 193 HG2 LYS 24 HG2 LYS 24 6.830 -15.984 5.291 194 HG3 LYS 24 HG1 LYS 24 8.033 -14.768 5.731 195 HD2 LYS 24 HD2 LYS 24 6.134 -15.635 7.832 196 HD3 LYS 24 HD1 LYS 24 7.373 -16.781 7.343 197 HE2 LYS 24 HE2 LYS 24 9.114 -15.219 7.878 198 HE3 LYS 24 HE1 LYS 24 7.929 -13.948 8.195 199 HZ1 LYS 24 HZ1 LYS 24 8.742 -14.919 10.246 200 HZ2 LYS 24 HZ2 LYS 24 8.243 -16.458 9.757 201 HZ3 LYS 24 HZ3 LYS 24 7.095 -15.253 10.058 202 H HIS 25 HN HIS 25 3.856 -13.343 6.261 203 HA HIS 25 HA HIS 25 1.702 -12.136 5.277 204 HB2 HIS 25 HB2 HIS 25 3.106 -10.462 7.290 205 HB3 HIS 25 HB1 HIS 25 1.431 -10.977 7.253 206 HD1 HIS 25 HD1 HIS 25 2.786 -11.020 9.866 207 HD2 HIS 25 HD2 HIS 25 2.969 -14.303 7.310 208 HE1 HIS 25 HE1 HIS 25 3.361 -12.981 11.317 209 HE2 HIS 25 HE2 HIS 25 3.363 -14.972 9.775 210 H LEU 26 HN LEU 26 1.588 -10.838 3.521 211 HA LEU 26 HA LEU 26 3.577 -8.730 3.212 212 HB2 LEU 26 HB2 LEU 26 3.223 -10.099 1.268 213 HB3 LEU 26 HB1 LEU 26 1.497 -9.795 1.303 214 HG LEU 26 HG LEU 26 1.770 -7.569 0.535 215 HD11 LEU 26 HD11 LEU 26 4.676 -7.930 1.202 216 HD12 LEU 26 HD12 LEU 26 3.536 -6.782 1.894 217 HD13 LEU 26 HD13 LEU 26 4.055 -6.601 0.232 218 HD21 LEU 26 HD21 LEU 26 4.009 -8.642 -1.063 219 HD22 LEU 26 HD22 LEU 26 2.441 -7.996 -1.579 220 HD23 LEU 26 HD23 LEU 26 2.559 -9.658 -0.999 221 H LYS 27 HN LYS 27 3.198 -6.711 3.550 222 HA LYS 27 HA LYS 27 0.483 -5.870 4.328 223 HB2 LYS 27 HB2 LYS 27 1.759 -6.131 6.317 224 HB3 LYS 27 HB1 LYS 27 3.158 -5.368 5.596 225 HG2 LYS 27 HG2 LYS 27 2.281 -3.816 7.112 226 HG3 LYS 27 HG1 LYS 27 1.828 -3.247 5.503 227 HD2 LYS 27 HD2 LYS 27 -0.032 -3.045 7.084 228 HD3 LYS 27 HD1 LYS 27 -0.406 -4.193 5.797 229 HE2 LYS 27 HE2 LYS 27 0.070 -6.054 7.259 230 HE3 LYS 27 HE1 LYS 27 0.608 -4.961 8.532 231 HZ1 LYS 27 HZ1 LYS 27 -2.130 -4.882 7.415 232 HZ2 LYS 27 HZ2 LYS 27 -1.565 -4.184 8.853 233 HZ3 LYS 27 HZ3 LYS 27 -1.714 -5.863 8.733 234 H ILE 28 HN ILE 28 -0.148 -3.856 3.676 235 HA ILE 28 HA ILE 28 1.738 -2.379 1.973 236 HB ILE 28 HB ILE 28 -1.278 -2.360 1.798 237 HG12 ILE 28 HG12 ILE 28 -0.364 -4.546 1.160 238 HG13 ILE 28 HG11 ILE 28 -0.974 -3.702 -0.244 239 HG21 ILE 28 HG21 ILE 28 -0.907 -1.203 -0.338 240 HG22 ILE 28 HG22 ILE 28 0.827 -1.187 -0.019 241 HG23 ILE 28 HG23 ILE 28 -0.271 -0.286 1.028 242 HD11 ILE 28 HD11 ILE 28 1.898 -3.917 0.538 243 HD12 ILE 28 HD12 ILE 28 1.271 -3.091 -0.892 244 HD13 ILE 28 HD13 ILE 28 1.090 -4.839 -0.729 245 H LEU 29 HN LEU 29 2.503 -0.677 3.004 246 HA LEU 29 HA LEU 29 1.349 0.353 5.384 247 HB2 LEU 29 HB2 LEU 29 3.832 0.389 4.497 248 HB3 LEU 29 HB1 LEU 29 3.345 1.909 3.771 249 HG LEU 29 HG LEU 29 4.509 2.245 5.895 250 HD11 LEU 29 HD11 LEU 29 2.913 3.925 5.264 251 HD12 LEU 29 HD12 LEU 29 2.828 3.677 7.007 252 HD13 LEU 29 HD13 LEU 29 1.585 2.990 5.957 253 HD21 LEU 29 HD21 LEU 29 2.200 0.769 7.153 254 HD22 LEU 29 HD22 LEU 29 3.530 1.555 8.002 255 HD23 LEU 29 HD23 LEU 29 3.843 0.150 6.984 256 H ASN 30 HN ASN 30 -0.328 1.681 5.547 257 HA ASN 30 HA ASN 30 -1.324 3.250 3.388 258 HB2 ASN 30 HB2 ASN 30 -1.921 2.964 6.288 259 HB3 ASN 30 HB1 ASN 30 -2.423 4.458 5.513 260 HD21 ASN 30 HD21 ASN 30 -2.313 1.334 3.920 261 HD22 ASN 30 HD22 ASN 30 -4.022 1.167 3.733 262 H THR 31 HN THR 31 0.334 4.541 2.604 263 HA THR 31 HA THR 31 1.940 6.122 4.324 264 HB THR 31 HB THR 31 2.376 7.157 1.917 265 HG1 THR 31 HG1 THR 31 2.165 4.995 0.605 266 HG21 THR 31 HG21 THR 31 4.086 5.382 1.646 267 HG22 THR 31 HG22 THR 31 3.314 4.501 2.963 268 HG23 THR 31 HG23 THR 31 4.039 6.078 3.264 269 HA PRO 32 HA PRO 32 0.400 10.338 4.532 270 HB2 PRO 32 HB2 PRO 32 2.703 10.826 2.682 271 HB3 PRO 32 HB1 PRO 32 2.200 11.735 4.114 272 HG2 PRO 32 HG2 PRO 32 4.207 10.035 4.281 273 HG3 PRO 32 HG1 PRO 32 3.006 10.119 5.579 274 HD2 PRO 32 HD2 PRO 32 3.383 8.059 3.477 275 HD3 PRO 32 HD1 PRO 32 2.803 7.885 5.141 276 H ASN 33 HN ASN 33 -0.009 8.547 1.811 277 HA ASN 33 HA ASN 33 -0.813 8.820 -0.282 278 HB2 ASN 33 HB2 ASN 33 -1.852 10.703 -0.976 279 HB3 ASN 33 HB1 ASN 33 -1.611 11.235 0.675 280 HD21 ASN 33 HD21 ASN 33 0.162 12.687 1.094 281 HD22 ASN 33 HD22 ASN 33 0.731 13.737 -0.161 282 H CYS 34 HN CYS 34 1.600 8.123 0.475 283 HA CYS 34 HA CYS 34 3.375 8.927 -1.695 284 HB2 CYS 34 HB2 CYS 34 3.609 6.992 0.618 285 HB3 CYS 34 HB1 CYS 34 4.817 7.087 -0.628 286 H ALA 35 HN ALA 35 4.250 6.870 -2.938 287 HA ALA 35 HA ALA 35 2.237 5.351 -4.084 288 HB1 ALA 35 HB1 ALA 35 3.978 3.792 -4.797 289 HB2 ALA 35 HB2 ALA 35 5.109 4.522 -3.654 290 HB3 ALA 35 HB3 ALA 35 4.500 5.465 -5.015 291 H LEU 36 HN LEU 36 1.531 3.214 -3.714 292 HA LEU 36 HA LEU 36 1.029 2.572 -1.032 293 HB2 LEU 36 HB2 LEU 36 0.639 1.309 -3.703 294 HB3 LEU 36 HB1 LEU 36 0.477 0.297 -2.295 295 HG LEU 36 HG LEU 36 -1.289 1.798 -1.427 296 HD11 LEU 36 HD11 LEU 36 -1.021 3.211 -4.078 297 HD12 LEU 36 HD12 LEU 36 -0.481 3.859 -2.529 298 HD13 LEU 36 HD13 LEU 36 -2.199 3.559 -2.810 299 HD21 LEU 36 HD21 LEU 36 -3.005 1.205 -3.065 300 HD22 LEU 36 HD22 LEU 36 -1.906 -0.140 -2.760 301 HD23 LEU 36 HD23 LEU 36 -1.746 0.812 -4.235 302 H GLN 37 HN GLN 37 2.446 1.818 0.343 303 HA GLN 37 HA GLN 37 4.994 0.818 -0.555 304 HB2 GLN 37 HB2 GLN 37 3.923 1.104 2.238 305 HB3 GLN 37 HB1 GLN 37 5.604 0.919 1.777 306 HG2 GLN 37 HG2 GLN 37 3.966 3.260 0.852 307 HG3 GLN 37 HG1 GLN 37 4.786 3.235 2.414 308 HE21 GLN 37 HE21 GLN 37 6.053 4.891 1.880 309 HE22 GLN 37 HE22 GLN 37 7.378 4.748 0.779 310 H ILE 38 HN ILE 38 5.281 -1.257 -0.991 311 HA ILE 38 HA ILE 38 3.565 -3.220 0.272 312 HB ILE 38 HB ILE 38 5.599 -3.771 -1.882 313 HG12 ILE 38 HG12 ILE 38 3.247 -3.606 -3.229 314 HG13 ILE 38 HG11 ILE 38 3.024 -2.323 -2.058 315 HG21 ILE 38 HG21 ILE 38 4.794 -5.780 -1.073 316 HG22 ILE 38 HG22 ILE 38 3.717 -5.462 -2.437 317 HG23 ILE 38 HG23 ILE 38 3.166 -5.133 -0.789 318 HD11 ILE 38 HD11 ILE 38 3.900 -1.353 -4.022 319 HD12 ILE 38 HD12 ILE 38 5.175 -2.567 -4.137 320 HD13 ILE 38 HD13 ILE 38 5.209 -1.374 -2.842 321 H VAL 39 HN VAL 39 4.312 -3.678 2.275 322 HA VAL 39 HA VAL 39 7.210 -4.024 2.629 323 HB VAL 39 HB VAL 39 5.799 -2.312 4.012 324 HG11 VAL 39 HG11 VAL 39 4.947 -3.162 6.124 325 HG12 VAL 39 HG12 VAL 39 5.209 -4.811 5.557 326 HG13 VAL 39 HG13 VAL 39 4.043 -3.771 4.738 327 HG21 VAL 39 HG21 VAL 39 7.282 -2.585 5.938 328 HG22 VAL 39 HG22 VAL 39 8.146 -2.763 4.410 329 HG23 VAL 39 HG23 VAL 39 7.728 -4.190 5.358 330 H ALA 40 HN ALA 40 8.025 -5.992 3.211 331 HA ALA 40 HA ALA 40 6.047 -8.151 3.567 332 HB1 ALA 40 HB1 ALA 40 7.182 -9.482 1.905 333 HB2 ALA 40 HB2 ALA 40 8.378 -8.210 1.664 334 HB3 ALA 40 HB3 ALA 40 6.701 -7.939 1.204 335 H ARG 41 HN ARG 41 6.646 -9.799 4.896 336 HA ARG 41 HA ARG 41 9.299 -9.628 6.131 337 HB2 ARG 41 HB2 ARG 41 6.738 -11.013 6.879 338 HB3 ARG 41 HB1 ARG 41 8.266 -11.408 7.661 339 HG2 ARG 41 HG2 ARG 41 7.482 -8.554 7.509 340 HG3 ARG 41 HG1 ARG 41 6.636 -9.589 8.638 341 HD2 ARG 41 HD2 ARG 41 8.805 -10.291 9.577 342 HD3 ARG 41 HD1 ARG 41 9.595 -9.144 8.498 343 HE ARG 41 HE ARG 41 7.798 -7.619 9.840 344 HH11 ARG 41 HH11 ARG 41 10.353 -9.802 10.820 345 HH12 ARG 41 HH12 ARG 41 10.630 -8.998 12.334 346 HH21 ARG 41 HH21 ARG 41 8.176 -6.545 11.824 347 HH22 ARG 41 HH22 ARG 41 9.400 -7.142 12.899 348 H LEU 42 HN LEU 42 10.870 -11.024 5.525 349 HA LEU 42 HA LEU 42 10.351 -12.812 3.384 350 HB2 LEU 42 HB2 LEU 42 12.752 -12.201 5.043 351 HB3 LEU 42 HB1 LEU 42 12.769 -13.605 3.996 352 HG LEU 42 HG LEU 42 12.234 -10.788 3.059 353 HD11 LEU 42 HD11 LEU 42 14.735 -12.459 2.853 354 HD12 LEU 42 HD12 LEU 42 14.525 -11.028 3.863 355 HD13 LEU 42 HD13 LEU 42 14.482 -10.882 2.106 356 HD21 LEU 42 HD21 LEU 42 11.202 -12.469 1.635 357 HD22 LEU 42 HD22 LEU 42 12.724 -13.353 1.542 358 HD23 LEU 42 HD23 LEU 42 12.591 -11.749 0.823 359 H LYS 43 HN LYS 43 10.496 -15.024 3.253 360 HA LYS 43 HA LYS 43 8.819 -16.357 4.974 361 HB2 LYS 43 HB2 LYS 43 9.581 -16.877 2.584 362 HB3 LYS 43 HB1 LYS 43 10.903 -17.740 3.341 363 HG2 LYS 43 HG2 LYS 43 9.415 -19.288 4.364 364 HG3 LYS 43 HG1 LYS 43 8.010 -18.338 3.867 365 HD2 LYS 43 HD2 LYS 43 8.717 -18.716 1.494 366 HD3 LYS 43 HD1 LYS 43 9.935 -19.832 2.094 367 HE2 LYS 43 HE2 LYS 43 8.255 -21.258 2.989 368 HE3 LYS 43 HE1 LYS 43 6.988 -20.096 2.622 369 HZ1 LYS 43 HZ1 LYS 43 8.650 -21.565 0.651 370 HZ2 LYS 43 HZ2 LYS 43 7.497 -20.392 0.259 371 HZ3 LYS 43 HZ3 LYS 43 7.016 -21.841 0.985 372 H ASN 44 HN ASN 44 12.266 -17.141 4.642 373 HA ASN 44 HA ASN 44 12.219 -18.460 7.217 374 HB2 ASN 44 HB2 ASN 44 14.401 -18.128 5.174 375 HB3 ASN 44 HB1 ASN 44 14.593 -19.018 6.675 376 HD21 ASN 44 HD21 ASN 44 11.940 -20.153 6.640 377 HD22 ASN 44 HD22 ASN 44 11.932 -21.350 5.394 378 H ASN 45 HN ASN 45 13.689 -15.667 5.706 379 HA ASN 45 HA ASN 45 15.520 -15.130 7.799 380 HB2 ASN 45 HB2 ASN 45 15.549 -14.411 5.306 381 HB3 ASN 45 HB1 ASN 45 14.591 -13.057 5.864 382 HD21 ASN 45 HD21 ASN 45 16.362 -11.763 5.108 383 HD22 ASN 45 HD22 ASN 45 17.744 -11.536 6.117 384 H ASN 46 HN ASN 46 12.272 -14.117 7.135 385 HA ASN 46 HA ASN 46 10.679 -13.133 8.390 386 HB2 ASN 46 HB2 ASN 46 11.647 -14.651 10.170 387 HB3 ASN 46 HB1 ASN 46 12.550 -13.255 10.744 388 HD21 ASN 46 HD21 ASN 46 11.533 -13.129 12.708 389 HD22 ASN 46 HD22 ASN 46 9.875 -12.672 12.887 390 H ARG 47 HN ARG 47 13.449 -11.608 7.579 391 HA ARG 47 HA ARG 47 13.130 -9.193 9.029 392 HB2 ARG 47 HB2 ARG 47 14.482 -9.621 6.367 393 HB3 ARG 47 HB1 ARG 47 14.698 -8.246 7.440 394 HG2 ARG 47 HG2 ARG 47 15.457 -10.011 9.150 395 HG3 ARG 47 HG1 ARG 47 15.652 -11.055 7.746 396 HD2 ARG 47 HD2 ARG 47 17.041 -9.266 6.713 397 HD3 ARG 47 HD1 ARG 47 16.974 -8.407 8.249 398 HE ARG 47 HE ARG 47 17.926 -10.742 9.058 399 HH11 ARG 47 HH11 ARG 47 18.827 -8.821 6.274 400 HH12 ARG 47 HH12 ARG 47 20.478 -9.354 6.283 401 HH21 ARG 47 HH21 ARG 47 20.096 -11.457 9.057 402 HH22 ARG 47 HH22 ARG 47 21.197 -10.854 7.861 403 H GLN 48 HN GLN 48 11.986 -7.472 8.620 404 HA GLN 48 HA GLN 48 9.898 -7.570 6.651 405 HB2 GLN 48 HB2 GLN 48 9.559 -6.669 8.928 406 HB3 GLN 48 HB1 GLN 48 10.651 -5.346 8.555 407 HG2 GLN 48 HG2 GLN 48 9.161 -4.518 6.883 408 HG3 GLN 48 HG1 GLN 48 8.111 -5.921 7.064 409 HE21 GLN 48 HE21 GLN 48 9.156 -2.923 8.467 410 HE22 GLN 48 HE22 GLN 48 7.899 -2.807 9.648 411 H VAL 49 HN VAL 49 10.035 -6.721 4.695 412 HA VAL 49 HA VAL 49 12.196 -4.819 4.022 413 HB VAL 49 HB VAL 49 11.306 -6.581 1.886 414 HG11 VAL 49 HG11 VAL 49 13.084 -5.080 1.448 415 HG12 VAL 49 HG12 VAL 49 13.756 -6.711 1.451 416 HG13 VAL 49 HG13 VAL 49 13.989 -5.657 2.845 417 HG21 VAL 49 HG21 VAL 49 12.911 -7.731 4.133 418 HG22 VAL 49 HG22 VAL 49 12.642 -8.497 2.568 419 HG23 VAL 49 HG23 VAL 49 11.281 -8.198 3.652 420 H CYS 50 HN CYS 50 11.739 -3.994 1.707 421 HA CYS 50 HA CYS 50 8.870 -3.536 1.328 422 HB2 CYS 50 HB2 CYS 50 11.145 -1.661 0.628 423 HB3 CYS 50 HB1 CYS 50 9.443 -1.368 0.362 424 H ILE 51 HN ILE 51 8.113 -4.327 -0.521 425 HA ILE 51 HA ILE 51 9.967 -5.599 -2.350 426 HB ILE 51 HB ILE 51 7.060 -5.489 -2.989 427 HG12 ILE 51 HG12 ILE 51 8.180 -7.153 -0.715 428 HG13 ILE 51 HG11 ILE 51 7.017 -5.840 -0.554 429 HG21 ILE 51 HG21 ILE 51 7.435 -7.614 -3.881 430 HG22 ILE 51 HG22 ILE 51 8.869 -7.877 -2.893 431 HG23 ILE 51 HG23 ILE 51 8.926 -6.740 -4.241 432 HD11 ILE 51 HD11 ILE 51 5.492 -7.208 -2.055 433 HD12 ILE 51 HD12 ILE 51 5.764 -7.821 -0.429 434 HD13 ILE 51 HD13 ILE 51 6.610 -8.544 -1.793 435 H ASP 52 HN ASP 52 10.398 -5.001 -4.416 436 HA ASP 52 HA ASP 52 10.037 -2.309 -5.196 437 HB2 ASP 52 HB2 ASP 52 11.935 -3.633 -5.964 438 HB3 ASP 52 HB1 ASP 52 10.858 -4.729 -6.811 439 HA PRO 53 HA PRO 53 5.867 -2.733 -6.671 440 HB2 PRO 53 HB2 PRO 53 5.627 -0.272 -7.760 441 HB3 PRO 53 HB1 PRO 53 5.556 -0.565 -6.022 442 HG2 PRO 53 HG2 PRO 53 7.864 0.378 -7.673 443 HG3 PRO 53 HG1 PRO 53 7.292 0.975 -6.111 444 HD2 PRO 53 HD2 PRO 53 9.389 -0.686 -6.327 445 HD3 PRO 53 HD1 PRO 53 8.269 -0.749 -4.959 446 H LYS 54 HN LYS 54 8.644 -2.190 -8.576 447 HA LYS 54 HA LYS 54 7.242 -2.255 -11.115 448 HB2 LYS 54 HB2 LYS 54 10.200 -2.256 -10.533 449 HB3 LYS 54 HB1 LYS 54 9.462 -2.065 -12.118 450 HG2 LYS 54 HG2 LYS 54 8.236 -0.126 -10.581 451 HG3 LYS 54 HG1 LYS 54 9.912 -0.111 -10.033 452 HD2 LYS 54 HD2 LYS 54 9.787 1.421 -11.841 453 HD3 LYS 54 HD1 LYS 54 10.580 -0.029 -12.450 454 HE2 LYS 54 HE2 LYS 54 8.975 0.798 -14.059 455 HE3 LYS 54 HE1 LYS 54 8.503 -0.780 -13.439 456 HZ1 LYS 54 HZ1 LYS 54 7.384 1.834 -12.587 457 HZ2 LYS 54 HZ2 LYS 54 6.940 0.335 -11.950 458 HZ3 LYS 54 HZ3 LYS 54 6.611 0.695 -13.567 459 H LEU 55 HN LEU 55 8.321 -4.471 -8.873 460 HA LEU 55 HA LEU 55 9.138 -6.647 -10.395 461 HB2 LEU 55 HB2 LEU 55 7.818 -6.219 -7.768 462 HB3 LEU 55 HB1 LEU 55 7.869 -7.860 -8.391 463 HG LEU 55 HG LEU 55 10.324 -6.144 -8.105 464 HD11 LEU 55 HD11 LEU 55 10.755 -7.420 -6.022 465 HD12 LEU 55 HD12 LEU 55 9.100 -8.030 -6.108 466 HD13 LEU 55 HD13 LEU 55 9.398 -6.300 -5.921 467 HD21 LEU 55 HD21 LEU 55 11.477 -8.298 -8.153 468 HD22 LEU 55 HD22 LEU 55 10.522 -8.031 -9.612 469 HD23 LEU 55 HD23 LEU 55 9.926 -9.116 -8.356 470 H LYS 56 HN LYS 56 8.113 -8.003 -11.701 471 HA LYS 56 HA LYS 56 5.634 -7.238 -12.782 472 HB2 LYS 56 HB2 LYS 56 7.118 -9.839 -13.142 473 HB3 LYS 56 HB1 LYS 56 5.868 -9.199 -14.204 474 HG2 LYS 56 HG2 LYS 56 8.597 -8.029 -13.708 475 HG3 LYS 56 HG1 LYS 56 8.012 -8.785 -15.192 476 HD2 LYS 56 HD2 LYS 56 6.422 -7.012 -15.524 477 HD3 LYS 56 HD1 LYS 56 6.822 -6.302 -13.964 478 HE2 LYS 56 HE2 LYS 56 8.770 -6.605 -16.240 479 HE3 LYS 56 HE1 LYS 56 7.855 -5.137 -15.903 480 HZ1 LYS 56 HZ1 LYS 56 10.043 -4.985 -14.943 481 HZ2 LYS 56 HZ2 LYS 56 9.824 -6.428 -14.094 482 HZ3 LYS 56 HZ3 LYS 56 8.900 -5.068 -13.697 483 H TRP 57 HN TRP 57 6.485 -9.565 -10.303 484 HA TRP 57 HA TRP 57 3.817 -10.661 -10.296 485 HB2 TRP 57 HB2 TRP 57 4.496 -12.062 -8.533 486 HB3 TRP 57 HB1 TRP 57 5.901 -11.932 -9.565 487 HD1 TRP 57 HD1 TRP 57 8.068 -10.868 -8.520 488 HE1 TRP 57 HE1 TRP 57 8.754 -10.307 -6.093 489 HE3 TRP 57 HE3 TRP 57 3.476 -11.095 -6.325 490 HZ2 TRP 57 HZ2 TRP 57 7.493 -9.999 -3.591 491 HZ3 TRP 57 HZ3 TRP 57 3.289 -10.642 -3.920 492 HH2 TRP 57 HH2 TRP 57 5.259 -10.111 -2.575 493 H ILE 58 HN ILE 58 5.531 -8.059 -8.810 494 HA ILE 58 HA ILE 58 3.630 -7.581 -6.725 495 HB ILE 58 HB ILE 58 5.860 -5.959 -7.907 496 HG12 ILE 58 HG12 ILE 58 6.375 -7.814 -6.358 497 HG13 ILE 58 HG11 ILE 58 6.844 -6.246 -5.707 498 HG21 ILE 58 HG21 ILE 58 4.301 -4.281 -7.422 499 HG22 ILE 58 HG22 ILE 58 5.384 -4.338 -6.021 500 HG23 ILE 58 HG23 ILE 58 3.787 -5.078 -5.934 501 HD11 ILE 58 HD11 ILE 58 5.103 -6.242 -4.165 502 HD12 ILE 58 HD12 ILE 58 5.696 -7.903 -4.152 503 HD13 ILE 58 HD13 ILE 58 4.223 -7.503 -5.018 504 H GLN 59 HN GLN 59 4.149 -6.249 -9.962 505 HA GLN 59 HA GLN 59 2.163 -4.314 -10.051 506 HB2 GLN 59 HB2 GLN 59 3.181 -6.248 -12.084 507 HB3 GLN 59 HB1 GLN 59 1.993 -5.028 -12.508 508 HG2 GLN 59 HG2 GLN 59 4.680 -4.418 -11.317 509 HG3 GLN 59 HG1 GLN 59 4.370 -4.470 -13.052 510 HE21 GLN 59 HE21 GLN 59 3.983 -2.676 -10.134 511 HE22 GLN 59 HE22 GLN 59 3.283 -1.260 -10.848 512 H GLU 60 HN GLU 60 1.934 -7.758 -10.180 513 HA GLU 60 HA GLU 60 -0.813 -7.899 -10.939 514 HB2 GLU 60 HB2 GLU 60 0.853 -9.949 -9.472 515 HB3 GLU 60 HB1 GLU 60 -0.679 -10.246 -10.271 516 HG2 GLU 60 HG2 GLU 60 1.862 -9.394 -11.624 517 HG3 GLU 60 HG1 GLU 60 1.229 -11.037 -11.574 518 H TYR 61 HN TYR 61 0.929 -7.854 -7.883 519 HA TYR 61 HA TYR 61 -1.403 -8.388 -6.285 520 HB2 TYR 61 HB2 TYR 61 0.781 -8.973 -5.384 521 HB3 TYR 61 HB1 TYR 61 1.345 -7.323 -5.571 522 HD1 TYR 61 HD1 TYR 61 -0.337 -9.643 -3.430 523 HD2 TYR 61 HD2 TYR 61 0.327 -5.514 -4.167 524 HE1 TYR 61 HE1 TYR 61 -1.061 -9.118 -1.158 525 HE2 TYR 61 HE2 TYR 61 -0.414 -4.983 -1.888 526 HH TYR 61 HH TYR 61 -1.735 -5.931 -0.117 527 H LEU 62 HN LEU 62 0.414 -5.687 -7.423 528 HA LEU 62 HA LEU 62 -0.594 -3.568 -6.016 529 HB2 LEU 62 HB2 LEU 62 0.866 -4.031 -8.385 530 HB3 LEU 62 HB1 LEU 62 -0.392 -2.870 -8.777 531 HG LEU 62 HG LEU 62 0.427 -1.539 -6.755 532 HD11 LEU 62 HD11 LEU 62 2.953 -2.004 -6.431 533 HD12 LEU 62 HD12 LEU 62 2.535 -3.632 -7.002 534 HD13 LEU 62 HD13 LEU 62 1.765 -2.976 -5.556 535 HD21 LEU 62 HD21 LEU 62 0.810 -0.831 -9.048 536 HD22 LEU 62 HD22 LEU 62 2.227 -1.877 -9.147 537 HD23 LEU 62 HD23 LEU 62 2.224 -0.496 -8.050 538 H GLU 63 HN GLU 63 -1.919 -5.174 -8.862 539 HA GLU 63 HA GLU 63 -4.014 -3.527 -9.489 540 HB2 GLU 63 HB2 GLU 63 -4.057 -6.527 -9.405 541 HB3 GLU 63 HB1 GLU 63 -5.118 -5.509 -10.352 542 HG2 GLU 63 HG2 GLU 63 -3.258 -4.705 -11.629 543 HG3 GLU 63 HG1 GLU 63 -2.150 -5.654 -10.654 544 H LYS 64 HN LYS 64 -3.903 -6.047 -7.061 545 HA LYS 64 HA LYS 64 -6.612 -5.781 -6.208 546 HB2 LYS 64 HB2 LYS 64 -4.205 -7.073 -4.943 547 HB3 LYS 64 HB1 LYS 64 -5.824 -7.160 -4.256 548 HG2 LYS 64 HG2 LYS 64 -5.747 -9.137 -5.405 549 HG3 LYS 64 HG1 LYS 64 -6.444 -8.072 -6.623 550 HD2 LYS 64 HD2 LYS 64 -4.219 -7.754 -7.604 551 HD3 LYS 64 HD1 LYS 64 -3.551 -8.872 -6.412 552 HE2 LYS 64 HE2 LYS 64 -4.953 -10.660 -7.275 553 HE3 LYS 64 HE1 LYS 64 -5.689 -9.549 -8.428 554 HZ1 LYS 64 HZ1 LYS 64 -3.491 -9.242 -9.435 555 HZ2 LYS 64 HZ2 LYS 64 -4.003 -10.852 -9.508 556 HZ3 LYS 64 HZ3 LYS 64 -2.844 -10.386 -8.369 557 H ALA 65 HN ALA 65 -3.505 -4.630 -5.079 558 HA ALA 65 HA ALA 65 -4.402 -3.405 -2.701 559 HB1 ALA 65 HB1 ALA 65 -1.988 -2.779 -4.390 560 HB2 ALA 65 HB2 ALA 65 -2.067 -4.005 -3.126 561 HB3 ALA 65 HB3 ALA 65 -2.229 -2.297 -2.710 562 H LEU 66 HN LEU 66 -4.317 -2.441 -6.010 563 HA LEU 66 HA LEU 66 -4.779 0.371 -5.462 564 HB2 LEU 66 HB2 LEU 66 -4.325 -1.293 -7.860 565 HB3 LEU 66 HB1 LEU 66 -5.311 0.137 -8.086 566 HG LEU 66 HG LEU 66 -3.502 1.520 -7.193 567 HD11 LEU 66 HD11 LEU 66 -1.321 0.587 -6.752 568 HD12 LEU 66 HD12 LEU 66 -1.900 -1.024 -7.192 569 HD13 LEU 66 HD13 LEU 66 -2.527 -0.231 -5.750 570 HD21 LEU 66 HD21 LEU 66 -1.993 1.307 -9.096 571 HD22 LEU 66 HD22 LEU 66 -3.674 1.141 -9.599 572 HD23 LEU 66 HD23 LEU 66 -2.652 -0.289 -9.447 573 H ASN 67 HN ASN 67 -6.556 -2.410 -5.720 574 HA ASN 67 HA ASN 67 -9.047 -1.269 -6.528 575 HB2 ASN 67 HB2 ASN 67 -8.083 -3.892 -5.739 576 HB3 ASN 67 HB1 ASN 67 -9.714 -3.554 -5.218 577 HD21 ASN 67 HD21 ASN 67 -7.588 -3.870 -7.952 578 HD22 ASN 67 HD22 ASN 67 -8.840 -4.078 -9.132 579 H LYS 68 HN LYS 68 -7.252 -1.223 -3.694 580 HA LYS 68 HA LYS 68 -9.640 -0.787 -2.030 581 HB2 LYS 68 HB2 LYS 68 -6.875 -0.973 -0.905 582 HB3 LYS 68 HB1 LYS 68 -8.407 -1.391 -0.154 583 HG2 LYS 68 HG2 LYS 68 -7.019 -2.981 -2.306 584 HG3 LYS 68 HG1 LYS 68 -7.062 -3.374 -0.588 585 HD2 LYS 68 HD2 LYS 68 -9.525 -3.562 -0.739 586 HD3 LYS 68 HD1 LYS 68 -9.419 -3.268 -2.473 587 HE2 LYS 68 HE2 LYS 68 -8.048 -5.276 -2.723 588 HE3 LYS 68 HE1 LYS 68 -8.131 -5.544 -0.984 589 HZ1 LYS 68 HZ1 LYS 68 -10.522 -5.819 -1.174 590 HZ2 LYS 68 HZ2 LYS 68 -9.711 -6.932 -2.153 591 HZ3 LYS 68 HZ3 LYS 68 -10.442 -5.572 -2.846 592 H GLY 69 HN GLY 69 -9.945 1.173 -1.039 593 HA2 GLY 69 HA2 GLY 69 -7.733 3.074 -1.086 594 HA3 GLY 69 HA1 GLY 69 -9.233 3.555 -1.872 595 H ARG 70 HN ARG 70 -8.743 1.706 1.086 596 HA ARG 70 HA ARG 70 -10.056 3.861 2.584 597 HB2 ARG 70 HB2 ARG 70 -11.285 2.124 3.865 598 HB3 ARG 70 HB1 ARG 70 -11.748 2.198 2.172 599 HG2 ARG 70 HG2 ARG 70 -10.385 0.249 1.691 600 HG3 ARG 70 HG1 ARG 70 -9.852 0.191 3.373 601 HD2 ARG 70 HD2 ARG 70 -12.689 -0.113 2.405 602 HD3 ARG 70 HD1 ARG 70 -11.636 -1.420 2.939 603 HE ARG 70 HE ARG 70 -11.725 0.383 5.022 604 HH11 ARG 70 HH11 ARG 70 -14.055 -1.500 3.224 605 HH12 ARG 70 HH12 ARG 70 -15.102 -1.740 4.590 606 HH21 ARG 70 HH21 ARG 70 -13.108 0.088 6.816 607 HH22 ARG 70 HH22 ARG 70 -14.560 -0.849 6.628 608 H ARG 71 HN ARG 71 -9.935 3.125 5.082 609 HA ARG 71 HA ARG 71 -7.107 3.075 5.604 610 HB2 ARG 71 HB2 ARG 71 -8.718 4.515 6.868 611 HB3 ARG 71 HB1 ARG 71 -9.381 3.058 7.594 612 HG2 ARG 71 HG2 ARG 71 -7.853 4.076 9.132 613 HG3 ARG 71 HG1 ARG 71 -7.154 2.565 8.549 614 HD2 ARG 71 HD2 ARG 71 -5.453 4.278 8.592 615 HD3 ARG 71 HD1 ARG 71 -5.815 3.850 6.922 616 HE ARG 71 HE ARG 71 -7.213 6.157 8.026 617 HH11 ARG 71 HH11 ARG 71 -4.623 4.941 6.003 618 HH12 ARG 71 HH12 ARG 71 -4.334 6.472 5.238 619 HH21 ARG 71 HH21 ARG 71 -6.856 8.158 6.996 620 HH22 ARG 71 HH22 ARG 71 -5.601 8.305 5.805 621 H GLU 72 HN GLU 72 -9.869 1.014 6.516 622 HA GLU 72 HA GLU 72 -8.248 -0.969 7.724 623 HB2 GLU 72 HB2 GLU 72 -11.100 -1.012 6.763 624 HB3 GLU 72 HB1 GLU 72 -10.329 -2.410 7.503 625 HG2 GLU 72 HG2 GLU 72 -10.886 0.265 8.743 626 HG3 GLU 72 HG1 GLU 72 -11.534 -1.308 9.207 627 H GLU 73 HN GLU 73 -7.692 -3.004 7.013 628 HA GLU 73 HA GLU 73 -7.576 -3.335 4.099 629 HB2 GLU 73 HB2 GLU 73 -5.151 -3.889 4.346 630 HB3 GLU 73 HB1 GLU 73 -5.534 -2.209 4.708 631 HG2 GLU 73 HG2 GLU 73 -5.441 -2.638 7.068 632 HG3 GLU 73 HG1 GLU 73 -5.227 -4.364 6.784 633 H LYS 74 HN LYS 74 -7.536 -4.746 7.289 634 HA LYS 74 HA LYS 74 -6.682 -7.325 6.283 635 HB2 LYS 74 HB2 LYS 74 -5.998 -6.165 8.533 636 HB3 LYS 74 HB1 LYS 74 -7.505 -6.852 9.123 637 HG2 LYS 74 HG2 LYS 74 -5.610 -8.295 9.631 638 HG3 LYS 74 HG1 LYS 74 -6.734 -9.088 8.523 639 HD2 LYS 74 HD2 LYS 74 -5.304 -8.541 6.640 640 HD3 LYS 74 HD1 LYS 74 -4.214 -7.651 7.698 641 HE2 LYS 74 HE2 LYS 74 -3.547 -9.648 8.809 642 HE3 LYS 74 HE1 LYS 74 -4.808 -10.584 8.007 643 HZ1 LYS 74 HZ1 LYS 74 -2.581 -9.246 6.577 644 HZ2 LYS 74 HZ2 LYS 74 -3.712 -10.321 5.926 645 HZ3 LYS 74 HZ3 LYS 74 -2.561 -10.875 7.040 646 H VAL 75 HN VAL 75 -9.370 -6.256 8.359 647 HA VAL 75 HA VAL 75 -10.939 -8.533 7.405 648 HB VAL 75 HB VAL 75 -11.664 -6.554 9.575 649 HG11 VAL 75 HG11 VAL 75 -13.210 -8.304 10.309 650 HG12 VAL 75 HG12 VAL 75 -12.728 -9.304 8.939 651 HG13 VAL 75 HG13 VAL 75 -13.560 -7.774 8.666 652 HG21 VAL 75 HG21 VAL 75 -9.584 -7.678 10.158 653 HG22 VAL 75 HG22 VAL 75 -10.330 -9.246 9.848 654 HG23 VAL 75 HG23 VAL 75 -10.906 -8.241 11.179 655 H GLY 76 HN GLY 76 -10.743 -5.070 7.281 656 HA2 GLY 76 HA2 GLY 76 -11.743 -3.568 5.852 657 HA3 GLY 76 HA1 GLY 76 -12.470 -4.931 5.014 658 H LYS 77 HN LYS 77 -14.591 -5.168 5.173 659 HA LYS 77 HA LYS 77 -16.755 -4.966 5.872 660 HB2 LYS 77 HB2 LYS 77 -15.427 -4.979 8.589 661 HB3 LYS 77 HB1 LYS 77 -17.130 -5.270 8.296 662 HG2 LYS 77 HG2 LYS 77 -14.869 -6.986 7.298 663 HG3 LYS 77 HG1 LYS 77 -15.892 -7.339 8.688 664 HD2 LYS 77 HD2 LYS 77 -17.023 -8.562 7.147 665 HD3 LYS 77 HD1 LYS 77 -17.792 -7.008 6.831 666 HE2 LYS 77 HE2 LYS 77 -17.133 -8.078 4.749 667 HE3 LYS 77 HE1 LYS 77 -16.209 -6.601 5.005 668 HZ1 LYS 77 HZ1 LYS 77 -14.347 -7.921 5.769 669 HZ2 LYS 77 HZ2 LYS 77 -14.818 -8.418 4.221 670 HZ3 LYS 77 HZ3 LYS 77 -15.238 -9.347 5.572 671 H LYS 78 HN LYS 78 -17.619 -3.617 8.350 672 HA LYS 78 HA LYS 78 -17.021 -0.833 7.612 673 HB2 LYS 78 HB2 LYS 78 -19.620 -1.988 8.637 674 HB3 LYS 78 HB1 LYS 78 -19.306 -0.269 8.438 675 HG2 LYS 78 HG2 LYS 78 -18.948 -0.630 6.035 676 HG3 LYS 78 HG1 LYS 78 -19.329 -2.338 6.251 677 HD2 LYS 78 HD2 LYS 78 -21.567 -1.738 7.038 678 HD3 LYS 78 HD1 LYS 78 -21.181 -0.028 6.833 679 HE2 LYS 78 HE2 LYS 78 -20.815 -0.427 4.427 680 HE3 LYS 78 HE1 LYS 78 -21.278 -2.113 4.654 681 HZ1 LYS 78 HZ1 LYS 78 -23.118 -0.798 3.827 682 HZ2 LYS 78 HZ2 LYS 78 -23.013 0.239 5.155 683 HZ3 LYS 78 HZ3 LYS 78 -23.460 -1.376 5.377 684 H GLU 79 HN GLU 79 -15.363 -2.061 9.329 685 HA GLU 79 HA GLU 79 -16.213 -1.337 12.026 686 HB2 GLU 79 HB2 GLU 79 -14.026 -2.439 12.676 687 HB3 GLU 79 HB1 GLU 79 -15.244 -3.484 11.967 688 HG2 GLU 79 HG2 GLU 79 -14.071 -3.304 9.792 689 HG3 GLU 79 HG1 GLU 79 -12.806 -2.377 10.599 690 H LYS 80 HN LYS 80 -16.099 0.897 10.781 691 HA LYS 80 HA LYS 80 -13.431 2.045 10.782 692 HB2 LYS 80 HB2 LYS 80 -16.102 3.344 10.225 693 HB3 LYS 80 HB1 LYS 80 -14.525 4.062 9.945 694 HG2 LYS 80 HG2 LYS 80 -14.032 2.386 8.263 695 HG3 LYS 80 HG1 LYS 80 -15.582 1.604 8.570 696 HD2 LYS 80 HD2 LYS 80 -15.904 2.905 6.630 697 HD3 LYS 80 HD1 LYS 80 -16.664 3.811 7.935 698 HE2 LYS 80 HE2 LYS 80 -13.840 4.361 7.076 699 HE3 LYS 80 HE1 LYS 80 -15.208 5.089 6.242 700 HZ1 LYS 80 HZ1 LYS 80 -14.356 6.575 7.906 701 HZ2 LYS 80 HZ2 LYS 80 -14.527 5.413 9.113 702 HZ3 LYS 80 HZ3 LYS 80 -15.898 6.059 8.370 703 H ILE 81 HN ILE 81 -15.964 1.607 12.948 704 HA ILE 81 HA ILE 81 -15.615 3.985 14.500 705 HB ILE 81 HB ILE 81 -17.753 2.841 14.524 706 HG12 ILE 81 HG12 ILE 81 -18.096 2.641 16.987 707 HG13 ILE 81 HG11 ILE 81 -16.352 2.733 17.203 708 HG21 ILE 81 HG21 ILE 81 -17.023 0.562 14.183 709 HG22 ILE 81 HG22 ILE 81 -18.044 0.661 15.616 710 HG23 ILE 81 HG23 ILE 81 -16.295 0.528 15.789 711 HD11 ILE 81 HD11 ILE 81 -17.428 4.872 17.629 712 HD12 ILE 81 HD12 ILE 81 -18.088 4.874 15.994 713 HD13 ILE 81 HD13 ILE 81 -16.345 4.968 16.242 714 H GLY 82 HN GLY 82 -14.327 0.713 14.601 715 HA2 GLY 82 HA2 GLY 82 -12.906 1.380 17.090 716 HA3 GLY 82 HA1 GLY 82 -13.270 -0.250 16.545 717 H LYS 83 HN LYS 83 -11.039 2.345 16.461 718 HA LYS 83 HA LYS 83 -9.425 1.203 14.355 719 HB2 LYS 83 HB2 LYS 83 -8.891 3.442 16.318 720 HB3 LYS 83 HB1 LYS 83 -7.718 2.903 15.133 721 HG2 LYS 83 HG2 LYS 83 -8.730 4.819 14.233 722 HG3 LYS 83 HG1 LYS 83 -9.422 3.453 13.363 723 HD2 LYS 83 HD2 LYS 83 -11.444 3.582 14.673 724 HD3 LYS 83 HD1 LYS 83 -10.741 4.837 15.697 725 HE2 LYS 83 HE2 LYS 83 -10.614 6.344 13.789 726 HE3 LYS 83 HE1 LYS 83 -11.259 5.089 12.736 727 HZ1 LYS 83 HZ1 LYS 83 -12.912 6.759 13.488 728 HZ2 LYS 83 HZ2 LYS 83 -12.726 6.186 15.067 729 HZ3 LYS 83 HZ3 LYS 83 -13.331 5.165 13.860 730 H LYS 84 HN LYS 84 -8.338 2.105 17.591 731 HA LYS 84 HA LYS 84 -6.936 1.098 19.067 732 HB2 LYS 84 HB2 LYS 84 -8.572 -1.307 18.243 733 HB3 LYS 84 HB1 LYS 84 -7.509 -1.260 19.642 734 HG2 LYS 84 HG2 LYS 84 -9.922 0.494 19.224 735 HG3 LYS 84 HG1 LYS 84 -9.853 -0.936 20.254 736 HD2 LYS 84 HD2 LYS 84 -8.088 0.149 21.594 737 HD3 LYS 84 HD1 LYS 84 -8.236 1.591 20.590 738 HE2 LYS 84 HE2 LYS 84 -10.591 1.796 21.277 739 HE3 LYS 84 HE1 LYS 84 -10.395 0.386 22.317 740 HZ1 LYS 84 HZ1 LYS 84 -8.738 1.589 23.586 741 HZ2 LYS 84 HZ2 LYS 84 -10.192 2.452 23.556 742 HZ3 LYS 84 HZ3 LYS 84 -8.899 2.939 22.579 743 H LYS 85 HN LYS 85 -5.978 -1.629 19.028 744 HA LYS 85 HA LYS 85 -3.932 -1.421 16.974 745 HB2 LYS 85 HB2 LYS 85 -4.319 -3.370 19.259 746 HB3 LYS 85 HB1 LYS 85 -2.949 -3.391 18.157 747 HG2 LYS 85 HG2 LYS 85 -2.179 -1.287 18.942 748 HG3 LYS 85 HG1 LYS 85 -3.662 -1.017 19.855 749 HD2 LYS 85 HD2 LYS 85 -3.106 -2.923 21.300 750 HD3 LYS 85 HD1 LYS 85 -1.610 -3.164 20.393 751 HE2 LYS 85 HE2 LYS 85 -1.276 -1.920 22.507 752 HE3 LYS 85 HE1 LYS 85 -0.789 -1.008 21.080 753 HZ1 LYS 85 HZ1 LYS 85 -2.033 0.359 22.637 754 HZ2 LYS 85 HZ2 LYS 85 -3.359 -0.683 22.527 755 HZ3 LYS 85 HZ3 LYS 85 -2.869 0.202 21.178 756 H ARG 86 HN ARG 86 -4.155 -2.412 15.059 757 HA ARG 86 HA ARG 86 -6.426 -4.095 14.599 758 HB2 ARG 86 HB2 ARG 86 -5.564 -2.443 12.935 759 HB3 ARG 86 HB1 ARG 86 -4.155 -3.467 12.707 760 HG2 ARG 86 HG2 ARG 86 -5.829 -3.761 10.940 761 HG3 ARG 86 HG1 ARG 86 -5.539 -5.249 11.842 762 HD2 ARG 86 HD2 ARG 86 -7.903 -5.000 11.467 763 HD3 ARG 86 HD1 ARG 86 -7.564 -4.790 13.180 764 HE ARG 86 HE ARG 86 -8.131 -2.574 11.305 765 HH11 ARG 86 HH11 ARG 86 -8.277 -3.980 14.529 766 HH12 ARG 86 HH12 ARG 86 -9.195 -2.663 15.186 767 HH21 ARG 86 HH21 ARG 86 -9.366 -0.877 12.170 768 HH22 ARG 86 HH22 ARG 86 -9.845 -0.921 13.846 769 H GLN 87 HN GLN 87 -3.277 -4.667 15.670 770 HA GLN 87 HA GLN 87 -3.032 -7.353 14.698 771 HB2 GLN 87 HB2 GLN 87 -1.652 -5.847 16.914 772 HB3 GLN 87 HB1 GLN 87 -1.326 -7.541 16.584 773 HG2 GLN 87 HG2 GLN 87 -0.662 -6.926 14.286 774 HG3 GLN 87 HG1 GLN 87 -0.895 -5.230 14.708 775 HE21 GLN 87 HE21 GLN 87 1.278 -4.775 14.294 776 HE22 GLN 87 HE22 GLN 87 2.531 -5.249 15.389 777 H LYS 88 HN LYS 88 -4.883 -5.843 17.091 778 HA LYS 88 HA LYS 88 -5.107 -7.885 19.018 779 HB2 LYS 88 HB2 LYS 88 -5.845 -5.634 19.500 780 HB3 LYS 88 HB1 LYS 88 -7.021 -5.696 18.197 781 HG2 LYS 88 HG2 LYS 88 -8.197 -7.508 19.426 782 HG3 LYS 88 HG1 LYS 88 -7.079 -7.260 20.766 783 HD2 LYS 88 HD2 LYS 88 -8.900 -5.149 19.613 784 HD3 LYS 88 HD1 LYS 88 -9.226 -6.077 21.077 785 HE2 LYS 88 HE2 LYS 88 -6.840 -4.279 20.662 786 HE3 LYS 88 HE1 LYS 88 -8.304 -3.826 21.530 787 HZ1 LYS 88 HZ1 LYS 88 -7.870 -5.615 23.101 788 HZ2 LYS 88 HZ2 LYS 88 -6.580 -4.526 23.052 789 HZ3 LYS 88 HZ3 LYS 88 -6.450 -6.025 22.279 790 H LYS 89 HN LYS 89 -5.588 -9.903 18.393 791 HA LYS 89 HA LYS 89 -7.676 -10.355 16.404 792 HB2 LYS 89 HB2 LYS 89 -5.370 -11.591 16.575 793 HB3 LYS 89 HB1 LYS 89 -6.172 -12.535 17.820 794 HG2 LYS 89 HG2 LYS 89 -6.424 -13.790 15.869 795 HG3 LYS 89 HG1 LYS 89 -7.980 -12.990 16.084 796 HD2 LYS 89 HD2 LYS 89 -7.365 -12.839 13.767 797 HD3 LYS 89 HD1 LYS 89 -7.223 -11.232 14.482 798 HE2 LYS 89 HE2 LYS 89 -4.821 -11.504 14.680 799 HE3 LYS 89 HE1 LYS 89 -4.933 -13.152 14.067 800 HZ1 LYS 89 HZ1 LYS 89 -4.213 -11.591 12.365 801 HZ2 LYS 89 HZ2 LYS 89 -5.641 -10.703 12.545 802 HZ3 LYS 89 HZ3 LYS 89 -5.699 -12.289 11.956 803 H ARG 90 HN ARG 90 -9.030 -9.286 18.228 804 HA ARG 90 HA ARG 90 -9.694 -10.990 20.464 805 HB2 ARG 90 HB2 ARG 90 -9.614 -8.499 20.629 806 HB3 ARG 90 HB1 ARG 90 -11.009 -8.422 19.562 807 HG2 ARG 90 HG2 ARG 90 -12.315 -9.687 21.221 808 HG3 ARG 90 HG1 ARG 90 -10.917 -9.671 22.300 809 HD2 ARG 90 HD2 ARG 90 -10.958 -7.189 22.218 810 HD3 ARG 90 HD1 ARG 90 -12.442 -7.283 21.272 811 HE ARG 90 HE ARG 90 -12.540 -8.686 23.792 812 HH11 ARG 90 HH11 ARG 90 -13.086 -5.655 22.138 813 HH12 ARG 90 HH12 ARG 90 -14.171 -5.044 23.345 814 HH21 ARG 90 HH21 ARG 90 -13.964 -7.885 25.388 815 HH22 ARG 90 HH22 ARG 90 -14.681 -6.319 25.188 816 H LYS 91 HN LYS 91 -10.633 -12.811 19.700 817 HA LYS 91 HA LYS 91 -12.220 -14.217 18.929 818 HB2 LYS 91 HB2 LYS 91 -13.989 -11.767 19.028 819 HB3 LYS 91 HB1 LYS 91 -14.558 -13.415 18.796 820 HG2 LYS 91 HG2 LYS 91 -13.660 -14.024 20.993 821 HG3 LYS 91 HG1 LYS 91 -13.128 -12.360 21.226 822 HD2 LYS 91 HD2 LYS 91 -15.456 -11.605 21.059 823 HD3 LYS 91 HD1 LYS 91 -15.977 -13.278 20.850 824 HE2 LYS 91 HE2 LYS 91 -14.567 -12.148 23.266 825 HE3 LYS 91 HE1 LYS 91 -16.284 -12.531 23.157 826 HZ1 LYS 91 HZ1 LYS 91 -14.060 -14.488 22.908 827 HZ2 LYS 91 HZ2 LYS 91 -15.710 -14.853 22.822 828 HZ3 LYS 91 HZ3 LYS 91 -15.045 -14.284 24.266 829 H ALA 92 HN ALA 92 -13.978 -14.389 17.059 830 HA ALA 92 HA ALA 92 -14.267 -14.599 14.821 831 HB1 ALA 92 HB1 ALA 92 -13.151 -11.795 14.739 832 HB2 ALA 92 HB2 ALA 92 -14.843 -12.223 14.995 833 HB3 ALA 92 HB3 ALA 92 -14.063 -12.589 13.457 834 H ALA 93 HN ALA 93 -12.874 -13.867 12.613 835 HA ALA 93 HA ALA 93 -11.139 -14.513 11.308 836 HB1 ALA 93 HB1 ALA 93 -10.129 -12.560 12.381 837 HB2 ALA 93 HB2 ALA 93 -8.924 -13.795 12.019 838 HB3 ALA 93 HB3 ALA 93 -9.509 -13.591 13.670 839 H GLN 94 HN GLN 94 -12.212 -16.709 12.174 840 HA GLN 94 HA GLN 94 -10.552 -18.321 13.848 841 HB2 GLN 94 HB2 GLN 94 -12.855 -19.078 12.044 842 HB3 GLN 94 HB1 GLN 94 -12.093 -20.154 13.211 843 HG2 GLN 94 HG2 GLN 94 -12.728 -18.593 15.012 844 HG3 GLN 94 HG1 GLN 94 -13.569 -17.604 13.822 845 HE21 GLN 94 HE21 GLN 94 -14.560 -19.001 16.182 846 HE22 GLN 94 HE22 GLN 94 -15.817 -20.051 15.628 847 H LYS 95 HN LYS 95 -10.380 -17.423 10.617 848 HA LYS 95 HA LYS 95 -8.854 -19.775 9.805 849 HB2 LYS 95 HB2 LYS 95 -10.483 -18.530 8.272 850 HB3 LYS 95 HB1 LYS 95 -9.292 -17.241 8.219 851 HG2 LYS 95 HG2 LYS 95 -7.644 -18.898 7.346 852 HG3 LYS 95 HG1 LYS 95 -8.963 -20.065 7.239 853 HD2 LYS 95 HD2 LYS 95 -8.731 -19.112 5.082 854 HD3 LYS 95 HD1 LYS 95 -10.174 -18.391 5.793 855 HE2 LYS 95 HE2 LYS 95 -8.892 -16.673 4.694 856 HE3 LYS 95 HE1 LYS 95 -8.821 -16.418 6.437 857 HZ1 LYS 95 HZ1 LYS 95 -6.633 -17.488 6.442 858 HZ2 LYS 95 HZ2 LYS 95 -6.655 -16.120 5.451 859 HZ3 LYS 95 HZ3 LYS 95 -6.707 -17.661 4.762 860 H ARG 96 HN ARG 96 -8.214 -17.452 11.802 861 HA ARG 96 HA ARG 96 -6.322 -16.575 12.683 862 HB2 ARG 96 HB2 ARG 96 -4.902 -17.895 10.364 863 HB3 ARG 96 HB1 ARG 96 -4.098 -17.061 11.687 864 HG2 ARG 96 HG2 ARG 96 -5.841 -19.501 11.961 865 HG3 ARG 96 HG1 ARG 96 -4.078 -19.484 11.985 866 HD2 ARG 96 HD2 ARG 96 -5.888 -18.084 13.951 867 HD3 ARG 96 HD1 ARG 96 -5.008 -19.581 14.246 868 HE ARG 96 HE ARG 96 -2.967 -18.086 13.713 869 HH11 ARG 96 HH11 ARG 96 -5.851 -17.081 15.431 870 HH12 ARG 96 HH12 ARG 96 -5.023 -15.889 16.381 871 HH21 ARG 96 HH21 ARG 96 -1.878 -16.516 14.956 872 HH22 ARG 96 HH22 ARG 96 -2.764 -15.560 16.102 873 H LYS 97 HN LYS 97 -5.811 -16.357 9.164 874 HA LYS 97 HA LYS 97 -5.568 -14.598 7.764 875 HB2 LYS 97 HB2 LYS 97 -7.931 -14.268 8.506 876 HB3 LYS 97 HB1 LYS 97 -7.353 -13.143 9.724 877 HG2 LYS 97 HG2 LYS 97 -6.587 -11.617 8.045 878 HG3 LYS 97 HG1 LYS 97 -6.929 -12.781 6.764 879 HD2 LYS 97 HD2 LYS 97 -9.022 -11.615 8.599 880 HD3 LYS 97 HD1 LYS 97 -8.641 -10.975 7.001 881 HE2 LYS 97 HE2 LYS 97 -9.264 -13.104 5.987 882 HE3 LYS 97 HE1 LYS 97 -9.596 -13.780 7.576 883 HZ1 LYS 97 HZ1 LYS 97 -11.051 -11.530 6.299 884 HZ2 LYS 97 HZ2 LYS 97 -11.350 -12.121 7.854 885 HZ3 LYS 97 HZ3 LYS 97 -11.631 -13.105 6.509 886 H ASN 98 HN ASN 98 -3.326 -14.679 8.633 887 HA ASN 98 HA ASN 98 -2.606 -12.021 9.664 888 HB2 ASN 98 HB2 ASN 98 -1.220 -14.628 10.350 889 HB3 ASN 98 HB1 ASN 98 -0.659 -13.026 10.817 890 HD21 ASN 98 HD21 ASN 98 -2.816 -15.599 11.487 891 HD22 ASN 98 HD22 ASN 98 -3.510 -14.935 12.923 Start of MODEL 14 1 H1 LYS 1 HT1 LYS 1 0.760 17.763 13.000 2 H2 LYS 1 HT2 LYS 1 1.962 16.718 12.435 3 H3 LYS 1 HT3 LYS 1 0.493 16.837 11.613 4 HA LYS 1 HA LYS 1 0.950 19.098 11.000 5 HB2 LYS 1 HB2 LYS 1 2.298 19.512 13.101 6 HB3 LYS 1 HB1 LYS 1 3.634 18.676 12.331 7 HG2 LYS 1 HG2 LYS 1 3.821 20.369 10.655 8 HG3 LYS 1 HG1 LYS 1 2.333 21.147 11.209 9 HD2 LYS 1 HD2 LYS 1 3.399 21.610 13.376 10 HD3 LYS 1 HD1 LYS 1 4.885 20.858 12.798 11 HE2 LYS 1 HE2 LYS 1 3.586 23.242 11.493 12 HE3 LYS 1 HE1 LYS 1 4.857 23.361 12.707 13 HZ1 LYS 1 HZ1 LYS 1 6.309 22.089 11.234 14 HZ2 LYS 1 HZ2 LYS 1 5.774 23.512 10.497 15 HZ3 LYS 1 HZ3 LYS 1 5.091 22.032 10.062 16 HA PRO 2 HA PRO 2 2.919 15.989 8.215 17 HB2 PRO 2 HB2 PRO 2 0.978 15.749 6.400 18 HB3 PRO 2 HB1 PRO 2 0.876 14.929 7.964 19 HG2 PRO 2 HG2 PRO 2 -0.469 17.427 7.032 20 HG3 PRO 2 HG1 PRO 2 -1.099 16.127 8.054 21 HD2 PRO 2 HD2 PRO 2 -0.130 18.552 8.981 22 HD3 PRO 2 HD1 PRO 2 -0.283 17.077 9.951 23 H VAL 3 HN VAL 3 2.741 19.024 8.157 24 HA VAL 3 HA VAL 3 3.144 19.529 5.314 25 HB VAL 3 HB VAL 3 3.351 21.545 7.553 26 HG11 VAL 3 HG11 VAL 3 4.322 22.258 5.438 27 HG12 VAL 3 HG12 VAL 3 2.858 23.175 5.793 28 HG13 VAL 3 HG13 VAL 3 2.816 21.874 4.604 29 HG21 VAL 3 HG21 VAL 3 0.913 20.775 5.959 30 HG22 VAL 3 HG22 VAL 3 1.024 22.160 7.045 31 HG23 VAL 3 HG23 VAL 3 1.163 20.521 7.687 32 H SER 4 HN SER 4 4.829 18.607 7.984 33 HA SER 4 HA SER 4 7.351 19.842 7.179 34 HB2 SER 4 HB2 SER 4 6.676 18.179 9.618 35 HB3 SER 4 HB1 SER 4 8.196 19.026 9.329 36 HG SER 4 HG SER 4 6.908 20.981 9.217 37 H LEU 5 HN LEU 5 5.933 17.615 5.738 38 HA LEU 5 HA LEU 5 7.663 15.330 6.154 39 HB2 LEU 5 HB2 LEU 5 5.528 15.785 4.076 40 HB3 LEU 5 HB1 LEU 5 6.367 14.275 4.363 41 HG LEU 5 HG LEU 5 4.464 15.656 6.254 42 HD11 LEU 5 HD11 LEU 5 3.083 13.674 5.900 43 HD12 LEU 5 HD12 LEU 5 4.266 13.051 4.751 44 HD13 LEU 5 HD13 LEU 5 3.378 14.530 4.388 45 HD21 LEU 5 HD21 LEU 5 4.767 13.665 7.678 46 HD22 LEU 5 HD22 LEU 5 6.239 14.621 7.531 47 HD23 LEU 5 HD23 LEU 5 6.064 13.123 6.615 48 H SER 6 HN SER 6 9.211 17.404 5.546 49 HA SER 6 HA SER 6 9.806 17.480 2.720 50 HB2 SER 6 HB2 SER 6 11.459 18.589 4.999 51 HB3 SER 6 HB1 SER 6 11.471 19.102 3.312 52 HG SER 6 HG SER 6 9.187 19.675 3.690 53 H TYR 7 HN TYR 7 9.893 14.901 3.818 54 HA TYR 7 HA TYR 7 12.761 14.267 3.703 55 HB2 TYR 7 HB2 TYR 7 10.622 13.038 5.451 56 HB3 TYR 7 HB1 TYR 7 12.218 12.344 5.231 57 HD1 TYR 7 HD1 TYR 7 10.249 14.762 6.997 58 HD2 TYR 7 HD2 TYR 7 14.234 13.664 5.996 59 HE1 TYR 7 HE1 TYR 7 11.089 16.166 8.827 60 HE2 TYR 7 HE2 TYR 7 15.086 15.067 7.826 61 HH TYR 7 HH TYR 7 13.098 16.312 10.261 62 H ARG 8 HN ARG 8 12.636 11.569 3.596 63 HA ARG 8 HA ARG 8 11.525 11.053 0.983 64 HB2 ARG 8 HB2 ARG 8 12.890 9.146 2.893 65 HB3 ARG 8 HB1 ARG 8 12.626 8.899 1.172 66 HG2 ARG 8 HG2 ARG 8 14.137 10.696 0.635 67 HG3 ARG 8 HG1 ARG 8 14.333 11.083 2.344 68 HD2 ARG 8 HD2 ARG 8 15.235 8.758 2.658 69 HD3 ARG 8 HD1 ARG 8 15.236 8.599 0.901 70 HE ARG 8 HE ARG 8 16.626 10.930 1.872 71 HH11 ARG 8 HH11 ARG 8 16.923 7.538 1.080 72 HH12 ARG 8 HH12 ARG 8 18.633 7.616 0.815 73 HH21 ARG 8 HH21 ARG 8 18.878 11.041 1.541 74 HH22 ARG 8 HH22 ARG 8 19.752 9.608 1.091 75 H CYS 9 HN CYS 9 10.438 8.764 0.806 76 HA CYS 9 HA CYS 9 7.966 8.910 2.180 77 HB2 CYS 9 HB2 CYS 9 9.124 6.683 0.496 78 HB3 CYS 9 HB1 CYS 9 7.440 6.875 0.938 79 HA PRO 10 HA PRO 10 8.189 6.770 5.978 80 HB2 PRO 10 HB2 PRO 10 6.505 4.693 4.666 81 HB3 PRO 10 HB1 PRO 10 6.321 5.443 6.253 82 HG2 PRO 10 HG2 PRO 10 4.863 6.217 4.131 83 HG3 PRO 10 HG1 PRO 10 5.374 7.342 5.397 84 HD2 PRO 10 HD2 PRO 10 6.282 7.151 2.611 85 HD3 PRO 10 HD1 PRO 10 6.457 8.485 3.762 86 H CYS 11 HN CYS 11 8.068 4.252 3.461 87 HA CYS 11 HA CYS 11 10.140 2.780 4.882 88 HB2 CYS 11 HB2 CYS 11 8.219 1.508 4.021 89 HB3 CYS 11 HB1 CYS 11 8.595 2.036 2.383 90 H ARG 12 HN ARG 12 12.070 2.140 3.966 91 HA ARG 12 HA ARG 12 13.378 4.036 2.300 92 HB2 ARG 12 HB2 ARG 12 14.416 1.292 2.998 93 HB3 ARG 12 HB1 ARG 12 15.343 2.734 2.597 94 HG2 ARG 12 HG2 ARG 12 13.733 2.265 5.099 95 HG3 ARG 12 HG1 ARG 12 15.490 2.307 4.959 96 HD2 ARG 12 HD2 ARG 12 13.678 4.628 4.321 97 HD3 ARG 12 HD1 ARG 12 14.470 4.392 5.876 98 HE ARG 12 HE ARG 12 16.390 4.319 3.816 99 HH11 ARG 12 HH11 ARG 12 14.250 6.581 5.406 100 HH12 ARG 12 HH12 ARG 12 15.339 7.921 5.239 101 HH21 ARG 12 HH21 ARG 12 17.821 6.072 3.582 102 HH22 ARG 12 HH22 ARG 12 17.379 7.630 4.204 103 H PHE 13 HN PHE 13 14.969 2.524 0.588 104 HA PHE 13 HA PHE 13 13.072 2.424 -1.568 105 HB2 PHE 13 HB2 PHE 13 16.039 1.807 -1.595 106 HB3 PHE 13 HB1 PHE 13 15.028 2.114 -3.004 107 HD1 PHE 13 HD1 PHE 13 14.356 4.339 -3.586 108 HD2 PHE 13 HD2 PHE 13 16.689 3.620 -0.104 109 HE1 PHE 13 HE1 PHE 13 14.860 6.726 -3.444 110 HE2 PHE 13 HE2 PHE 13 17.193 6.013 0.055 111 HZ PHE 13 HZ PHE 13 16.267 7.581 -1.564 112 H PHE 14 HN PHE 14 12.632 0.671 -2.884 113 HA PHE 14 HA PHE 14 12.165 -1.639 -1.273 114 HB2 PHE 14 HB2 PHE 14 11.311 -1.425 -4.119 115 HB3 PHE 14 HB1 PHE 14 10.443 -2.028 -2.722 116 HD1 PHE 14 HD1 PHE 14 9.142 -0.581 -1.328 117 HD2 PHE 14 HD2 PHE 14 11.358 0.973 -4.602 118 HE1 PHE 14 HE1 PHE 14 7.903 1.535 -1.152 119 HE2 PHE 14 HE2 PHE 14 10.128 3.095 -4.434 120 HZ PHE 14 HZ PHE 14 8.397 3.379 -2.706 121 H GLU 15 HN GLU 15 12.405 -3.842 -2.137 122 HA GLU 15 HA GLU 15 14.880 -4.087 -3.669 123 HB2 GLU 15 HB2 GLU 15 15.516 -5.058 -1.745 124 HB3 GLU 15 HB1 GLU 15 13.862 -5.336 -1.232 125 HG2 GLU 15 HG2 GLU 15 13.698 -7.277 -2.516 126 HG3 GLU 15 HG1 GLU 15 15.219 -6.974 -3.322 127 H SER 16 HN SER 16 14.940 -5.239 -5.436 128 HA SER 16 HA SER 16 12.407 -6.362 -6.393 129 HB2 SER 16 HB2 SER 16 13.457 -4.503 -7.686 130 HB3 SER 16 HB1 SER 16 14.852 -5.536 -7.980 131 HG SER 16 HG SER 16 12.378 -5.525 -9.170 132 H HIS 17 HN HIS 17 13.999 -7.804 -4.590 133 HA HIS 17 HA HIS 17 14.851 -10.054 -6.287 134 HB2 HIS 17 HB2 HIS 17 16.769 -9.055 -5.123 135 HB3 HIS 17 HB1 HIS 17 15.940 -9.235 -3.582 136 HD1 HIS 17 HD1 HIS 17 16.737 -11.170 -2.296 137 HD2 HIS 17 HD2 HIS 17 17.056 -11.815 -6.390 138 HE1 HIS 17 HE1 HIS 17 17.751 -13.452 -2.542 139 HE2 HIS 17 HE2 HIS 17 18.083 -13.753 -5.020 140 H ILE 18 HN ILE 18 12.839 -8.882 -3.790 141 HA ILE 18 HA ILE 18 12.249 -11.235 -2.387 142 HB ILE 18 HB ILE 18 10.535 -8.830 -2.952 143 HG12 ILE 18 HG12 ILE 18 11.928 -9.303 -0.381 144 HG13 ILE 18 HG11 ILE 18 12.912 -8.826 -1.747 145 HG21 ILE 18 HG21 ILE 18 9.295 -9.460 -0.929 146 HG22 ILE 18 HG22 ILE 18 10.258 -10.933 -0.805 147 HG23 ILE 18 HG23 ILE 18 9.173 -10.701 -2.177 148 HD11 ILE 18 HD11 ILE 18 10.480 -7.246 -1.091 149 HD12 ILE 18 HD12 ILE 18 11.992 -6.740 -1.865 150 HD13 ILE 18 HD13 ILE 18 11.941 -7.046 -0.124 151 H ALA 19 HN ALA 19 10.913 -12.880 -2.722 152 HA ALA 19 HA ALA 19 9.436 -12.995 -5.269 153 HB1 ALA 19 HB1 ALA 19 11.374 -14.533 -5.125 154 HB2 ALA 19 HB2 ALA 19 9.835 -15.365 -5.321 155 HB3 ALA 19 HB3 ALA 19 10.608 -15.309 -3.739 156 H ARG 20 HN ARG 20 7.444 -14.070 -5.296 157 HA ARG 20 HA ARG 20 5.720 -13.438 -3.224 158 HB2 ARG 20 HB2 ARG 20 4.847 -15.665 -4.891 159 HB3 ARG 20 HB1 ARG 20 4.182 -14.067 -4.700 160 HG2 ARG 20 HG2 ARG 20 5.859 -13.188 -6.268 161 HG3 ARG 20 HG1 ARG 20 6.426 -14.839 -6.518 162 HD2 ARG 20 HD2 ARG 20 3.640 -13.834 -7.078 163 HD3 ARG 20 HD1 ARG 20 4.890 -14.116 -8.288 164 HE ARG 20 HE ARG 20 4.482 -16.467 -6.789 165 HH11 ARG 20 HH11 ARG 20 2.903 -14.491 -9.207 166 HH12 ARG 20 HH12 ARG 20 2.022 -15.813 -9.897 167 HH21 ARG 20 HH21 ARG 20 3.316 -18.206 -7.679 168 HH22 ARG 20 HH22 ARG 20 2.250 -17.934 -9.022 169 H ALA 21 HN ALA 21 7.252 -16.470 -4.085 170 HA ALA 21 HA ALA 21 5.895 -17.946 -2.003 171 HB1 ALA 21 HB1 ALA 21 7.139 -19.865 -2.797 172 HB2 ALA 21 HB2 ALA 21 8.150 -18.818 -3.795 173 HB3 ALA 21 HB3 ALA 21 6.432 -18.994 -4.157 174 H ASN 22 HN ASN 22 8.554 -15.953 -2.078 175 HA ASN 22 HA ASN 22 9.856 -17.349 0.110 176 HB2 ASN 22 HB2 ASN 22 10.729 -15.233 -1.821 177 HB3 ASN 22 HB1 ASN 22 11.570 -15.424 -0.296 178 HD21 ASN 22 HD21 ASN 22 13.466 -16.044 -1.287 179 HD22 ASN 22 HD22 ASN 22 13.664 -17.596 -2.020 180 H VAL 23 HN VAL 23 7.656 -14.876 -0.476 181 HA VAL 23 HA VAL 23 8.413 -13.432 1.939 182 HB VAL 23 HB VAL 23 7.862 -12.064 -0.017 183 HG11 VAL 23 HG11 VAL 23 5.119 -13.266 0.252 184 HG12 VAL 23 HG12 VAL 23 6.218 -13.445 -1.119 185 HG13 VAL 23 HG13 VAL 23 5.515 -11.868 -0.749 186 HG21 VAL 23 HG21 VAL 23 6.332 -10.542 1.069 187 HG22 VAL 23 HG22 VAL 23 7.531 -11.184 2.200 188 HG23 VAL 23 HG23 VAL 23 5.883 -11.809 2.211 189 H LYS 24 HN LYS 24 7.144 -13.184 3.638 190 HA LYS 24 HA LYS 24 4.955 -15.058 4.035 191 HB2 LYS 24 HB2 LYS 24 6.321 -13.195 5.987 192 HB3 LYS 24 HB1 LYS 24 5.085 -14.373 6.398 193 HG2 LYS 24 HG2 LYS 24 6.669 -16.135 5.503 194 HG3 LYS 24 HG1 LYS 24 7.892 -14.868 5.468 195 HD2 LYS 24 HD2 LYS 24 6.344 -15.685 7.923 196 HD3 LYS 24 HD1 LYS 24 7.969 -16.230 7.528 197 HE2 LYS 24 HE2 LYS 24 8.738 -13.910 7.539 198 HE3 LYS 24 HE1 LYS 24 7.120 -13.386 8.003 199 HZ1 LYS 24 HZ1 LYS 24 7.377 -14.845 9.997 200 HZ2 LYS 24 HZ2 LYS 24 8.414 -13.512 9.964 201 HZ3 LYS 24 HZ3 LYS 24 9.005 -15.053 9.579 202 H HIS 25 HN HIS 25 3.621 -13.554 5.970 203 HA HIS 25 HA HIS 25 1.601 -12.299 4.759 204 HB2 HIS 25 HB2 HIS 25 1.112 -11.212 6.833 205 HB3 HIS 25 HB1 HIS 25 1.880 -12.750 7.186 206 HD1 HIS 25 HD1 HIS 25 2.129 -9.194 7.886 207 HD2 HIS 25 HD2 HIS 25 4.648 -12.503 8.050 208 HE1 HIS 25 HE1 HIS 25 4.037 -8.513 9.363 209 HE2 HIS 25 HE2 HIS 25 5.396 -10.611 9.653 210 H LEU 26 HN LEU 26 1.174 -10.493 3.727 211 HA LEU 26 HA LEU 26 3.418 -8.622 3.344 212 HB2 LEU 26 HB2 LEU 26 2.932 -10.169 1.451 213 HB3 LEU 26 HB1 LEU 26 1.353 -9.432 1.295 214 HG LEU 26 HG LEU 26 2.287 -7.373 0.561 215 HD11 LEU 26 HD11 LEU 26 4.122 -7.240 2.150 216 HD12 LEU 26 HD12 LEU 26 4.693 -6.970 0.505 217 HD13 LEU 26 HD13 LEU 26 4.968 -8.526 1.295 218 HD21 LEU 26 HD21 LEU 26 2.275 -8.709 -1.320 219 HD22 LEU 26 HD22 LEU 26 3.454 -9.837 -0.653 220 HD23 LEU 26 HD23 LEU 26 3.987 -8.258 -1.243 221 H LYS 27 HN LYS 27 2.996 -6.483 3.322 222 HA LYS 27 HA LYS 27 0.257 -5.583 3.877 223 HB2 LYS 27 HB2 LYS 27 1.151 -5.872 6.057 224 HB3 LYS 27 HB1 LYS 27 2.701 -5.204 5.584 225 HG2 LYS 27 HG2 LYS 27 1.608 -3.601 6.939 226 HG3 LYS 27 HG1 LYS 27 1.596 -3.009 5.276 227 HD2 LYS 27 HD2 LYS 27 -0.564 -2.597 6.246 228 HD3 LYS 27 HD1 LYS 27 -0.731 -3.890 5.059 229 HE2 LYS 27 HE2 LYS 27 -1.987 -4.398 7.081 230 HE3 LYS 27 HE1 LYS 27 -0.666 -5.544 6.859 231 HZ1 LYS 27 HZ1 LYS 27 -0.886 -4.760 9.162 232 HZ2 LYS 27 HZ2 LYS 27 -0.558 -3.182 8.651 233 HZ3 LYS 27 HZ3 LYS 27 0.622 -4.381 8.497 234 H ILE 28 HN ILE 28 -0.150 -3.437 3.274 235 HA ILE 28 HA ILE 28 1.977 -2.198 1.665 236 HB ILE 28 HB ILE 28 -1.014 -1.889 1.375 237 HG12 ILE 28 HG12 ILE 28 -0.280 -4.129 0.757 238 HG13 ILE 28 HG11 ILE 28 -0.699 -3.226 -0.683 239 HG21 ILE 28 HG21 ILE 28 1.254 -0.873 -0.339 240 HG22 ILE 28 HG22 ILE 28 0.169 0.103 0.653 241 HG23 ILE 28 HG23 ILE 28 -0.459 -0.767 -0.748 242 HD11 ILE 28 HD11 ILE 28 2.068 -3.713 0.329 243 HD12 ILE 28 HD12 ILE 28 1.647 -2.802 -1.120 244 HD13 ILE 28 HD13 ILE 28 1.296 -4.529 -1.027 245 H LEU 29 HN LEU 29 2.613 -0.171 2.103 246 HA LEU 29 HA LEU 29 1.457 1.164 4.413 247 HB2 LEU 29 HB2 LEU 29 4.006 0.951 3.741 248 HB3 LEU 29 HB1 LEU 29 3.646 2.355 2.747 249 HG LEU 29 HG LEU 29 4.632 3.019 4.874 250 HD11 LEU 29 HD11 LEU 29 3.093 4.588 3.901 251 HD12 LEU 29 HD12 LEU 29 2.889 4.595 5.651 252 HD13 LEU 29 HD13 LEU 29 1.714 3.761 4.628 253 HD21 LEU 29 HD21 LEU 29 3.905 1.119 6.223 254 HD22 LEU 29 HD22 LEU 29 2.245 1.710 6.168 255 HD23 LEU 29 HD23 LEU 29 3.489 2.652 6.988 256 H ASN 30 HN ASN 30 -0.168 2.517 4.171 257 HA ASN 30 HA ASN 30 -0.802 3.746 1.663 258 HB2 ASN 30 HB2 ASN 30 -1.865 4.075 4.458 259 HB3 ASN 30 HB1 ASN 30 -2.443 5.027 3.105 260 HD21 ASN 30 HD21 ASN 30 -2.406 1.922 4.611 261 HD22 ASN 30 HD22 ASN 30 -3.599 1.181 3.603 262 H THR 31 HN THR 31 0.843 5.023 0.998 263 HA THR 31 HA THR 31 2.301 6.654 2.821 264 HB THR 31 HB THR 31 3.283 7.356 0.470 265 HG1 THR 31 HG1 THR 31 2.819 4.877 -0.448 266 HG21 THR 31 HG21 THR 31 4.795 5.432 0.639 267 HG22 THR 31 HG22 THR 31 3.686 4.689 1.793 268 HG23 THR 31 HG23 THR 31 4.501 6.202 2.198 269 HA PRO 32 HA PRO 32 1.070 10.946 2.215 270 HB2 PRO 32 HB2 PRO 32 3.668 11.111 0.800 271 HB3 PRO 32 HB1 PRO 32 2.985 12.165 2.039 272 HG2 PRO 32 HG2 PRO 32 4.865 10.354 2.642 273 HG3 PRO 32 HG1 PRO 32 3.550 10.730 3.763 274 HD2 PRO 32 HD2 PRO 32 3.982 8.329 2.107 275 HD3 PRO 32 HD1 PRO 32 3.096 8.510 3.630 276 H ASN 33 HN ASN 33 1.052 8.793 -0.230 277 HA ASN 33 HA ASN 33 0.515 8.804 -2.442 278 HB2 ASN 33 HB2 ASN 33 1.030 11.790 -2.429 279 HB3 ASN 33 HB1 ASN 33 0.516 10.857 -3.824 280 HD21 ASN 33 HD21 ASN 33 -0.664 10.222 -0.617 281 HD22 ASN 33 HD22 ASN 33 -2.251 10.828 -0.855 282 H CYS 34 HN CYS 34 2.760 8.060 -1.322 283 HA CYS 34 HA CYS 34 4.816 8.553 -3.328 284 HB2 CYS 34 HB2 CYS 34 4.705 6.972 -0.751 285 HB3 CYS 34 HB1 CYS 34 6.037 6.828 -1.873 286 H ALA 35 HN ALA 35 5.756 6.347 -4.187 287 HA ALA 35 HA ALA 35 3.854 4.685 -5.345 288 HB1 ALA 35 HB1 ALA 35 6.628 3.914 -4.425 289 HB2 ALA 35 HB2 ALA 35 6.232 4.657 -5.976 290 HB3 ALA 35 HB3 ALA 35 5.642 3.037 -5.599 291 H LEU 36 HN LEU 36 2.763 2.864 -4.651 292 HA LEU 36 HA LEU 36 2.157 2.519 -1.965 293 HB2 LEU 36 HB2 LEU 36 1.877 0.798 -4.406 294 HB3 LEU 36 HB1 LEU 36 1.448 0.177 -2.837 295 HG LEU 36 HG LEU 36 -0.553 0.932 -3.899 296 HD11 LEU 36 HD11 LEU 36 -1.379 2.569 -2.331 297 HD12 LEU 36 HD12 LEU 36 0.267 3.016 -1.885 298 HD13 LEU 36 HD13 LEU 36 -0.346 1.408 -1.497 299 HD21 LEU 36 HD21 LEU 36 0.849 3.570 -4.302 300 HD22 LEU 36 HD22 LEU 36 -0.849 3.247 -4.656 301 HD23 LEU 36 HD23 LEU 36 0.414 2.410 -5.559 302 H GLN 37 HN GLN 37 3.600 1.986 -0.444 303 HA GLN 37 HA GLN 37 5.934 0.434 -1.162 304 HB2 GLN 37 HB2 GLN 37 5.301 1.318 1.634 305 HB3 GLN 37 HB1 GLN 37 6.870 1.115 0.867 306 HG2 GLN 37 HG2 GLN 37 6.128 3.067 -0.643 307 HG3 GLN 37 HG1 GLN 37 4.917 3.356 0.601 308 HE21 GLN 37 HE21 GLN 37 8.231 3.520 -0.247 309 HE22 GLN 37 HE22 GLN 37 8.776 4.355 1.159 310 H ILE 38 HN ILE 38 5.930 -1.677 -1.086 311 HA ILE 38 HA ILE 38 3.829 -3.050 0.366 312 HB ILE 38 HB ILE 38 5.827 -4.301 -1.517 313 HG12 ILE 38 HG12 ILE 38 3.621 -4.082 -3.053 314 HG13 ILE 38 HG11 ILE 38 3.463 -2.602 -2.124 315 HG21 ILE 38 HG21 ILE 38 3.885 -5.364 0.115 316 HG22 ILE 38 HG22 ILE 38 4.632 -6.168 -1.269 317 HG23 ILE 38 HG23 ILE 38 3.097 -5.300 -1.462 318 HD11 ILE 38 HD11 ILE 38 4.587 -2.259 -4.267 319 HD12 ILE 38 HD12 ILE 38 5.863 -3.373 -3.771 320 HD13 ILE 38 HD13 ILE 38 5.629 -1.855 -2.906 321 H VAL 39 HN VAL 39 4.409 -3.398 2.480 322 HA VAL 39 HA VAL 39 7.205 -4.004 3.051 323 HB VAL 39 HB VAL 39 5.833 -2.306 4.415 324 HG11 VAL 39 HG11 VAL 39 4.800 -4.814 5.697 325 HG12 VAL 39 HG12 VAL 39 3.854 -3.615 4.816 326 HG13 VAL 39 HG13 VAL 39 4.629 -3.181 6.341 327 HG21 VAL 39 HG21 VAL 39 8.061 -3.048 5.041 328 HG22 VAL 39 HG22 VAL 39 7.385 -4.473 5.829 329 HG23 VAL 39 HG23 VAL 39 7.048 -2.866 6.472 330 H ALA 40 HN ALA 40 7.919 -5.936 3.440 331 HA ALA 40 HA ALA 40 5.995 -8.144 3.743 332 HB1 ALA 40 HB1 ALA 40 6.779 -7.884 1.409 333 HB2 ALA 40 HB2 ALA 40 7.262 -9.418 2.129 334 HB3 ALA 40 HB3 ALA 40 8.436 -8.110 1.971 335 H ARG 41 HN ARG 41 6.791 -10.000 4.818 336 HA ARG 41 HA ARG 41 9.468 -9.682 6.012 337 HB2 ARG 41 HB2 ARG 41 6.993 -11.018 7.122 338 HB3 ARG 41 HB1 ARG 41 8.606 -11.228 7.812 339 HG2 ARG 41 HG2 ARG 41 8.258 -8.468 7.521 340 HG3 ARG 41 HG1 ARG 41 6.748 -9.082 8.178 341 HD2 ARG 41 HD2 ARG 41 7.943 -10.171 9.981 342 HD3 ARG 41 HD1 ARG 41 9.480 -9.648 9.290 343 HE ARG 41 HE ARG 41 7.893 -7.382 9.722 344 HH11 ARG 41 HH11 ARG 41 9.508 -9.865 11.576 345 HH12 ARG 41 HH12 ARG 41 9.791 -8.843 12.946 346 HH21 ARG 41 HH21 ARG 41 8.261 -6.022 11.514 347 HH22 ARG 41 HH22 ARG 41 9.085 -6.644 12.909 348 H LEU 42 HN LEU 42 10.928 -11.193 5.479 349 HA LEU 42 HA LEU 42 10.168 -13.014 3.416 350 HB2 LEU 42 HB2 LEU 42 12.743 -12.438 4.800 351 HB3 LEU 42 HB1 LEU 42 12.603 -13.830 3.746 352 HG LEU 42 HG LEU 42 12.101 -10.972 2.930 353 HD11 LEU 42 HD11 LEU 42 14.380 -12.795 2.194 354 HD12 LEU 42 HD12 LEU 42 14.471 -11.554 3.443 355 HD13 LEU 42 HD13 LEU 42 14.186 -11.096 1.761 356 HD21 LEU 42 HD21 LEU 42 12.156 -13.521 1.316 357 HD22 LEU 42 HD22 LEU 42 12.078 -11.893 0.643 358 HD23 LEU 42 HD23 LEU 42 10.748 -12.503 1.625 359 H LYS 43 HN LYS 43 10.364 -15.244 3.346 360 HA LYS 43 HA LYS 43 9.010 -16.547 5.393 361 HB2 LYS 43 HB2 LYS 43 9.293 -17.118 2.907 362 HB3 LYS 43 HB1 LYS 43 10.762 -17.930 3.410 363 HG2 LYS 43 HG2 LYS 43 9.462 -19.376 4.884 364 HG3 LYS 43 HG1 LYS 43 7.981 -18.572 4.351 365 HD2 LYS 43 HD2 LYS 43 8.137 -20.529 3.044 366 HD3 LYS 43 HD1 LYS 43 8.677 -19.215 1.985 367 HE2 LYS 43 HE2 LYS 43 10.215 -21.019 1.717 368 HE3 LYS 43 HE1 LYS 43 11.021 -19.765 2.661 369 HZ1 LYS 43 HZ1 LYS 43 11.428 -21.947 3.580 370 HZ2 LYS 43 HZ2 LYS 43 9.772 -22.211 3.773 371 HZ3 LYS 43 HZ3 LYS 43 10.547 -21.003 4.666 372 H ASN 44 HN ASN 44 12.374 -17.099 4.396 373 HA ASN 44 HA ASN 44 12.923 -18.583 6.802 374 HB2 ASN 44 HB2 ASN 44 14.603 -17.798 4.448 375 HB3 ASN 44 HB1 ASN 44 15.274 -18.626 5.843 376 HD21 ASN 44 HD21 ASN 44 15.846 -20.390 4.688 377 HD22 ASN 44 HD22 ASN 44 14.702 -21.532 4.065 378 H ASN 45 HN ASN 45 14.232 -15.682 5.285 379 HA ASN 45 HA ASN 45 16.010 -14.931 7.276 380 HB2 ASN 45 HB2 ASN 45 14.478 -13.128 5.426 381 HB3 ASN 45 HB1 ASN 45 15.882 -12.647 6.356 382 HD21 ASN 45 HD21 ASN 45 17.139 -12.125 4.660 383 HD22 ASN 45 HD22 ASN 45 17.710 -13.265 3.505 384 H ASN 46 HN ASN 46 12.580 -14.334 7.021 385 HA ASN 46 HA ASN 46 11.043 -13.380 8.380 386 HB2 ASN 46 HB2 ASN 46 13.246 -13.676 10.409 387 HB3 ASN 46 HB1 ASN 46 11.682 -12.986 10.812 388 HD21 ASN 46 HD21 ASN 46 12.956 -15.400 11.811 389 HD22 ASN 46 HD22 ASN 46 11.864 -16.692 11.463 390 H ARG 47 HN ARG 47 13.528 -11.838 7.105 391 HA ARG 47 HA ARG 47 13.610 -9.420 8.587 392 HB2 ARG 47 HB2 ARG 47 14.976 -8.548 6.851 393 HB3 ARG 47 HB1 ARG 47 15.404 -10.244 6.998 394 HG2 ARG 47 HG2 ARG 47 14.076 -10.789 5.070 395 HG3 ARG 47 HG1 ARG 47 13.542 -9.116 4.934 396 HD2 ARG 47 HD2 ARG 47 16.436 -9.901 4.841 397 HD3 ARG 47 HD1 ARG 47 15.426 -9.862 3.400 398 HE ARG 47 HE ARG 47 15.815 -7.480 5.096 399 HH11 ARG 47 HH11 ARG 47 15.845 -9.043 1.956 400 HH12 ARG 47 HH12 ARG 47 16.148 -7.576 1.077 401 HH21 ARG 47 HH21 ARG 47 16.243 -5.560 3.958 402 HH22 ARG 47 HH22 ARG 47 16.385 -5.595 2.228 403 H GLN 48 HN GLN 48 12.622 -7.560 8.271 404 HA GLN 48 HA GLN 48 10.245 -7.549 6.604 405 HB2 GLN 48 HB2 GLN 48 10.202 -6.749 8.996 406 HB3 GLN 48 HB1 GLN 48 11.173 -5.379 8.481 407 HG2 GLN 48 HG2 GLN 48 9.403 -4.783 6.884 408 HG3 GLN 48 HG1 GLN 48 8.420 -6.090 7.538 409 HE21 GLN 48 HE21 GLN 48 9.735 -2.941 8.085 410 HE22 GLN 48 HE22 GLN 48 8.797 -2.565 9.489 411 H VAL 49 HN VAL 49 10.192 -6.553 4.739 412 HA VAL 49 HA VAL 49 12.155 -4.508 4.024 413 HB VAL 49 HB VAL 49 13.216 -6.697 3.500 414 HG11 VAL 49 HG11 VAL 49 11.252 -8.026 3.070 415 HG12 VAL 49 HG12 VAL 49 12.330 -8.073 1.676 416 HG13 VAL 49 HG13 VAL 49 10.882 -7.066 1.638 417 HG21 VAL 49 HG21 VAL 49 13.832 -4.769 2.180 418 HG22 VAL 49 HG22 VAL 49 12.466 -5.042 1.097 419 HG23 VAL 49 HG23 VAL 49 13.791 -6.205 1.157 420 H CYS 50 HN CYS 50 11.535 -3.421 1.973 421 HA CYS 50 HA CYS 50 8.691 -3.802 1.405 422 HB2 CYS 50 HB2 CYS 50 10.522 -1.445 0.975 423 HB3 CYS 50 HB1 CYS 50 8.906 -1.544 0.308 424 H ILE 51 HN ILE 51 8.044 -4.528 -0.468 425 HA ILE 51 HA ILE 51 9.981 -5.566 -2.323 426 HB ILE 51 HB ILE 51 7.086 -5.556 -3.018 427 HG12 ILE 51 HG12 ILE 51 8.243 -7.212 -0.756 428 HG13 ILE 51 HG11 ILE 51 6.987 -5.985 -0.611 429 HG21 ILE 51 HG21 ILE 51 8.958 -7.891 -2.962 430 HG22 ILE 51 HG22 ILE 51 9.055 -6.697 -4.252 431 HG23 ILE 51 HG23 ILE 51 7.566 -7.608 -4.004 432 HD11 ILE 51 HD11 ILE 51 5.585 -7.408 -2.145 433 HD12 ILE 51 HD12 ILE 51 5.908 -8.082 -0.549 434 HD13 ILE 51 HD13 ILE 51 6.803 -8.665 -1.948 435 H ASP 52 HN ASP 52 10.164 -5.025 -4.511 436 HA ASP 52 HA ASP 52 9.819 -2.243 -5.077 437 HB2 ASP 52 HB2 ASP 52 11.768 -3.583 -5.853 438 HB3 ASP 52 HB1 ASP 52 10.696 -4.460 -6.932 439 HA PRO 53 HA PRO 53 5.683 -2.590 -6.657 440 HB2 PRO 53 HB2 PRO 53 5.541 -0.093 -7.716 441 HB3 PRO 53 HB1 PRO 53 5.387 -0.432 -5.990 442 HG2 PRO 53 HG2 PRO 53 7.771 0.510 -7.521 443 HG3 PRO 53 HG1 PRO 53 7.159 1.056 -5.960 444 HD2 PRO 53 HD2 PRO 53 9.231 -0.618 -6.165 445 HD3 PRO 53 HD1 PRO 53 8.063 -0.721 -4.842 446 H LYS 54 HN LYS 54 8.477 -2.130 -8.538 447 HA LYS 54 HA LYS 54 7.031 -2.144 -11.069 448 HB2 LYS 54 HB2 LYS 54 9.936 -1.827 -10.404 449 HB3 LYS 54 HB1 LYS 54 9.342 -1.988 -12.053 450 HG2 LYS 54 HG2 LYS 54 8.008 -0.001 -11.820 451 HG3 LYS 54 HG1 LYS 54 8.460 0.135 -10.121 452 HD2 LYS 54 HD2 LYS 54 10.445 0.152 -12.361 453 HD3 LYS 54 HD1 LYS 54 9.723 1.630 -11.720 454 HE2 LYS 54 HE2 LYS 54 10.597 1.006 -9.483 455 HE3 LYS 54 HE1 LYS 54 11.387 -0.383 -10.222 456 HZ1 LYS 54 HZ1 LYS 54 12.709 1.101 -11.568 457 HZ2 LYS 54 HZ2 LYS 54 12.903 1.492 -9.934 458 HZ3 LYS 54 HZ3 LYS 54 11.921 2.451 -10.922 459 H LEU 55 HN LEU 55 8.230 -4.352 -8.881 460 HA LEU 55 HA LEU 55 9.201 -6.443 -10.431 461 HB2 LEU 55 HB2 LEU 55 7.863 -6.124 -7.810 462 HB3 LEU 55 HB1 LEU 55 7.928 -7.752 -8.461 463 HG LEU 55 HG LEU 55 10.362 -6.006 -8.115 464 HD11 LEU 55 HD11 LEU 55 9.473 -6.281 -5.941 465 HD12 LEU 55 HD12 LEU 55 10.790 -7.444 -6.104 466 HD13 LEU 55 HD13 LEU 55 9.115 -7.983 -6.224 467 HD21 LEU 55 HD21 LEU 55 10.023 -8.969 -8.512 468 HD22 LEU 55 HD22 LEU 55 11.553 -8.125 -8.276 469 HD23 LEU 55 HD23 LEU 55 10.586 -7.813 -9.717 470 H LYS 56 HN LYS 56 8.276 -7.952 -11.683 471 HA LYS 56 HA LYS 56 5.860 -7.272 -12.949 472 HB2 LYS 56 HB2 LYS 56 7.390 -9.870 -13.079 473 HB3 LYS 56 HB1 LYS 56 6.169 -9.339 -14.226 474 HG2 LYS 56 HG2 LYS 56 8.788 -7.945 -13.705 475 HG3 LYS 56 HG1 LYS 56 8.455 -9.019 -15.061 476 HD2 LYS 56 HD2 LYS 56 6.905 -6.495 -14.496 477 HD3 LYS 56 HD1 LYS 56 8.294 -6.571 -15.580 478 HE2 LYS 56 HE2 LYS 56 5.756 -8.177 -15.880 479 HE3 LYS 56 HE1 LYS 56 6.146 -6.711 -16.779 480 HZ1 LYS 56 HZ1 LYS 56 8.041 -7.832 -17.741 481 HZ2 LYS 56 HZ2 LYS 56 6.635 -8.719 -18.043 482 HZ3 LYS 56 HZ3 LYS 56 7.715 -9.230 -16.848 483 H TRP 57 HN TRP 57 6.578 -9.468 -10.323 484 HA TRP 57 HA TRP 57 3.894 -10.576 -10.420 485 HB2 TRP 57 HB2 TRP 57 4.570 -12.050 -8.710 486 HB3 TRP 57 HB1 TRP 57 5.983 -11.882 -9.725 487 HD1 TRP 57 HD1 TRP 57 8.139 -10.850 -8.620 488 HE1 TRP 57 HE1 TRP 57 8.800 -10.339 -6.173 489 HE3 TRP 57 HE3 TRP 57 3.522 -11.163 -6.486 490 HZ2 TRP 57 HZ2 TRP 57 7.500 -10.107 -3.675 491 HZ3 TRP 57 HZ3 TRP 57 3.303 -10.774 -4.073 492 HH2 TRP 57 HH2 TRP 57 5.253 -10.265 -2.691 493 H ILE 58 HN ILE 58 5.641 -8.068 -8.814 494 HA ILE 58 HA ILE 58 3.725 -7.621 -6.737 495 HB ILE 58 HB ILE 58 5.973 -5.990 -7.876 496 HG12 ILE 58 HG12 ILE 58 6.465 -7.876 -6.355 497 HG13 ILE 58 HG11 ILE 58 6.936 -6.320 -5.673 498 HG21 ILE 58 HG21 ILE 58 4.041 -5.142 -5.738 499 HG22 ILE 58 HG22 ILE 58 4.218 -4.422 -7.340 500 HG23 ILE 58 HG23 ILE 58 5.534 -4.308 -6.161 501 HD11 ILE 58 HD11 ILE 58 5.069 -6.304 -4.219 502 HD12 ILE 58 HD12 ILE 58 5.813 -7.899 -4.094 503 HD13 ILE 58 HD13 ILE 58 4.345 -7.685 -5.032 504 H GLN 59 HN GLN 59 4.211 -6.443 -9.996 505 HA GLN 59 HA GLN 59 2.209 -4.543 -10.195 506 HB2 GLN 59 HB2 GLN 59 3.299 -6.615 -12.016 507 HB3 GLN 59 HB1 GLN 59 1.982 -5.587 -12.569 508 HG2 GLN 59 HG2 GLN 59 4.617 -4.617 -11.527 509 HG3 GLN 59 HG1 GLN 59 4.245 -4.823 -13.238 510 HE21 GLN 59 HE21 GLN 59 3.773 -2.881 -10.418 511 HE22 GLN 59 HE22 GLN 59 2.922 -1.590 -11.195 512 H GLU 60 HN GLU 60 2.024 -8.010 -10.085 513 HA GLU 60 HA GLU 60 -0.754 -8.245 -10.628 514 HB2 GLU 60 HB2 GLU 60 0.994 -10.103 -9.008 515 HB3 GLU 60 HB1 GLU 60 -0.582 -10.489 -9.672 516 HG2 GLU 60 HG2 GLU 60 0.353 -10.207 -11.937 517 HG3 GLU 60 HG1 GLU 60 1.929 -9.934 -11.210 518 H TYR 61 HN TYR 61 1.170 -7.851 -7.718 519 HA TYR 61 HA TYR 61 -1.048 -8.279 -5.947 520 HB2 TYR 61 HB2 TYR 61 1.258 -8.796 -5.228 521 HB3 TYR 61 HB1 TYR 61 1.689 -7.101 -5.384 522 HD1 TYR 61 HD1 TYR 61 0.425 -9.596 -3.214 523 HD2 TYR 61 HD2 TYR 61 0.410 -5.426 -3.969 524 HE1 TYR 61 HE1 TYR 61 -0.305 -9.186 -0.920 525 HE2 TYR 61 HE2 TYR 61 -0.345 -5.007 -1.663 526 HH TYR 61 HH TYR 61 -1.558 -6.264 0.132 527 H LEU 62 HN LEU 62 0.670 -5.648 -7.373 528 HA LEU 62 HA LEU 62 -0.322 -3.434 -6.115 529 HB2 LEU 62 HB2 LEU 62 0.984 -4.078 -8.536 530 HB3 LEU 62 HB1 LEU 62 -0.316 -2.953 -8.914 531 HG LEU 62 HG LEU 62 0.751 -1.648 -6.847 532 HD11 LEU 62 HD11 LEU 62 3.161 -1.826 -6.864 533 HD12 LEU 62 HD12 LEU 62 3.073 -3.098 -8.089 534 HD13 LEU 62 HD13 LEU 62 2.435 -3.389 -6.469 535 HD21 LEU 62 HD21 LEU 62 1.812 -1.588 -9.667 536 HD22 LEU 62 HD22 LEU 62 2.001 -0.307 -8.470 537 HD23 LEU 62 HD23 LEU 62 0.396 -0.727 -9.068 538 H GLU 63 HN GLU 63 -1.754 -5.331 -8.711 539 HA GLU 63 HA GLU 63 -3.964 -3.808 -9.279 540 HB2 GLU 63 HB2 GLU 63 -3.739 -6.796 -9.129 541 HB3 GLU 63 HB1 GLU 63 -5.004 -5.918 -9.966 542 HG2 GLU 63 HG2 GLU 63 -3.293 -4.841 -11.343 543 HG3 GLU 63 HG1 GLU 63 -2.078 -5.835 -10.567 544 H LYS 64 HN LYS 64 -3.512 -6.088 -6.656 545 HA LYS 64 HA LYS 64 -6.136 -5.805 -5.556 546 HB2 LYS 64 HB2 LYS 64 -3.582 -6.825 -4.326 547 HB3 LYS 64 HB1 LYS 64 -5.147 -6.881 -3.529 548 HG2 LYS 64 HG2 LYS 64 -5.064 -8.994 -4.373 549 HG3 LYS 64 HG1 LYS 64 -5.837 -8.158 -5.720 550 HD2 LYS 64 HD2 LYS 64 -3.725 -7.956 -6.859 551 HD3 LYS 64 HD1 LYS 64 -2.887 -8.699 -5.494 552 HE2 LYS 64 HE2 LYS 64 -4.176 -10.761 -5.843 553 HE3 LYS 64 HE1 LYS 64 -4.972 -10.019 -7.229 554 HZ1 LYS 64 HZ1 LYS 64 -3.177 -11.406 -7.973 555 HZ2 LYS 64 HZ2 LYS 64 -2.078 -10.613 -6.967 556 HZ3 LYS 64 HZ3 LYS 64 -2.773 -9.790 -8.270 557 H ALA 65 HN ALA 65 -2.949 -4.532 -4.814 558 HA ALA 65 HA ALA 65 -3.626 -3.120 -2.481 559 HB1 ALA 65 HB1 ALA 65 -1.374 -2.627 -4.417 560 HB2 ALA 65 HB2 ALA 65 -1.346 -3.768 -3.076 561 HB3 ALA 65 HB3 ALA 65 -1.459 -2.036 -2.757 562 H LEU 66 HN LEU 66 -3.863 -2.338 -5.830 563 HA LEU 66 HA LEU 66 -4.248 0.502 -5.369 564 HB2 LEU 66 HB2 LEU 66 -4.079 -1.268 -7.731 565 HB3 LEU 66 HB1 LEU 66 -5.019 0.197 -7.914 566 HG LEU 66 HG LEU 66 -2.707 0.461 -8.673 567 HD11 LEU 66 HD11 LEU 66 -3.933 2.405 -7.825 568 HD12 LEU 66 HD12 LEU 66 -2.207 2.525 -7.489 569 HD13 LEU 66 HD13 LEU 66 -3.325 2.074 -6.203 570 HD21 LEU 66 HD21 LEU 66 -2.046 -0.107 -5.795 571 HD22 LEU 66 HD22 LEU 66 -0.897 0.492 -6.997 572 HD23 LEU 66 HD23 LEU 66 -1.631 -1.104 -7.189 573 H ASN 67 HN ASN 67 -6.086 -2.270 -5.355 574 HA ASN 67 HA ASN 67 -8.630 -1.010 -5.761 575 HB2 ASN 67 HB2 ASN 67 -7.753 -3.711 -4.921 576 HB3 ASN 67 HB1 ASN 67 -9.396 -3.228 -4.611 577 HD21 ASN 67 HD21 ASN 67 -7.545 -2.186 -7.370 578 HD22 ASN 67 HD22 ASN 67 -8.459 -3.050 -8.550 579 H LYS 68 HN LYS 68 -6.378 -0.962 -3.356 580 HA LYS 68 HA LYS 68 -8.310 -0.748 -1.172 581 HB2 LYS 68 HB2 LYS 68 -5.292 -0.899 -1.140 582 HB3 LYS 68 HB1 LYS 68 -6.300 -0.751 0.295 583 HG2 LYS 68 HG2 LYS 68 -6.366 -3.045 -1.661 584 HG3 LYS 68 HG1 LYS 68 -5.561 -3.053 -0.090 585 HD2 LYS 68 HD2 LYS 68 -7.681 -2.750 1.038 586 HD3 LYS 68 HD1 LYS 68 -8.508 -2.596 -0.512 587 HE2 LYS 68 HE2 LYS 68 -7.949 -4.874 -1.076 588 HE3 LYS 68 HE1 LYS 68 -7.043 -5.050 0.426 589 HZ1 LYS 68 HZ1 LYS 68 -9.941 -4.432 0.301 590 HZ2 LYS 68 HZ2 LYS 68 -9.043 -4.827 1.679 591 HZ3 LYS 68 HZ3 LYS 68 -9.321 -5.993 0.490 592 H GLY 69 HN GLY 69 -7.804 0.949 0.477 593 HA2 GLY 69 HA2 GLY 69 -7.241 3.097 1.114 594 HA3 GLY 69 HA1 GLY 69 -6.445 3.324 -0.436 595 H ARG 70 HN ARG 70 -7.403 4.589 -1.875 596 HA ARG 70 HA ARG 70 -10.277 4.873 -1.955 597 HB2 ARG 70 HB2 ARG 70 -10.209 7.343 -1.716 598 HB3 ARG 70 HB1 ARG 70 -9.768 6.496 -0.240 599 HG2 ARG 70 HG2 ARG 70 -7.416 6.929 -0.674 600 HG3 ARG 70 HG1 ARG 70 -7.830 7.731 -2.190 601 HD2 ARG 70 HD2 ARG 70 -9.096 9.416 -0.953 602 HD3 ARG 70 HD1 ARG 70 -8.694 8.613 0.563 603 HE ARG 70 HE ARG 70 -6.320 9.223 -0.807 604 HH11 ARG 70 HH11 ARG 70 -8.937 10.845 0.861 605 HH12 ARG 70 HH12 ARG 70 -7.948 12.173 1.378 606 HH21 ARG 70 HH21 ARG 70 -5.036 10.994 -0.153 607 HH22 ARG 70 HH22 ARG 70 -5.742 12.265 0.793 608 H ARG 71 HN ARG 71 -8.415 3.828 -3.781 609 HA ARG 71 HA ARG 71 -7.946 5.869 -5.791 610 HB2 ARG 71 HB2 ARG 71 -7.311 2.920 -5.681 611 HB3 ARG 71 HB1 ARG 71 -7.023 3.902 -7.112 612 HG2 ARG 71 HG2 ARG 71 -5.826 4.427 -4.397 613 HG3 ARG 71 HG1 ARG 71 -5.010 3.595 -5.724 614 HD2 ARG 71 HD2 ARG 71 -5.207 5.594 -7.110 615 HD3 ARG 71 HD1 ARG 71 -6.060 6.424 -5.811 616 HE ARG 71 HE ARG 71 -3.557 5.518 -4.880 617 HH11 ARG 71 HH11 ARG 71 -4.946 7.911 -7.020 618 HH12 ARG 71 HH12 ARG 71 -3.659 9.054 -6.790 619 HH21 ARG 71 HH21 ARG 71 -1.844 7.025 -4.578 620 HH22 ARG 71 HH22 ARG 71 -1.907 8.554 -5.393 621 H GLU 72 HN GLU 72 -10.562 5.735 -5.280 622 HA GLU 72 HA GLU 72 -12.014 4.021 -7.034 623 HB2 GLU 72 HB2 GLU 72 -12.855 6.649 -5.787 624 HB3 GLU 72 HB1 GLU 72 -13.927 5.440 -6.480 625 HG2 GLU 72 HG2 GLU 72 -12.159 4.987 -4.089 626 HG3 GLU 72 HG1 GLU 72 -13.867 5.419 -4.014 627 H GLU 73 HN GLU 73 -10.624 7.218 -7.228 628 HA GLU 73 HA GLU 73 -11.811 7.891 -9.739 629 HB2 GLU 73 HB2 GLU 73 -9.516 9.096 -8.189 630 HB3 GLU 73 HB1 GLU 73 -10.115 9.754 -9.706 631 HG2 GLU 73 HG2 GLU 73 -11.705 9.443 -7.169 632 HG3 GLU 73 HG1 GLU 73 -11.033 10.948 -7.799 633 H LYS 74 HN LYS 74 -11.346 6.181 -11.084 634 HA LYS 74 HA LYS 74 -8.559 5.639 -11.743 635 HB2 LYS 74 HB2 LYS 74 -11.046 4.410 -12.942 636 HB3 LYS 74 HB1 LYS 74 -9.402 3.779 -13.006 637 HG2 LYS 74 HG2 LYS 74 -9.425 3.391 -10.617 638 HG3 LYS 74 HG1 LYS 74 -11.036 4.096 -10.495 639 HD2 LYS 74 HD2 LYS 74 -11.825 2.295 -12.061 640 HD3 LYS 74 HD1 LYS 74 -10.237 1.546 -11.882 641 HE2 LYS 74 HE2 LYS 74 -12.248 2.081 -9.703 642 HE3 LYS 74 HE1 LYS 74 -11.780 0.510 -10.348 643 HZ1 LYS 74 HZ1 LYS 74 -10.673 0.911 -8.268 644 HZ2 LYS 74 HZ2 LYS 74 -10.039 2.374 -8.824 645 HZ3 LYS 74 HZ3 LYS 74 -9.524 0.917 -9.509 646 H VAL 75 HN VAL 75 -11.351 7.298 -12.900 647 HA VAL 75 HA VAL 75 -10.041 8.010 -15.407 648 HB VAL 75 HB VAL 75 -12.162 9.316 -15.835 649 HG11 VAL 75 HG11 VAL 75 -13.504 7.321 -16.330 650 HG12 VAL 75 HG12 VAL 75 -12.438 6.360 -15.306 651 HG13 VAL 75 HG13 VAL 75 -11.812 7.101 -16.777 652 HG21 VAL 75 HG21 VAL 75 -13.105 7.862 -13.364 653 HG22 VAL 75 HG22 VAL 75 -14.121 8.794 -14.463 654 HG23 VAL 75 HG23 VAL 75 -12.874 9.603 -13.513 655 H GLY 76 HN GLY 76 -8.408 8.916 -13.691 656 HA2 GLY 76 HA2 GLY 76 -9.095 11.472 -12.554 657 HA3 GLY 76 HA1 GLY 76 -7.510 10.714 -12.543 658 H LYS 77 HN LYS 77 -8.036 10.423 -15.611 659 HA LYS 77 HA LYS 77 -6.657 12.870 -16.290 660 HB2 LYS 77 HB2 LYS 77 -6.051 10.618 -17.226 661 HB3 LYS 77 HB1 LYS 77 -7.556 10.649 -18.132 662 HG2 LYS 77 HG2 LYS 77 -6.827 12.570 -19.381 663 HG3 LYS 77 HG1 LYS 77 -5.369 12.704 -18.396 664 HD2 LYS 77 HD2 LYS 77 -6.065 10.355 -20.161 665 HD3 LYS 77 HD1 LYS 77 -4.951 11.653 -20.594 666 HE2 LYS 77 HE2 LYS 77 -3.544 11.062 -18.664 667 HE3 LYS 77 HE1 LYS 77 -4.646 9.742 -18.279 668 HZ1 LYS 77 HZ1 LYS 77 -2.697 8.993 -19.507 669 HZ2 LYS 77 HZ2 LYS 77 -3.108 9.996 -20.803 670 HZ3 LYS 77 HZ3 LYS 77 -4.117 8.709 -20.378 671 H LYS 78 HN LYS 78 -8.819 13.832 -15.426 672 HA LYS 78 HA LYS 78 -10.894 14.032 -17.455 673 HB2 LYS 78 HB2 LYS 78 -12.040 15.425 -15.712 674 HB3 LYS 78 HB1 LYS 78 -11.665 13.788 -15.192 675 HG2 LYS 78 HG2 LYS 78 -9.827 14.531 -13.883 676 HG3 LYS 78 HG1 LYS 78 -9.921 16.153 -14.571 677 HD2 LYS 78 HD2 LYS 78 -12.146 16.423 -13.531 678 HD3 LYS 78 HD1 LYS 78 -11.962 14.834 -12.784 679 HE2 LYS 78 HE2 LYS 78 -11.385 16.691 -11.258 680 HE3 LYS 78 HE1 LYS 78 -10.038 15.591 -11.543 681 HZ1 LYS 78 HZ1 LYS 78 -10.428 18.197 -12.918 682 HZ2 LYS 78 HZ2 LYS 78 -9.107 17.157 -13.104 683 HZ3 LYS 78 HZ3 LYS 78 -9.372 17.929 -11.625 684 H GLU 79 HN GLU 79 -8.555 15.050 -18.404 685 HA GLU 79 HA GLU 79 -8.025 17.748 -17.840 686 HB2 GLU 79 HB2 GLU 79 -7.528 16.165 -20.360 687 HB3 GLU 79 HB1 GLU 79 -6.878 17.766 -20.049 688 HG2 GLU 79 HG2 GLU 79 -5.679 16.891 -18.103 689 HG3 GLU 79 HG1 GLU 79 -6.307 15.280 -18.458 690 H LYS 80 HN LYS 80 -10.047 16.257 -20.324 691 HA LYS 80 HA LYS 80 -11.755 18.542 -20.453 692 HB2 LYS 80 HB2 LYS 80 -11.378 18.966 -22.896 693 HB3 LYS 80 HB1 LYS 80 -10.049 19.459 -21.858 694 HG2 LYS 80 HG2 LYS 80 -8.795 17.485 -22.469 695 HG3 LYS 80 HG1 LYS 80 -10.146 16.900 -23.440 696 HD2 LYS 80 HD2 LYS 80 -9.947 18.891 -24.876 697 HD3 LYS 80 HD1 LYS 80 -8.559 19.419 -23.921 698 HE2 LYS 80 HE2 LYS 80 -7.857 18.299 -25.976 699 HE3 LYS 80 HE1 LYS 80 -7.346 17.411 -24.545 700 HZ1 LYS 80 HZ1 LYS 80 -9.700 16.756 -26.231 701 HZ2 LYS 80 HZ2 LYS 80 -9.209 15.907 -24.857 702 HZ3 LYS 80 HZ3 LYS 80 -8.226 15.930 -26.228 703 H ILE 81 HN ILE 81 -12.486 16.131 -19.726 704 HA ILE 81 HA ILE 81 -13.430 14.579 -21.985 705 HB ILE 81 HB ILE 81 -14.142 14.214 -19.068 706 HG12 ILE 81 HG12 ILE 81 -11.698 14.148 -19.356 707 HG13 ILE 81 HG11 ILE 81 -12.338 12.558 -18.959 708 HG21 ILE 81 HG21 ILE 81 -15.613 13.051 -20.609 709 HG22 ILE 81 HG22 ILE 81 -14.599 11.897 -19.745 710 HG23 ILE 81 HG23 ILE 81 -14.225 12.321 -21.414 711 HD11 ILE 81 HD11 ILE 81 -11.528 13.511 -21.696 712 HD12 ILE 81 HD12 ILE 81 -12.180 11.919 -21.313 713 HD13 ILE 81 HD13 ILE 81 -10.618 12.412 -20.659 714 H GLY 82 HN GLY 82 -14.631 16.871 -19.642 715 HA2 GLY 82 HA2 GLY 82 -16.418 18.328 -19.913 716 HA3 GLY 82 HA1 GLY 82 -16.905 17.431 -21.344 717 H LYS 83 HN LYS 83 -18.665 16.237 -21.189 718 HA LYS 83 HA LYS 83 -19.962 15.943 -18.616 719 HB2 LYS 83 HB2 LYS 83 -20.915 16.414 -21.111 720 HB3 LYS 83 HB1 LYS 83 -21.122 14.673 -21.031 721 HG2 LYS 83 HG2 LYS 83 -22.213 16.595 -18.988 722 HG3 LYS 83 HG1 LYS 83 -23.124 15.996 -20.373 723 HD2 LYS 83 HD2 LYS 83 -22.790 13.686 -19.537 724 HD3 LYS 83 HD1 LYS 83 -21.981 14.350 -18.115 725 HE2 LYS 83 HE2 LYS 83 -24.005 15.564 -17.515 726 HE3 LYS 83 HE1 LYS 83 -24.817 14.953 -18.954 727 HZ1 LYS 83 HZ1 LYS 83 -24.533 12.699 -18.058 728 HZ2 LYS 83 HZ2 LYS 83 -25.467 13.682 -17.050 729 HZ3 LYS 83 HZ3 LYS 83 -23.859 13.349 -16.647 730 H LYS 84 HN LYS 84 -17.900 14.556 -18.147 731 HA LYS 84 HA LYS 84 -17.931 11.845 -19.061 732 HB2 LYS 84 HB2 LYS 84 -16.278 11.456 -17.267 733 HB3 LYS 84 HB1 LYS 84 -15.862 12.844 -18.260 734 HG2 LYS 84 HG2 LYS 84 -16.791 14.326 -16.518 735 HG3 LYS 84 HG1 LYS 84 -17.097 12.908 -15.515 736 HD2 LYS 84 HD2 LYS 84 -14.384 13.737 -16.545 737 HD3 LYS 84 HD1 LYS 84 -14.998 14.098 -14.933 738 HE2 LYS 84 HE2 LYS 84 -14.554 11.347 -16.087 739 HE3 LYS 84 HE1 LYS 84 -13.521 12.153 -14.910 740 HZ1 LYS 84 HZ1 LYS 84 -15.505 12.223 -13.418 741 HZ2 LYS 84 HZ2 LYS 84 -14.915 10.674 -13.733 742 HZ3 LYS 84 HZ3 LYS 84 -16.307 11.216 -14.520 743 H LYS 85 HN LYS 85 -19.422 13.625 -16.532 744 HA LYS 85 HA LYS 85 -21.337 11.592 -16.032 745 HB2 LYS 85 HB2 LYS 85 -19.425 10.773 -14.626 746 HB3 LYS 85 HB1 LYS 85 -19.480 12.289 -13.740 747 HG2 LYS 85 HG2 LYS 85 -20.612 10.631 -12.459 748 HG3 LYS 85 HG1 LYS 85 -21.820 11.752 -13.087 749 HD2 LYS 85 HD2 LYS 85 -22.306 10.160 -14.910 750 HD3 LYS 85 HD1 LYS 85 -21.143 9.033 -14.210 751 HE2 LYS 85 HE2 LYS 85 -23.634 10.064 -12.858 752 HE3 LYS 85 HE1 LYS 85 -23.447 8.473 -13.592 753 HZ1 LYS 85 HZ1 LYS 85 -21.833 9.490 -11.317 754 HZ2 LYS 85 HZ2 LYS 85 -21.758 7.938 -11.984 755 HZ3 LYS 85 HZ3 LYS 85 -23.154 8.444 -11.177 756 H ARG 86 HN ARG 86 -19.839 14.163 -14.094 757 HA ARG 86 HA ARG 86 -22.331 15.575 -13.809 758 HB2 ARG 86 HB2 ARG 86 -20.725 15.638 -11.995 759 HB3 ARG 86 HB1 ARG 86 -19.484 16.270 -13.064 760 HG2 ARG 86 HG2 ARG 86 -20.837 18.321 -13.351 761 HG3 ARG 86 HG1 ARG 86 -21.980 17.687 -12.164 762 HD2 ARG 86 HD2 ARG 86 -20.260 17.643 -10.472 763 HD3 ARG 86 HD1 ARG 86 -19.047 18.143 -11.649 764 HE ARG 86 HE ARG 86 -21.138 20.040 -11.548 765 HH11 ARG 86 HH11 ARG 86 -18.388 18.899 -9.706 766 HH12 ARG 86 HH12 ARG 86 -18.135 20.415 -8.899 767 HH21 ARG 86 HH21 ARG 86 -20.798 22.044 -10.500 768 HH22 ARG 86 HH22 ARG 86 -19.505 22.202 -9.351 769 H GLN 87 HN GLN 87 -22.952 17.427 -14.874 770 HA GLN 87 HA GLN 87 -21.422 18.043 -17.291 771 HB2 GLN 87 HB2 GLN 87 -23.785 17.469 -17.603 772 HB3 GLN 87 HB1 GLN 87 -24.253 18.790 -16.541 773 HG2 GLN 87 HG2 GLN 87 -23.414 20.411 -18.097 774 HG3 GLN 87 HG1 GLN 87 -22.748 19.140 -19.122 775 HE21 GLN 87 HE21 GLN 87 -24.689 21.229 -19.743 776 HE22 GLN 87 HE22 GLN 87 -26.107 20.410 -20.304 777 H LYS 88 HN LYS 88 -20.330 19.843 -17.492 778 HA LYS 88 HA LYS 88 -21.153 22.275 -16.159 779 HB2 LYS 88 HB2 LYS 88 -18.823 22.668 -15.281 780 HB3 LYS 88 HB1 LYS 88 -19.714 21.407 -14.446 781 HG2 LYS 88 HG2 LYS 88 -17.652 20.434 -14.667 782 HG3 LYS 88 HG1 LYS 88 -18.471 19.820 -16.102 783 HD2 LYS 88 HD2 LYS 88 -17.453 21.759 -17.362 784 HD3 LYS 88 HD1 LYS 88 -16.469 22.063 -15.929 785 HE2 LYS 88 HE2 LYS 88 -16.525 19.505 -17.527 786 HE3 LYS 88 HE1 LYS 88 -15.261 20.729 -17.586 787 HZ1 LYS 88 HZ1 LYS 88 -15.993 19.079 -15.230 788 HZ2 LYS 88 HZ2 LYS 88 -14.820 20.300 -15.231 789 HZ3 LYS 88 HZ3 LYS 88 -14.599 18.918 -16.175 790 H LYS 89 HN LYS 89 -20.410 24.114 -17.246 791 HA LYS 89 HA LYS 89 -19.391 23.571 -19.922 792 HB2 LYS 89 HB2 LYS 89 -20.308 26.199 -18.741 793 HB3 LYS 89 HB1 LYS 89 -20.005 25.863 -20.437 794 HG2 LYS 89 HG2 LYS 89 -21.865 24.271 -20.451 795 HG3 LYS 89 HG1 LYS 89 -22.172 24.629 -18.753 796 HD2 LYS 89 HD2 LYS 89 -23.702 26.004 -19.787 797 HD3 LYS 89 HD1 LYS 89 -22.334 27.096 -19.592 798 HE2 LYS 89 HE2 LYS 89 -23.023 25.564 -22.099 799 HE3 LYS 89 HE1 LYS 89 -23.346 27.271 -21.819 800 HZ1 LYS 89 HZ1 LYS 89 -20.918 27.586 -21.582 801 HZ2 LYS 89 HZ2 LYS 89 -21.385 27.069 -23.119 802 HZ3 LYS 89 HZ3 LYS 89 -20.690 25.973 -22.040 803 H ARG 90 HN ARG 90 -18.638 25.550 -17.092 804 HA ARG 90 HA ARG 90 -15.803 25.434 -17.797 805 HB2 ARG 90 HB2 ARG 90 -17.255 27.997 -17.092 806 HB3 ARG 90 HB1 ARG 90 -15.515 27.834 -17.273 807 HG2 ARG 90 HG2 ARG 90 -15.826 27.248 -19.633 808 HG3 ARG 90 HG1 ARG 90 -17.568 27.449 -19.441 809 HD2 ARG 90 HD2 ARG 90 -15.455 29.570 -19.110 810 HD3 ARG 90 HD1 ARG 90 -16.622 29.440 -20.422 811 HE ARG 90 HE ARG 90 -17.495 29.856 -17.638 812 HH11 ARG 90 HH11 ARG 90 -17.471 30.818 -21.009 813 HH12 ARG 90 HH12 ARG 90 -18.639 32.083 -20.784 814 HH21 ARG 90 HH21 ARG 90 -19.050 31.499 -17.352 815 HH22 ARG 90 HH22 ARG 90 -19.541 32.464 -18.710 816 H LYS 91 HN LYS 91 -14.411 25.732 -15.983 817 HA LYS 91 HA LYS 91 -15.659 26.095 -13.380 818 HB2 LYS 91 HB2 LYS 91 -15.607 23.620 -13.846 819 HB3 LYS 91 HB1 LYS 91 -13.853 23.730 -13.905 820 HG2 LYS 91 HG2 LYS 91 -13.831 24.527 -11.588 821 HG3 LYS 91 HG1 LYS 91 -15.588 24.384 -11.533 822 HD2 LYS 91 HD2 LYS 91 -15.377 21.968 -11.992 823 HD3 LYS 91 HD1 LYS 91 -13.620 22.138 -11.965 824 HE2 LYS 91 HE2 LYS 91 -13.781 22.978 -9.642 825 HE3 LYS 91 HE1 LYS 91 -15.517 22.679 -9.684 826 HZ1 LYS 91 HZ1 LYS 91 -15.052 20.331 -10.059 827 HZ2 LYS 91 HZ2 LYS 91 -14.351 20.866 -8.618 828 HZ3 LYS 91 HZ3 LYS 91 -13.390 20.632 -9.986 829 H ALA 92 HN ALA 92 -14.547 28.100 -13.633 830 HA ALA 92 HA ALA 92 -11.929 28.033 -12.448 831 HB1 ALA 92 HB1 ALA 92 -11.328 27.774 -14.804 832 HB2 ALA 92 HB2 ALA 92 -10.806 29.341 -14.186 833 HB3 ALA 92 HB3 ALA 92 -12.242 29.229 -15.201 834 H ALA 93 HN ALA 93 -12.913 29.162 -10.785 835 HA ALA 93 HA ALA 93 -14.284 31.646 -11.265 836 HB1 ALA 93 HB1 ALA 93 -13.274 30.476 -8.672 837 HB2 ALA 93 HB2 ALA 93 -14.874 30.208 -9.363 838 HB3 ALA 93 HB3 ALA 93 -14.400 31.823 -8.840 839 H GLN 94 HN GLN 94 -11.054 30.615 -10.635 840 HA GLN 94 HA GLN 94 -10.020 33.156 -9.826 841 HB2 GLN 94 HB2 GLN 94 -7.816 32.115 -10.186 842 HB3 GLN 94 HB1 GLN 94 -8.869 31.092 -9.218 843 HG2 GLN 94 HG2 GLN 94 -9.348 29.712 -11.152 844 HG3 GLN 94 HG1 GLN 94 -8.355 30.759 -12.164 845 HE21 GLN 94 HE21 GLN 94 -7.002 29.071 -12.738 846 HE22 GLN 94 HE22 GLN 94 -5.851 28.395 -11.637 847 H LYS 95 HN LYS 95 -8.698 34.560 -11.059 848 HA LYS 95 HA LYS 95 -9.340 34.558 -13.912 849 HB2 LYS 95 HB2 LYS 95 -8.007 36.705 -12.253 850 HB3 LYS 95 HB1 LYS 95 -8.579 36.871 -13.905 851 HG2 LYS 95 HG2 LYS 95 -10.877 36.538 -13.138 852 HG3 LYS 95 HG1 LYS 95 -10.293 36.390 -11.479 853 HD2 LYS 95 HD2 LYS 95 -9.354 38.665 -11.636 854 HD3 LYS 95 HD1 LYS 95 -10.025 38.809 -13.262 855 HE2 LYS 95 HE2 LYS 95 -12.279 38.462 -12.327 856 HE3 LYS 95 HE1 LYS 95 -11.580 38.402 -10.711 857 HZ1 LYS 95 HZ1 LYS 95 -11.510 40.721 -12.564 858 HZ2 LYS 95 HZ2 LYS 95 -10.765 40.669 -11.047 859 HZ3 LYS 95 HZ3 LYS 95 -12.448 40.585 -11.162 860 H ARG 96 HN ARG 96 -7.785 32.648 -14.009 861 HA ARG 96 HA ARG 96 -4.983 33.325 -13.762 862 HB2 ARG 96 HB2 ARG 96 -5.800 31.066 -13.157 863 HB3 ARG 96 HB1 ARG 96 -6.260 30.799 -14.832 864 HG2 ARG 96 HG2 ARG 96 -4.146 29.712 -14.296 865 HG3 ARG 96 HG1 ARG 96 -3.932 30.965 -15.518 866 HD2 ARG 96 HD2 ARG 96 -3.147 32.508 -13.768 867 HD3 ARG 96 HD1 ARG 96 -3.323 31.222 -12.575 868 HE ARG 96 HE ARG 96 -1.687 30.184 -14.518 869 HH11 ARG 96 HH11 ARG 96 -1.588 32.954 -12.379 870 HH12 ARG 96 HH12 ARG 96 0.147 33.003 -12.319 871 HH21 ARG 96 HH21 ARG 96 0.589 30.247 -14.436 872 HH22 ARG 96 HH22 ARG 96 1.385 31.462 -13.485 873 H LYS 97 HN LYS 97 -5.297 35.112 -15.292 874 HA LYS 97 HA LYS 97 -4.453 34.232 -17.931 875 HB2 LYS 97 HB2 LYS 97 -5.925 35.963 -19.006 876 HB3 LYS 97 HB1 LYS 97 -6.785 34.588 -18.331 877 HG2 LYS 97 HG2 LYS 97 -7.401 35.916 -16.382 878 HG3 LYS 97 HG1 LYS 97 -6.509 37.293 -17.032 879 HD2 LYS 97 HD2 LYS 97 -7.995 37.309 -18.992 880 HD3 LYS 97 HD1 LYS 97 -8.901 35.962 -18.300 881 HE2 LYS 97 HE2 LYS 97 -9.488 37.342 -16.372 882 HE3 LYS 97 HE1 LYS 97 -8.571 38.686 -17.050 883 HZ1 LYS 97 HZ1 LYS 97 -10.874 38.990 -17.531 884 HZ2 LYS 97 HZ2 LYS 97 -11.009 37.444 -18.197 885 HZ3 LYS 97 HZ3 LYS 97 -10.083 38.623 -18.980 886 H ASN 98 HN ASN 98 -2.467 35.055 -17.980 887 HA ASN 98 HA ASN 98 -2.144 37.903 -17.791 888 HB2 ASN 98 HB2 ASN 98 -0.403 37.946 -16.108 889 HB3 ASN 98 HB1 ASN 98 -1.870 37.270 -15.424 890 HD21 ASN 98 HD21 ASN 98 -1.554 34.627 -16.489 891 HD22 ASN 98 HD22 ASN 98 -0.221 33.899 -15.666 Start of MODEL 15 1 H1 LYS 1 HT1 LYS 1 12.887 25.899 5.206 2 H2 LYS 1 HT2 LYS 1 12.064 25.619 3.760 3 H3 LYS 1 HT3 LYS 1 13.751 25.619 3.783 4 HA LYS 1 HA LYS 1 12.881 23.384 3.656 5 HB2 LYS 1 HB2 LYS 1 14.221 24.126 6.259 6 HB3 LYS 1 HB1 LYS 1 14.062 22.478 5.672 7 HG2 LYS 1 HG2 LYS 1 15.388 23.046 3.703 8 HG3 LYS 1 HG1 LYS 1 15.543 24.704 4.287 9 HD2 LYS 1 HD2 LYS 1 16.725 23.917 6.262 10 HD3 LYS 1 HD1 LYS 1 16.518 22.245 5.737 11 HE2 LYS 1 HE2 LYS 1 17.851 22.707 3.741 12 HE3 LYS 1 HE1 LYS 1 18.052 24.380 4.257 13 HZ1 LYS 1 HZ1 LYS 1 19.248 23.624 6.195 14 HZ2 LYS 1 HZ2 LYS 1 19.979 23.001 4.804 15 HZ3 LYS 1 HZ3 LYS 1 19.008 22.006 5.765 16 HA PRO 2 HA PRO 2 9.040 23.016 5.997 17 HB2 PRO 2 HB2 PRO 2 8.615 20.572 4.494 18 HB3 PRO 2 HB1 PRO 2 7.719 22.088 4.407 19 HG2 PRO 2 HG2 PRO 2 9.306 21.156 2.399 20 HG3 PRO 2 HG1 PRO 2 8.971 22.874 2.665 21 HD2 PRO 2 HD2 PRO 2 11.391 21.276 3.396 22 HD3 PRO 2 HD1 PRO 2 11.276 22.936 2.775 23 H VAL 3 HN VAL 3 8.122 21.284 7.348 24 HA VAL 3 HA VAL 3 10.206 19.789 8.679 25 HB VAL 3 HB VAL 3 7.246 19.644 9.260 26 HG11 VAL 3 HG11 VAL 3 9.678 19.195 10.987 27 HG12 VAL 3 HG12 VAL 3 8.623 17.943 10.331 28 HG13 VAL 3 HG13 VAL 3 8.001 19.086 11.521 29 HG21 VAL 3 HG21 VAL 3 7.580 21.435 10.894 30 HG22 VAL 3 HG22 VAL 3 7.905 21.992 9.253 31 HG23 VAL 3 HG23 VAL 3 9.244 21.628 10.342 32 H SER 4 HN SER 4 10.749 17.751 8.224 33 HA SER 4 HA SER 4 9.519 16.505 5.966 34 HB2 SER 4 HB2 SER 4 11.745 15.521 7.749 35 HB3 SER 4 HB1 SER 4 11.316 14.859 6.174 36 HG SER 4 HG SER 4 13.102 16.489 6.330 37 H LEU 5 HN LEU 5 7.437 15.952 6.675 38 HA LEU 5 HA LEU 5 7.393 13.467 8.264 39 HB2 LEU 5 HB2 LEU 5 5.353 15.631 7.902 40 HB3 LEU 5 HB1 LEU 5 4.831 14.001 8.270 41 HG LEU 5 HG LEU 5 4.888 15.263 10.303 42 HD11 LEU 5 HD11 LEU 5 6.357 13.920 11.660 43 HD12 LEU 5 HD12 LEU 5 7.297 13.457 10.244 44 HD13 LEU 5 HD13 LEU 5 5.627 12.917 10.405 45 HD21 LEU 5 HD21 LEU 5 6.938 16.287 11.159 46 HD22 LEU 5 HD22 LEU 5 6.417 17.024 9.643 47 HD23 LEU 5 HD23 LEU 5 7.763 15.882 9.653 48 H SER 6 HN SER 6 5.573 15.079 5.668 49 HA SER 6 HA SER 6 5.381 12.496 4.276 50 HB2 SER 6 HB2 SER 6 3.268 13.791 4.820 51 HB3 SER 6 HB1 SER 6 3.827 15.034 3.703 52 HG SER 6 HG SER 6 3.565 13.680 2.027 53 H TYR 7 HN TYR 7 7.490 14.787 4.478 54 HA TYR 7 HA TYR 7 7.849 15.693 1.798 55 HB2 TYR 7 HB2 TYR 7 8.688 16.833 3.908 56 HB3 TYR 7 HB1 TYR 7 9.927 15.589 3.989 57 HD1 TYR 7 HD1 TYR 7 11.774 15.573 2.413 58 HD2 TYR 7 HD2 TYR 7 8.783 18.590 2.232 59 HE1 TYR 7 HE1 TYR 7 13.216 16.910 0.940 60 HE2 TYR 7 HE2 TYR 7 10.220 19.934 0.760 61 HH TYR 7 HH TYR 7 12.736 20.131 0.323 62 H ARG 8 HN ARG 8 8.296 12.808 3.278 63 HA ARG 8 HA ARG 8 9.801 11.741 1.051 64 HB2 ARG 8 HB2 ARG 8 11.413 10.561 2.489 65 HB3 ARG 8 HB1 ARG 8 11.583 12.305 2.621 66 HG2 ARG 8 HG2 ARG 8 10.424 12.299 4.735 67 HG3 ARG 8 HG1 ARG 8 10.117 10.566 4.590 68 HD2 ARG 8 HD2 ARG 8 12.510 10.125 4.636 69 HD3 ARG 8 HD1 ARG 8 12.838 11.854 4.735 70 HE ARG 8 HE ARG 8 11.273 11.476 6.869 71 HH11 ARG 8 HH11 ARG 8 14.053 9.684 5.723 72 HH12 ARG 8 HH12 ARG 8 14.577 9.237 7.313 73 HH21 ARG 8 HH21 ARG 8 11.951 10.894 8.952 74 HH22 ARG 8 HH22 ARG 8 13.372 9.924 9.158 75 H CYS 9 HN CYS 9 9.587 9.450 0.872 76 HA CYS 9 HA CYS 9 7.041 8.563 1.799 77 HB2 CYS 9 HB2 CYS 9 9.123 7.019 0.266 78 HB3 CYS 9 HB1 CYS 9 7.409 6.684 0.367 79 HA PRO 10 HA PRO 10 7.748 6.576 5.565 80 HB2 PRO 10 HB2 PRO 10 6.576 4.163 4.306 81 HB3 PRO 10 HB1 PRO 10 6.146 4.961 5.820 82 HG2 PRO 10 HG2 PRO 10 4.684 5.254 3.586 83 HG3 PRO 10 HG1 PRO 10 4.871 6.546 4.778 84 HD2 PRO 10 HD2 PRO 10 6.023 6.319 2.074 85 HD3 PRO 10 HD1 PRO 10 5.716 7.759 3.055 86 H CYS 11 HN CYS 11 8.141 4.031 3.111 87 HA CYS 11 HA CYS 11 10.209 2.859 4.772 88 HB2 CYS 11 HB2 CYS 11 8.355 1.504 3.707 89 HB3 CYS 11 HB1 CYS 11 9.178 1.758 2.177 90 H ARG 12 HN ARG 12 12.206 2.161 3.978 91 HA ARG 12 HA ARG 12 13.593 3.957 2.272 92 HB2 ARG 12 HB2 ARG 12 14.354 1.358 3.587 93 HB3 ARG 12 HB1 ARG 12 15.407 2.150 2.437 94 HG2 ARG 12 HG2 ARG 12 15.985 2.637 4.774 95 HG3 ARG 12 HG1 ARG 12 15.621 4.078 3.823 96 HD2 ARG 12 HD2 ARG 12 14.560 4.310 5.944 97 HD3 ARG 12 HD1 ARG 12 13.330 4.003 4.720 98 HE ARG 12 HE ARG 12 14.169 1.592 5.972 99 HH11 ARG 12 HH11 ARG 12 12.159 4.425 6.435 100 HH12 ARG 12 HH12 ARG 12 11.061 3.625 7.516 101 HH21 ARG 12 HH21 ARG 12 12.715 0.533 7.397 102 HH22 ARG 12 HH22 ARG 12 11.377 1.417 8.063 103 H PHE 13 HN PHE 13 15.187 2.356 0.673 104 HA PHE 13 HA PHE 13 13.342 2.207 -1.513 105 HB2 PHE 13 HB2 PHE 13 16.272 1.467 -1.551 106 HB3 PHE 13 HB1 PHE 13 15.278 2.025 -2.899 107 HD1 PHE 13 HD1 PHE 13 14.464 4.380 -2.918 108 HD2 PHE 13 HD2 PHE 13 17.358 2.997 -0.125 109 HE1 PHE 13 HE1 PHE 13 15.160 6.687 -2.508 110 HE2 PHE 13 HE2 PHE 13 18.053 5.306 0.301 111 HZ PHE 13 HZ PHE 13 16.857 7.163 -0.743 112 H PHE 14 HN PHE 14 12.789 0.447 -2.694 113 HA PHE 14 HA PHE 14 12.514 -1.884 -1.014 114 HB2 PHE 14 HB2 PHE 14 11.148 -2.049 -3.548 115 HB3 PHE 14 HB1 PHE 14 10.494 -2.041 -1.924 116 HD1 PHE 14 HD1 PHE 14 9.730 -0.004 -0.877 117 HD2 PHE 14 HD2 PHE 14 11.312 0.009 -4.826 118 HE1 PHE 14 HE1 PHE 14 8.804 2.247 -1.238 119 HE2 PHE 14 HE2 PHE 14 10.391 2.257 -5.193 120 HZ PHE 14 HZ PHE 14 9.121 3.375 -3.377 121 H GLU 15 HN GLU 15 12.454 -4.096 -2.127 122 HA GLU 15 HA GLU 15 14.973 -4.275 -3.599 123 HB2 GLU 15 HB2 GLU 15 15.468 -6.139 -2.403 124 HB3 GLU 15 HB1 GLU 15 14.370 -5.388 -1.275 125 HG2 GLU 15 HG2 GLU 15 13.562 -7.403 -3.251 126 HG3 GLU 15 HG1 GLU 15 14.043 -7.789 -1.629 127 H SER 16 HN SER 16 15.080 -5.253 -5.526 128 HA SER 16 HA SER 16 12.508 -6.132 -6.634 129 HB2 SER 16 HB2 SER 16 13.826 -5.759 -8.855 130 HB3 SER 16 HB1 SER 16 13.219 -4.358 -7.972 131 HG SER 16 HG SER 16 15.202 -3.791 -7.462 132 H HIS 17 HN HIS 17 13.870 -7.866 -5.016 133 HA HIS 17 HA HIS 17 14.867 -9.876 -6.919 134 HB2 HIS 17 HB2 HIS 17 16.011 -9.354 -4.166 135 HB3 HIS 17 HB1 HIS 17 16.507 -10.643 -5.254 136 HD1 HIS 17 HD1 HIS 17 17.932 -9.951 -7.337 137 HD2 HIS 17 HD2 HIS 17 17.094 -6.864 -4.687 138 HE1 HIS 17 HE1 HIS 17 19.483 -8.076 -7.968 139 HE2 HIS 17 HE2 HIS 17 18.798 -6.154 -6.492 140 H ILE 18 HN ILE 18 13.004 -9.104 -4.071 141 HA ILE 18 HA ILE 18 12.798 -11.841 -3.210 142 HB ILE 18 HB ILE 18 11.524 -9.284 -2.307 143 HG12 ILE 18 HG12 ILE 18 13.261 -11.283 -0.875 144 HG13 ILE 18 HG11 ILE 18 13.899 -9.913 -1.768 145 HG21 ILE 18 HG21 ILE 18 10.930 -12.025 -1.198 146 HG22 ILE 18 HG22 ILE 18 9.794 -10.991 -2.066 147 HG23 ILE 18 HG23 ILE 18 10.418 -10.489 -0.493 148 HD11 ILE 18 HD11 ILE 18 12.001 -9.671 0.552 149 HD12 ILE 18 HD12 ILE 18 12.879 -8.371 -0.263 150 HD13 ILE 18 HD13 ILE 18 13.757 -9.573 0.683 151 H ALA 19 HN ALA 19 10.932 -13.119 -3.134 152 HA ALA 19 HA ALA 19 9.147 -12.727 -5.450 153 HB1 ALA 19 HB1 ALA 19 10.809 -14.527 -5.729 154 HB2 ALA 19 HB2 ALA 19 9.149 -15.121 -5.740 155 HB3 ALA 19 HB3 ALA 19 10.146 -15.323 -4.298 156 H ARG 20 HN ARG 20 7.046 -13.896 -5.299 157 HA ARG 20 HA ARG 20 5.660 -13.298 -2.944 158 HB2 ARG 20 HB2 ARG 20 4.224 -15.247 -4.340 159 HB3 ARG 20 HB1 ARG 20 4.004 -13.522 -4.386 160 HG2 ARG 20 HG2 ARG 20 5.522 -13.368 -6.280 161 HG3 ARG 20 HG1 ARG 20 5.751 -15.116 -6.220 162 HD2 ARG 20 HD2 ARG 20 3.402 -15.476 -6.684 163 HD3 ARG 20 HD1 ARG 20 3.102 -13.740 -6.634 164 HE ARG 20 HE ARG 20 5.044 -14.581 -8.602 165 HH11 ARG 20 HH11 ARG 20 1.664 -13.950 -7.941 166 HH12 ARG 20 HH12 ARG 20 1.252 -13.698 -9.609 167 HH21 ARG 20 HH21 ARG 20 4.508 -14.220 -10.804 168 HH22 ARG 20 HH22 ARG 20 2.869 -13.843 -11.234 169 H ALA 21 HN ALA 21 6.965 -16.235 -4.268 170 HA ALA 21 HA ALA 21 5.923 -17.930 -2.194 171 HB1 ALA 21 HB1 ALA 21 7.228 -19.697 -3.246 172 HB2 ALA 21 HB2 ALA 21 8.027 -18.504 -4.268 173 HB3 ALA 21 HB3 ALA 21 6.297 -18.796 -4.441 174 H ASN 22 HN ASN 22 8.244 -15.676 -2.072 175 HA ASN 22 HA ASN 22 9.743 -17.182 -0.053 176 HB2 ASN 22 HB2 ASN 22 10.635 -15.396 -2.207 177 HB3 ASN 22 HB1 ASN 22 11.335 -15.026 -0.641 178 HD21 ASN 22 HD21 ASN 22 13.380 -15.682 -1.182 179 HD22 ASN 22 HD22 ASN 22 13.795 -17.337 -1.441 180 H VAL 23 HN VAL 23 7.401 -14.934 -0.430 181 HA VAL 23 HA VAL 23 8.298 -13.411 1.912 182 HB VAL 23 HB VAL 23 7.705 -12.028 -0.012 183 HG11 VAL 23 HG11 VAL 23 5.997 -13.479 -1.014 184 HG12 VAL 23 HG12 VAL 23 5.399 -11.836 -0.771 185 HG13 VAL 23 HG13 VAL 23 4.920 -13.124 0.338 186 HG21 VAL 23 HG21 VAL 23 7.428 -11.195 2.241 187 HG22 VAL 23 HG22 VAL 23 5.761 -11.766 2.244 188 HG23 VAL 23 HG23 VAL 23 6.254 -10.492 1.126 189 H LYS 24 HN LYS 24 7.067 -13.123 3.629 190 HA LYS 24 HA LYS 24 4.831 -14.940 4.104 191 HB2 LYS 24 HB2 LYS 24 6.430 -13.302 6.086 192 HB3 LYS 24 HB1 LYS 24 5.233 -14.526 6.465 193 HG2 LYS 24 HG2 LYS 24 6.787 -16.088 5.103 194 HG3 LYS 24 HG1 LYS 24 7.994 -14.849 5.427 195 HD2 LYS 24 HD2 LYS 24 6.358 -16.238 7.544 196 HD3 LYS 24 HD1 LYS 24 7.997 -16.683 7.088 197 HE2 LYS 24 HE2 LYS 24 8.749 -14.425 7.697 198 HE3 LYS 24 HE1 LYS 24 7.117 -14.059 8.254 199 HZ1 LYS 24 HZ1 LYS 24 8.898 -16.172 9.336 200 HZ2 LYS 24 HZ2 LYS 24 7.321 -15.874 9.858 201 HZ3 LYS 24 HZ3 LYS 24 8.523 -14.704 10.092 202 H HIS 25 HN HIS 25 3.804 -13.314 6.276 203 HA HIS 25 HA HIS 25 1.713 -11.968 5.381 204 HB2 HIS 25 HB2 HIS 25 3.066 -10.126 7.183 205 HB3 HIS 25 HB1 HIS 25 1.548 -10.971 7.404 206 HD1 HIS 25 HD1 HIS 25 1.727 -11.817 9.700 207 HD2 HIS 25 HD2 HIS 25 5.203 -12.562 7.544 208 HE1 HIS 25 HE1 HIS 25 3.276 -12.999 11.283 209 HE2 HIS 25 HE2 HIS 25 5.382 -13.393 9.985 210 H LEU 26 HN LEU 26 1.327 -10.455 3.881 211 HA LEU 26 HA LEU 26 3.455 -8.506 3.332 212 HB2 LEU 26 HB2 LEU 26 3.084 -10.248 1.572 213 HB3 LEU 26 HB1 LEU 26 1.488 -9.574 1.308 214 HG LEU 26 HG LEU 26 2.394 -7.530 0.484 215 HD11 LEU 26 HD11 LEU 26 4.159 -7.238 2.104 216 HD12 LEU 26 HD12 LEU 26 4.813 -7.105 0.476 217 HD13 LEU 26 HD13 LEU 26 5.056 -8.584 1.408 218 HD21 LEU 26 HD21 LEU 26 3.607 -10.036 -0.580 219 HD22 LEU 26 HD22 LEU 26 4.227 -8.495 -1.185 220 HD23 LEU 26 HD23 LEU 26 2.507 -8.895 -1.362 221 H LYS 27 HN LYS 27 2.944 -6.434 3.177 222 HA LYS 27 HA LYS 27 0.152 -5.580 3.507 223 HB2 LYS 27 HB2 LYS 27 0.848 -5.636 5.749 224 HB3 LYS 27 HB1 LYS 27 2.461 -5.090 5.346 225 HG2 LYS 27 HG2 LYS 27 1.390 -3.319 6.476 226 HG3 LYS 27 HG1 LYS 27 1.495 -2.874 4.770 227 HD2 LYS 27 HD2 LYS 27 -0.835 -3.516 4.450 228 HD3 LYS 27 HD1 LYS 27 -0.942 -4.024 6.137 229 HE2 LYS 27 HE2 LYS 27 -0.458 -1.717 6.840 230 HE3 LYS 27 HE1 LYS 27 -0.406 -1.225 5.147 231 HZ1 LYS 27 HZ1 LYS 27 -2.545 -0.729 6.136 232 HZ2 LYS 27 HZ2 LYS 27 -2.766 -2.353 6.554 233 HZ3 LYS 27 HZ3 LYS 27 -2.721 -1.898 4.926 234 H ILE 28 HN ILE 28 -0.293 -3.546 2.687 235 HA ILE 28 HA ILE 28 1.880 -2.317 1.128 236 HB ILE 28 HB ILE 28 -1.093 -2.028 0.685 237 HG12 ILE 28 HG12 ILE 28 -0.440 -4.331 0.286 238 HG13 ILE 28 HG11 ILE 28 -0.725 -3.539 -1.251 239 HG21 ILE 28 HG21 ILE 28 -0.414 -1.116 -1.502 240 HG22 ILE 28 HG22 ILE 28 1.277 -1.236 -1.011 241 HG23 ILE 28 HG23 ILE 28 0.185 -0.144 -0.158 242 HD11 ILE 28 HD11 ILE 28 1.643 -3.289 -1.604 243 HD12 ILE 28 HD12 ILE 28 1.221 -4.981 -1.316 244 HD13 ILE 28 HD13 ILE 28 1.965 -4.023 -0.035 245 H LEU 29 HN LEU 29 2.538 -0.344 1.652 246 HA LEU 29 HA LEU 29 1.263 1.077 3.810 247 HB2 LEU 29 HB2 LEU 29 3.820 0.911 3.175 248 HB3 LEU 29 HB1 LEU 29 3.447 2.271 2.123 249 HG LEU 29 HG LEU 29 4.374 3.047 4.235 250 HD11 LEU 29 HD11 LEU 29 2.600 4.593 4.937 251 HD12 LEU 29 HD12 LEU 29 1.424 3.661 4.003 252 HD13 LEU 29 HD13 LEU 29 2.747 4.496 3.183 253 HD21 LEU 29 HD21 LEU 29 2.023 1.699 5.554 254 HD22 LEU 29 HD22 LEU 29 3.238 2.696 6.352 255 HD23 LEU 29 HD23 LEU 29 3.697 1.154 5.630 256 H ASN 30 HN ASN 30 -0.449 2.322 3.481 257 HA ASN 30 HA ASN 30 -1.030 3.580 0.984 258 HB2 ASN 30 HB2 ASN 30 -2.108 3.897 3.772 259 HB3 ASN 30 HB1 ASN 30 -2.635 4.924 2.451 260 HD21 ASN 30 HD21 ASN 30 -3.758 3.983 0.709 261 HD22 ASN 30 HD22 ASN 30 -4.551 2.457 0.872 262 H THR 31 HN THR 31 0.625 4.831 0.315 263 HA THR 31 HA THR 31 2.161 6.367 2.150 264 HB THR 31 HB THR 31 3.176 7.022 -0.197 265 HG1 THR 31 HG1 THR 31 2.787 4.811 -1.379 266 HG21 THR 31 HG21 THR 31 4.632 5.089 -0.012 267 HG22 THR 31 HG22 THR 31 3.451 4.280 1.016 268 HG23 THR 31 HG23 THR 31 4.267 5.735 1.588 269 HA PRO 32 HA PRO 32 1.248 10.746 1.572 270 HB2 PRO 32 HB2 PRO 32 3.774 10.621 0.018 271 HB3 PRO 32 HB1 PRO 32 3.250 11.797 1.226 272 HG2 PRO 32 HG2 PRO 32 4.975 9.840 1.844 273 HG3 PRO 32 HG1 PRO 32 3.755 10.398 2.997 274 HD2 PRO 32 HD2 PRO 32 3.897 7.878 1.498 275 HD3 PRO 32 HD1 PRO 32 3.037 8.251 2.998 276 H ASN 33 HN ASN 33 0.972 8.587 -0.889 277 HA ASN 33 HA ASN 33 0.401 8.640 -3.091 278 HB2 ASN 33 HB2 ASN 33 1.045 11.602 -3.070 279 HB3 ASN 33 HB1 ASN 33 0.426 10.704 -4.445 280 HD21 ASN 33 HD21 ASN 33 -0.653 10.093 -1.195 281 HD22 ASN 33 HD22 ASN 33 -2.214 10.785 -1.359 282 H CYS 34 HN CYS 34 2.685 7.927 -1.894 283 HA CYS 34 HA CYS 34 4.760 8.301 -3.896 284 HB2 CYS 34 HB2 CYS 34 4.614 6.744 -1.299 285 HB3 CYS 34 HB1 CYS 34 6.002 6.735 -2.362 286 H ALA 35 HN ALA 35 5.739 5.987 -4.506 287 HA ALA 35 HA ALA 35 3.783 4.414 -5.753 288 HB1 ALA 35 HB1 ALA 35 5.500 2.690 -5.965 289 HB2 ALA 35 HB2 ALA 35 6.514 3.542 -4.798 290 HB3 ALA 35 HB3 ALA 35 6.159 4.280 -6.360 291 H LEU 36 HN LEU 36 2.856 2.424 -5.133 292 HA LEU 36 HA LEU 36 2.079 2.226 -2.443 293 HB2 LEU 36 HB2 LEU 36 1.857 0.451 -4.849 294 HB3 LEU 36 HB1 LEU 36 1.365 -0.134 -3.279 295 HG LEU 36 HG LEU 36 -0.239 1.769 -3.118 296 HD11 LEU 36 HD11 LEU 36 0.537 2.250 -5.993 297 HD12 LEU 36 HD12 LEU 36 0.895 3.317 -4.635 298 HD13 LEU 36 HD13 LEU 36 -0.779 3.042 -5.124 299 HD21 LEU 36 HD21 LEU 36 -0.557 0.004 -5.537 300 HD22 LEU 36 HD22 LEU 36 -1.853 0.854 -4.693 301 HD23 LEU 36 HD23 LEU 36 -0.962 -0.431 -3.877 302 H GLN 37 HN GLN 37 3.523 1.811 -0.903 303 HA GLN 37 HA GLN 37 5.863 0.236 -1.506 304 HB2 GLN 37 HB2 GLN 37 5.079 1.578 1.079 305 HB3 GLN 37 HB1 GLN 37 6.666 0.927 0.674 306 HG2 GLN 37 HG2 GLN 37 6.753 2.517 -1.226 307 HG3 GLN 37 HG1 GLN 37 5.268 3.239 -0.623 308 HE21 GLN 37 HE21 GLN 37 7.800 4.422 -1.006 309 HE22 GLN 37 HE22 GLN 37 8.331 5.009 0.521 310 H ILE 38 HN ILE 38 5.938 -1.833 -1.253 311 HA ILE 38 HA ILE 38 3.834 -3.158 0.244 312 HB ILE 38 HB ILE 38 5.876 -4.468 -1.552 313 HG12 ILE 38 HG12 ILE 38 3.668 -4.385 -3.105 314 HG13 ILE 38 HG11 ILE 38 3.479 -2.858 -2.259 315 HG21 ILE 38 HG21 ILE 38 4.005 -5.512 0.127 316 HG22 ILE 38 HG22 ILE 38 4.686 -6.339 -1.276 317 HG23 ILE 38 HG23 ILE 38 3.139 -5.481 -1.410 318 HD11 ILE 38 HD11 ILE 38 4.595 -2.586 -4.399 319 HD12 ILE 38 HD12 ILE 38 5.880 -3.675 -3.875 320 HD13 ILE 38 HD13 ILE 38 5.649 -2.126 -3.066 321 H VAL 39 HN VAL 39 4.378 -3.406 2.377 322 HA VAL 39 HA VAL 39 7.159 -3.988 3.040 323 HB VAL 39 HB VAL 39 5.845 -2.284 4.372 324 HG11 VAL 39 HG11 VAL 39 4.523 -4.706 5.547 325 HG12 VAL 39 HG12 VAL 39 3.742 -3.476 4.553 326 HG13 VAL 39 HG13 VAL 39 4.387 -3.050 6.139 327 HG21 VAL 39 HG21 VAL 39 7.940 -3.223 5.174 328 HG22 VAL 39 HG22 VAL 39 7.085 -4.601 5.867 329 HG23 VAL 39 HG23 VAL 39 6.826 -2.982 6.519 330 H ALA 40 HN ALA 40 7.879 -5.913 3.467 331 HA ALA 40 HA ALA 40 5.945 -8.114 3.745 332 HB1 ALA 40 HB1 ALA 40 7.254 -9.425 2.220 333 HB2 ALA 40 HB2 ALA 40 8.483 -8.164 2.123 334 HB3 ALA 40 HB3 ALA 40 6.878 -7.883 1.454 335 H ARG 41 HN ARG 41 6.687 -9.950 4.844 336 HA ARG 41 HA ARG 41 9.249 -9.640 6.262 337 HB2 ARG 41 HB2 ARG 41 6.639 -10.873 7.070 338 HB3 ARG 41 HB1 ARG 41 8.143 -11.431 7.801 339 HG2 ARG 41 HG2 ARG 41 7.664 -8.511 7.711 340 HG3 ARG 41 HG1 ARG 41 6.721 -9.458 8.841 341 HD2 ARG 41 HD2 ARG 41 8.773 -10.380 9.792 342 HD3 ARG 41 HD1 ARG 41 9.717 -9.420 8.656 343 HE ARG 41 HE ARG 41 7.996 -7.739 10.129 344 HH11 ARG 41 HH11 ARG 41 10.904 -9.651 10.520 345 HH12 ARG 41 HH12 ARG 41 11.522 -8.666 11.811 346 HH21 ARG 41 HH21 ARG 41 8.802 -6.453 11.828 347 HH22 ARG 41 HH22 ARG 41 10.337 -6.842 12.546 348 H LEU 42 HN LEU 42 10.793 -10.980 5.628 349 HA LEU 42 HA LEU 42 10.371 -12.764 3.491 350 HB2 LEU 42 HB2 LEU 42 12.669 -12.107 5.264 351 HB3 LEU 42 HB1 LEU 42 12.776 -13.536 4.254 352 HG LEU 42 HG LEU 42 12.233 -10.757 3.215 353 HD11 LEU 42 HD11 LEU 42 14.464 -10.901 4.171 354 HD12 LEU 42 HD12 LEU 42 14.539 -10.815 2.412 355 HD13 LEU 42 HD13 LEU 42 14.786 -12.357 3.231 356 HD21 LEU 42 HD21 LEU 42 11.333 -12.478 1.774 357 HD22 LEU 42 HD22 LEU 42 12.852 -13.367 1.832 358 HD23 LEU 42 HD23 LEU 42 12.782 -11.795 1.039 359 H LYS 43 HN LYS 43 10.276 -14.871 3.286 360 HA LYS 43 HA LYS 43 9.213 -16.448 5.367 361 HB2 LYS 43 HB2 LYS 43 8.723 -16.750 2.976 362 HB3 LYS 43 HB1 LYS 43 10.380 -17.255 2.725 363 HG2 LYS 43 HG2 LYS 43 9.981 -19.173 4.235 364 HG3 LYS 43 HG1 LYS 43 8.288 -18.685 4.331 365 HD2 LYS 43 HD2 LYS 43 8.466 -20.404 2.672 366 HD3 LYS 43 HD1 LYS 43 8.174 -18.877 1.848 367 HE2 LYS 43 HE2 LYS 43 10.546 -18.672 1.353 368 HE3 LYS 43 HE1 LYS 43 10.842 -20.194 2.181 369 HZ1 LYS 43 HZ1 LYS 43 9.160 -19.840 -0.239 370 HZ2 LYS 43 HZ2 LYS 43 9.444 -21.309 0.554 371 HZ3 LYS 43 HZ3 LYS 43 10.717 -20.502 -0.209 372 H ASN 44 HN ASN 44 12.421 -16.085 4.021 373 HA ASN 44 HA ASN 44 13.476 -18.365 5.431 374 HB2 ASN 44 HB2 ASN 44 14.793 -16.222 3.790 375 HB3 ASN 44 HB1 ASN 44 15.658 -17.570 4.505 376 HD21 ASN 44 HD21 ASN 44 16.325 -18.157 2.450 377 HD22 ASN 44 HD22 ASN 44 15.279 -18.989 1.348 378 H ASN 45 HN ASN 45 14.095 -14.870 5.487 379 HA ASN 45 HA ASN 45 15.733 -15.164 7.855 380 HB2 ASN 45 HB2 ASN 45 15.079 -12.702 6.302 381 HB3 ASN 45 HB1 ASN 45 16.285 -12.816 7.564 382 HD21 ASN 45 HD21 ASN 45 16.625 -11.997 4.839 383 HD22 ASN 45 HD22 ASN 45 17.749 -13.095 4.132 384 H ASN 46 HN ASN 46 12.509 -14.320 7.181 385 HA ASN 46 HA ASN 46 10.794 -13.427 8.363 386 HB2 ASN 46 HB2 ASN 46 11.675 -14.933 10.200 387 HB3 ASN 46 HB1 ASN 46 12.547 -13.535 10.815 388 HD21 ASN 46 HD21 ASN 46 11.449 -13.394 12.733 389 HD22 ASN 46 HD22 ASN 46 9.782 -12.944 12.838 390 H ARG 47 HN ARG 47 13.428 -11.858 7.550 391 HA ARG 47 HA ARG 47 13.235 -9.504 9.150 392 HB2 ARG 47 HB2 ARG 47 14.670 -10.128 6.583 393 HB3 ARG 47 HB1 ARG 47 14.669 -8.520 7.283 394 HG2 ARG 47 HG2 ARG 47 15.682 -9.445 9.330 395 HG3 ARG 47 HG1 ARG 47 15.762 -11.021 8.547 396 HD2 ARG 47 HD2 ARG 47 17.889 -9.892 8.380 397 HD3 ARG 47 HD1 ARG 47 17.162 -10.078 6.788 398 HE ARG 47 HE ARG 47 16.493 -7.565 7.932 399 HH11 ARG 47 HH11 ARG 47 19.123 -9.260 6.347 400 HH12 ARG 47 HH12 ARG 47 19.811 -7.817 5.676 401 HH21 ARG 47 HH21 ARG 47 17.389 -5.683 7.045 402 HH22 ARG 47 HH22 ARG 47 18.819 -5.773 6.069 403 H GLN 48 HN GLN 48 12.283 -7.653 8.741 404 HA GLN 48 HA GLN 48 10.091 -7.574 6.891 405 HB2 GLN 48 HB2 GLN 48 9.921 -6.445 9.050 406 HB3 GLN 48 HB1 GLN 48 11.291 -5.416 8.654 407 HG2 GLN 48 HG2 GLN 48 9.876 -4.658 6.667 408 HG3 GLN 48 HG1 GLN 48 8.529 -5.411 7.521 409 HE21 GLN 48 HE21 GLN 48 9.665 -4.713 10.145 410 HE22 GLN 48 HE22 GLN 48 9.358 -3.024 10.346 411 H VAL 49 HN VAL 49 10.099 -6.611 4.906 412 HA VAL 49 HA VAL 49 12.274 -4.853 4.087 413 HB VAL 49 HB VAL 49 13.109 -7.136 3.584 414 HG11 VAL 49 HG11 VAL 49 10.759 -7.363 1.716 415 HG12 VAL 49 HG12 VAL 49 10.883 -8.174 3.278 416 HG13 VAL 49 HG13 VAL 49 12.024 -8.559 1.992 417 HG21 VAL 49 HG21 VAL 49 13.905 -5.407 2.143 418 HG22 VAL 49 HG22 VAL 49 12.411 -5.422 1.204 419 HG23 VAL 49 HG23 VAL 49 13.515 -6.796 1.118 420 H CYS 50 HN CYS 50 11.694 -3.658 2.145 421 HA CYS 50 HA CYS 50 8.828 -3.787 1.575 422 HB2 CYS 50 HB2 CYS 50 10.808 -1.523 1.333 423 HB3 CYS 50 HB1 CYS 50 9.176 -1.445 0.705 424 H ILE 51 HN ILE 51 8.198 -4.446 -0.322 425 HA ILE 51 HA ILE 51 10.132 -5.424 -2.230 426 HB ILE 51 HB ILE 51 7.210 -5.441 -2.816 427 HG12 ILE 51 HG12 ILE 51 8.487 -7.160 -0.676 428 HG13 ILE 51 HG11 ILE 51 7.193 -5.984 -0.447 429 HG21 ILE 51 HG21 ILE 51 7.638 -7.512 -3.839 430 HG22 ILE 51 HG22 ILE 51 9.180 -7.694 -3.004 431 HG23 ILE 51 HG23 ILE 51 9.002 -6.481 -4.270 432 HD11 ILE 51 HD11 ILE 51 6.137 -8.075 -0.438 433 HD12 ILE 51 HD12 ILE 51 7.074 -8.652 -1.808 434 HD13 ILE 51 HD13 ILE 51 5.832 -7.432 -2.051 435 H ASP 52 HN ASP 52 10.422 -4.784 -4.343 436 HA ASP 52 HA ASP 52 9.853 -2.063 -4.977 437 HB2 ASP 52 HB2 ASP 52 11.814 -3.441 -5.816 438 HB3 ASP 52 HB1 ASP 52 10.691 -4.200 -6.935 439 HA PRO 53 HA PRO 53 5.699 -2.643 -6.416 440 HB2 PRO 53 HB2 PRO 53 5.359 -0.183 -7.495 441 HB3 PRO 53 HB1 PRO 53 5.314 -0.496 -5.759 442 HG2 PRO 53 HG2 PRO 53 7.553 0.568 -7.422 443 HG3 PRO 53 HG1 PRO 53 6.991 1.090 -5.832 444 HD2 PRO 53 HD2 PRO 53 9.148 -0.472 -6.153 445 HD3 PRO 53 HD1 PRO 53 8.079 -0.596 -4.752 446 H LYS 54 HN LYS 54 8.393 -2.008 -8.430 447 HA LYS 54 HA LYS 54 6.828 -2.182 -10.880 448 HB2 LYS 54 HB2 LYS 54 9.759 -1.713 -10.367 449 HB3 LYS 54 HB1 LYS 54 9.104 -1.946 -11.981 450 HG2 LYS 54 HG2 LYS 54 7.773 0.096 -10.334 451 HG3 LYS 54 HG1 LYS 54 9.428 0.458 -10.826 452 HD2 LYS 54 HD2 LYS 54 7.907 1.358 -12.469 453 HD3 LYS 54 HD1 LYS 54 8.775 -0.004 -13.174 454 HE2 LYS 54 HE2 LYS 54 6.451 -0.102 -13.799 455 HE3 LYS 54 HE1 LYS 54 6.859 -1.443 -12.738 456 HZ1 LYS 54 HZ1 LYS 54 4.723 -0.401 -12.182 457 HZ2 LYS 54 HZ2 LYS 54 5.518 1.053 -11.864 458 HZ3 LYS 54 HZ3 LYS 54 5.826 -0.298 -10.904 459 H LEU 55 HN LEU 55 8.212 -4.293 -8.714 460 HA LEU 55 HA LEU 55 9.214 -6.354 -10.279 461 HB2 LEU 55 HB2 LEU 55 7.955 -6.052 -7.622 462 HB3 LEU 55 HB1 LEU 55 8.034 -7.686 -8.264 463 HG LEU 55 HG LEU 55 10.437 -5.884 -8.038 464 HD11 LEU 55 HD11 LEU 55 10.971 -7.361 -6.047 465 HD12 LEU 55 HD12 LEU 55 9.258 -7.790 -6.050 466 HD13 LEU 55 HD13 LEU 55 9.752 -6.109 -5.830 467 HD21 LEU 55 HD21 LEU 55 10.124 -8.852 -8.411 468 HD22 LEU 55 HD22 LEU 55 11.657 -8.000 -8.204 469 HD23 LEU 55 HD23 LEU 55 10.656 -7.686 -9.621 470 H LYS 56 HN LYS 56 8.314 -7.879 -11.512 471 HA LYS 56 HA LYS 56 5.841 -7.313 -12.694 472 HB2 LYS 56 HB2 LYS 56 7.739 -9.622 -12.895 473 HB3 LYS 56 HB1 LYS 56 6.202 -9.647 -13.743 474 HG2 LYS 56 HG2 LYS 56 8.274 -7.484 -14.050 475 HG3 LYS 56 HG1 LYS 56 8.108 -8.871 -15.127 476 HD2 LYS 56 HD2 LYS 56 5.915 -6.870 -14.584 477 HD3 LYS 56 HD1 LYS 56 7.006 -6.794 -15.965 478 HE2 LYS 56 HE2 LYS 56 6.192 -8.890 -16.802 479 HE3 LYS 56 HE1 LYS 56 5.242 -9.157 -15.343 480 HZ1 LYS 56 HZ1 LYS 56 4.793 -6.922 -17.241 481 HZ2 LYS 56 HZ2 LYS 56 3.825 -7.337 -15.919 482 HZ3 LYS 56 HZ3 LYS 56 3.924 -8.372 -17.250 483 H TRP 57 HN TRP 57 6.708 -9.578 -10.142 484 HA TRP 57 HA TRP 57 4.067 -10.742 -10.172 485 HB2 TRP 57 HB2 TRP 57 4.769 -12.129 -8.412 486 HB3 TRP 57 HB1 TRP 57 6.189 -11.943 -9.424 487 HD1 TRP 57 HD1 TRP 57 8.303 -10.784 -8.338 488 HE1 TRP 57 HE1 TRP 57 8.910 -10.168 -5.910 489 HE3 TRP 57 HE3 TRP 57 3.682 -11.206 -6.223 490 HZ2 TRP 57 HZ2 TRP 57 7.596 -9.901 -3.438 491 HZ3 TRP 57 HZ3 TRP 57 3.432 -10.742 -3.827 492 HH2 TRP 57 HH2 TRP 57 5.352 -10.109 -2.457 493 H ILE 58 HN ILE 58 5.666 -8.088 -8.695 494 HA ILE 58 HA ILE 58 3.755 -7.646 -6.607 495 HB ILE 58 HB ILE 58 5.942 -5.996 -7.833 496 HG12 ILE 58 HG12 ILE 58 6.510 -7.801 -6.242 497 HG13 ILE 58 HG11 ILE 58 6.945 -6.207 -5.635 498 HG21 ILE 58 HG21 ILE 58 3.862 -5.119 -5.870 499 HG22 ILE 58 HG22 ILE 58 4.343 -4.352 -7.387 500 HG23 ILE 58 HG23 ILE 58 5.439 -4.345 -5.998 501 HD11 ILE 58 HD11 ILE 58 4.379 -7.552 -4.891 502 HD12 ILE 58 HD12 ILE 58 5.183 -6.199 -4.097 503 HD13 ILE 58 HD13 ILE 58 5.875 -7.818 -4.011 504 H GLN 59 HN GLN 59 4.234 -6.373 -9.876 505 HA GLN 59 HA GLN 59 2.159 -4.534 -10.015 506 HB2 GLN 59 HB2 GLN 59 3.268 -6.469 -12.002 507 HB3 GLN 59 HB1 GLN 59 2.032 -5.308 -12.452 508 HG2 GLN 59 HG2 GLN 59 4.677 -4.537 -11.254 509 HG3 GLN 59 HG1 GLN 59 4.400 -4.666 -12.992 510 HE21 GLN 59 HE21 GLN 59 3.795 -2.838 -10.119 511 HE22 GLN 59 HE22 GLN 59 3.057 -1.475 -10.894 512 H GLU 60 HN GLU 60 2.118 -7.976 -10.038 513 HA GLU 60 HA GLU 60 -0.618 -8.339 -10.754 514 HB2 GLU 60 HB2 GLU 60 1.182 -10.181 -9.165 515 HB3 GLU 60 HB1 GLU 60 -0.295 -10.633 -9.994 516 HG2 GLU 60 HG2 GLU 60 2.156 -9.585 -11.376 517 HG3 GLU 60 HG1 GLU 60 1.808 -11.297 -11.143 518 H TYR 61 HN TYR 61 1.164 -8.045 -7.734 519 HA TYR 61 HA TYR 61 -1.101 -8.628 -6.068 520 HB2 TYR 61 HB2 TYR 61 1.229 -9.063 -5.333 521 HB3 TYR 61 HB1 TYR 61 1.565 -7.343 -5.395 522 HD1 TYR 61 HD1 TYR 61 0.445 -10.018 -3.371 523 HD2 TYR 61 HD2 TYR 61 0.183 -5.821 -3.895 524 HE1 TYR 61 HE1 TYR 61 -0.284 -9.783 -1.051 525 HE2 TYR 61 HE2 TYR 61 -0.576 -5.575 -1.560 526 HH TYR 61 HH TYR 61 -0.287 -8.021 0.725 527 H LEU 62 HN LEU 62 0.513 -5.891 -7.403 528 HA LEU 62 HA LEU 62 -0.603 -3.779 -6.025 529 HB2 LEU 62 HB2 LEU 62 0.902 -4.222 -8.371 530 HB3 LEU 62 HB1 LEU 62 -0.390 -3.092 -8.766 531 HG LEU 62 HG LEU 62 0.371 -1.742 -6.739 532 HD11 LEU 62 HD11 LEU 62 2.598 -3.724 -6.977 533 HD12 LEU 62 HD12 LEU 62 1.699 -3.231 -5.538 534 HD13 LEU 62 HD13 LEU 62 2.854 -2.118 -6.282 535 HD21 LEU 62 HD21 LEU 62 0.793 -1.017 -9.016 536 HD22 LEU 62 HD22 LEU 62 2.232 -2.033 -9.091 537 HD23 LEU 62 HD23 LEU 62 2.179 -0.658 -7.987 538 H GLU 63 HN GLU 63 -1.835 -5.589 -8.781 539 HA GLU 63 HA GLU 63 -4.028 -4.090 -9.450 540 HB2 GLU 63 HB2 GLU 63 -3.802 -7.072 -9.241 541 HB3 GLU 63 HB1 GLU 63 -5.098 -6.233 -10.059 542 HG2 GLU 63 HG2 GLU 63 -3.389 -5.148 -11.481 543 HG3 GLU 63 HG1 GLU 63 -2.201 -6.219 -10.760 544 H LYS 64 HN LYS 64 -3.727 -6.450 -6.893 545 HA LYS 64 HA LYS 64 -6.358 -6.155 -5.844 546 HB2 LYS 64 HB2 LYS 64 -3.839 -7.296 -4.650 547 HB3 LYS 64 HB1 LYS 64 -5.419 -7.392 -3.886 548 HG2 LYS 64 HG2 LYS 64 -5.255 -9.454 -4.900 549 HG3 LYS 64 HG1 LYS 64 -6.140 -8.515 -6.102 550 HD2 LYS 64 HD2 LYS 64 -4.055 -8.113 -7.320 551 HD3 LYS 64 HD1 LYS 64 -3.183 -9.083 -6.133 552 HE2 LYS 64 HE2 LYS 64 -5.445 -10.090 -7.851 553 HE3 LYS 64 HE1 LYS 64 -3.735 -10.319 -8.211 554 HZ1 LYS 64 HZ1 LYS 64 -4.704 -12.253 -7.127 555 HZ2 LYS 64 HZ2 LYS 64 -5.127 -11.317 -5.780 556 HZ3 LYS 64 HZ3 LYS 64 -3.495 -11.562 -6.167 557 H ALA 65 HN ALA 65 -3.194 -4.838 -5.120 558 HA ALA 65 HA ALA 65 -3.859 -3.503 -2.732 559 HB1 ALA 65 HB1 ALA 65 -1.724 -2.766 -4.719 560 HB2 ALA 65 HB2 ALA 65 -1.565 -4.035 -3.505 561 HB3 ALA 65 HB3 ALA 65 -1.766 -2.354 -3.004 562 H LEU 66 HN LEU 66 -4.322 -2.747 -6.055 563 HA LEU 66 HA LEU 66 -4.860 0.063 -5.667 564 HB2 LEU 66 HB2 LEU 66 -4.988 -1.843 -7.924 565 HB3 LEU 66 HB1 LEU 66 -6.084 -0.476 -8.013 566 HG LEU 66 HG LEU 66 -4.212 1.061 -7.839 567 HD11 LEU 66 HD11 LEU 66 -1.917 0.253 -7.921 568 HD12 LEU 66 HD12 LEU 66 -2.503 -1.413 -7.853 569 HD13 LEU 66 HD13 LEU 66 -2.748 -0.338 -6.478 570 HD21 LEU 66 HD21 LEU 66 -4.931 0.348 -10.048 571 HD22 LEU 66 HD22 LEU 66 -3.837 -1.033 -9.971 572 HD23 LEU 66 HD23 LEU 66 -3.186 0.605 -10.014 573 H ASN 67 HN ASN 67 -6.571 -2.822 -5.352 574 HA ASN 67 HA ASN 67 -9.168 -1.599 -5.384 575 HB2 ASN 67 HB2 ASN 67 -8.192 -4.395 -5.276 576 HB3 ASN 67 HB1 ASN 67 -9.816 -4.041 -4.762 577 HD21 ASN 67 HD21 ASN 67 -7.650 -4.287 -7.435 578 HD22 ASN 67 HD22 ASN 67 -8.844 -4.112 -8.673 579 H LYS 68 HN LYS 68 -10.293 -1.225 -3.684 580 HA LYS 68 HA LYS 68 -9.042 -1.274 -1.078 581 HB2 LYS 68 HB2 LYS 68 -11.772 -0.289 -1.925 582 HB3 LYS 68 HB1 LYS 68 -11.052 -0.049 -0.340 583 HG2 LYS 68 HG2 LYS 68 -9.967 1.032 -2.933 584 HG3 LYS 68 HG1 LYS 68 -10.876 1.950 -1.731 585 HD2 LYS 68 HD2 LYS 68 -8.218 0.601 -1.263 586 HD3 LYS 68 HD1 LYS 68 -8.452 2.324 -1.544 587 HE2 LYS 68 HE2 LYS 68 -9.872 2.408 0.485 588 HE3 LYS 68 HE1 LYS 68 -9.499 0.708 0.769 589 HZ1 LYS 68 HZ1 LYS 68 -8.077 2.132 2.080 590 HZ2 LYS 68 HZ2 LYS 68 -7.532 2.926 0.691 591 HZ3 LYS 68 HZ3 LYS 68 -7.158 1.296 0.934 592 H GLY 69 HN GLY 69 -12.068 -2.455 -2.484 593 HA2 GLY 69 HA2 GLY 69 -12.600 -4.095 -0.163 594 HA3 GLY 69 HA1 GLY 69 -13.616 -3.913 -1.585 595 H ARG 70 HN ARG 70 -10.958 -5.630 -0.154 596 HA ARG 70 HA ARG 70 -10.899 -7.472 -2.446 597 HB2 ARG 70 HB2 ARG 70 -8.946 -7.105 -0.171 598 HB3 ARG 70 HB1 ARG 70 -8.794 -8.321 -1.431 599 HG2 ARG 70 HG2 ARG 70 -8.614 -6.572 -3.112 600 HG3 ARG 70 HG1 ARG 70 -8.792 -5.344 -1.858 601 HD2 ARG 70 HD2 ARG 70 -6.583 -7.387 -1.997 602 HD3 ARG 70 HD1 ARG 70 -6.444 -5.706 -2.506 603 HE ARG 70 HE ARG 70 -6.881 -6.601 0.273 604 HH11 ARG 70 HH11 ARG 70 -5.757 -4.223 -2.037 605 HH12 ARG 70 HH12 ARG 70 -4.996 -3.234 -0.830 606 HH21 ARG 70 HH21 ARG 70 -5.894 -5.292 1.856 607 HH22 ARG 70 HH22 ARG 70 -5.084 -3.834 1.377 608 H ARG 71 HN ARG 71 -12.435 -7.138 0.410 609 HA ARG 71 HA ARG 71 -13.516 -8.521 1.854 610 HB2 ARG 71 HB2 ARG 71 -13.061 -10.562 -0.336 611 HB3 ARG 71 HB1 ARG 71 -14.172 -10.756 1.015 612 HG2 ARG 71 HG2 ARG 71 -15.546 -8.962 0.228 613 HG3 ARG 71 HG1 ARG 71 -14.373 -8.551 -1.024 614 HD2 ARG 71 HD2 ARG 71 -14.745 -10.729 -2.077 615 HD3 ARG 71 HD1 ARG 71 -15.921 -11.130 -0.829 616 HE ARG 71 HE ARG 71 -17.258 -9.230 -1.686 617 HH11 ARG 71 HH11 ARG 71 -14.826 -10.637 -3.780 618 HH12 ARG 71 HH12 ARG 71 -15.667 -10.225 -5.240 619 HH21 ARG 71 HH21 ARG 71 -18.355 -8.683 -3.615 620 HH22 ARG 71 HH22 ARG 71 -17.668 -9.120 -5.148 621 H GLU 72 HN GLU 72 -13.114 -11.266 2.481 622 HA GLU 72 HA GLU 72 -10.468 -11.047 3.683 623 HB2 GLU 72 HB2 GLU 72 -12.340 -11.580 5.167 624 HB3 GLU 72 HB1 GLU 72 -12.683 -13.025 4.226 625 HG2 GLU 72 HG2 GLU 72 -11.486 -13.534 6.294 626 HG3 GLU 72 HG1 GLU 72 -10.564 -13.989 4.863 627 H GLU 73 HN GLU 73 -12.355 -13.395 1.784 628 HA GLU 73 HA GLU 73 -9.823 -14.787 1.230 629 HB2 GLU 73 HB2 GLU 73 -11.612 -16.790 1.017 630 HB3 GLU 73 HB1 GLU 73 -10.744 -16.407 2.494 631 HG2 GLU 73 HG2 GLU 73 -13.071 -16.752 2.985 632 HG3 GLU 73 HG1 GLU 73 -12.654 -15.065 3.255 633 H LYS 74 HN LYS 74 -10.821 -12.808 -0.507 634 HA LYS 74 HA LYS 74 -11.189 -14.472 -2.868 635 HB2 LYS 74 HB2 LYS 74 -13.046 -12.235 -2.086 636 HB3 LYS 74 HB1 LYS 74 -12.892 -12.788 -3.747 637 HG2 LYS 74 HG2 LYS 74 -13.503 -15.079 -2.947 638 HG3 LYS 74 HG1 LYS 74 -13.855 -14.363 -1.374 639 HD2 LYS 74 HD2 LYS 74 -15.570 -12.974 -2.332 640 HD3 LYS 74 HD1 LYS 74 -15.142 -13.500 -3.961 641 HE2 LYS 74 HE2 LYS 74 -16.267 -15.229 -1.761 642 HE3 LYS 74 HE1 LYS 74 -17.136 -14.653 -3.181 643 HZ1 LYS 74 HZ1 LYS 74 -16.443 -16.893 -3.551 644 HZ2 LYS 74 HZ2 LYS 74 -14.843 -16.536 -3.141 645 HZ3 LYS 74 HZ3 LYS 74 -15.516 -15.895 -4.553 646 H VAL 75 HN VAL 75 -9.427 -14.036 -3.933 647 HA VAL 75 HA VAL 75 -8.069 -13.037 -5.400 648 HB VAL 75 HB VAL 75 -10.287 -11.726 -5.940 649 HG11 VAL 75 HG11 VAL 75 -10.029 -9.982 -4.252 650 HG12 VAL 75 HG12 VAL 75 -9.998 -9.304 -5.879 651 HG13 VAL 75 HG13 VAL 75 -8.496 -9.498 -4.976 652 HG21 VAL 75 HG21 VAL 75 -9.080 -10.576 -7.743 653 HG22 VAL 75 HG22 VAL 75 -8.550 -12.245 -7.535 654 HG23 VAL 75 HG23 VAL 75 -7.557 -10.921 -6.924 655 H GLY 76 HN GLY 76 -8.656 -11.297 -2.421 656 HA2 GLY 76 HA2 GLY 76 -6.343 -9.610 -2.701 657 HA3 GLY 76 HA1 GLY 76 -7.336 -9.787 -1.263 658 H LYS 77 HN LYS 77 -7.107 -12.155 -0.332 659 HA LYS 77 HA LYS 77 -4.419 -12.252 0.593 660 HB2 LYS 77 HB2 LYS 77 -6.810 -14.012 1.087 661 HB3 LYS 77 HB1 LYS 77 -5.238 -14.340 1.801 662 HG2 LYS 77 HG2 LYS 77 -6.847 -11.826 2.190 663 HG3 LYS 77 HG1 LYS 77 -6.714 -13.156 3.342 664 HD2 LYS 77 HD2 LYS 77 -4.247 -12.767 3.387 665 HD3 LYS 77 HD1 LYS 77 -4.507 -11.337 2.390 666 HE2 LYS 77 HE2 LYS 77 -4.317 -10.774 4.768 667 HE3 LYS 77 HE1 LYS 77 -5.896 -10.352 4.114 668 HZ1 LYS 77 HZ1 LYS 77 -6.858 -12.262 5.141 669 HZ2 LYS 77 HZ2 LYS 77 -5.967 -11.437 6.321 670 HZ3 LYS 77 HZ3 LYS 77 -5.342 -12.846 5.623 671 H LYS 78 HN LYS 78 -3.014 -14.061 0.558 672 HA LYS 78 HA LYS 78 -3.387 -16.018 -1.559 673 HB2 LYS 78 HB2 LYS 78 -2.243 -14.051 -2.588 674 HB3 LYS 78 HB1 LYS 78 -0.955 -14.218 -1.410 675 HG2 LYS 78 HG2 LYS 78 -0.291 -15.154 -3.532 676 HG3 LYS 78 HG1 LYS 78 -0.407 -16.416 -2.311 677 HD2 LYS 78 HD2 LYS 78 -1.361 -17.286 -4.304 678 HD3 LYS 78 HD1 LYS 78 -2.691 -16.946 -3.204 679 HE2 LYS 78 HE2 LYS 78 -1.847 -14.934 -5.256 680 HE3 LYS 78 HE1 LYS 78 -2.897 -16.277 -5.697 681 HZ1 LYS 78 HZ1 LYS 78 -4.259 -14.437 -5.175 682 HZ2 LYS 78 HZ2 LYS 78 -3.451 -14.133 -3.727 683 HZ3 LYS 78 HZ3 LYS 78 -4.409 -15.518 -3.883 684 H GLU 79 HN GLU 79 -2.285 -17.917 -1.172 685 HA GLU 79 HA GLU 79 -1.264 -19.563 -0.018 686 HB2 GLU 79 HB2 GLU 79 0.344 -17.322 1.214 687 HB3 GLU 79 HB1 GLU 79 0.713 -19.035 1.366 688 HG2 GLU 79 HG2 GLU 79 0.810 -17.329 -1.102 689 HG3 GLU 79 HG1 GLU 79 2.131 -18.185 -0.311 690 H LYS 80 HN LYS 80 -3.098 -20.182 1.069 691 HA LYS 80 HA LYS 80 -3.650 -19.067 3.698 692 HB2 LYS 80 HB2 LYS 80 -5.474 -19.693 2.071 693 HB3 LYS 80 HB1 LYS 80 -5.017 -21.374 2.299 694 HG2 LYS 80 HG2 LYS 80 -5.542 -21.166 4.694 695 HG3 LYS 80 HG1 LYS 80 -6.062 -19.504 4.413 696 HD2 LYS 80 HD2 LYS 80 -7.769 -20.310 2.848 697 HD3 LYS 80 HD1 LYS 80 -7.258 -21.970 3.149 698 HE2 LYS 80 HE2 LYS 80 -8.339 -20.078 5.233 699 HE3 LYS 80 HE1 LYS 80 -9.272 -21.337 4.426 700 HZ1 LYS 80 HZ1 LYS 80 -6.892 -21.785 6.143 701 HZ2 LYS 80 HZ2 LYS 80 -7.795 -22.993 5.378 702 HZ3 LYS 80 HZ3 LYS 80 -8.498 -22.052 6.595 703 H ILE 81 HN ILE 81 -2.332 -19.742 5.275 704 HA ILE 81 HA ILE 81 -1.231 -22.452 5.151 705 HB ILE 81 HB ILE 81 0.324 -21.671 6.935 706 HG12 ILE 81 HG12 ILE 81 -0.894 -18.958 6.357 707 HG13 ILE 81 HG11 ILE 81 -1.126 -19.873 7.842 708 HG21 ILE 81 HG21 ILE 81 0.997 -21.659 4.607 709 HG22 ILE 81 HG22 ILE 81 1.681 -20.266 5.445 710 HG23 ILE 81 HG23 ILE 81 0.285 -20.061 4.387 711 HD11 ILE 81 HD11 ILE 81 1.497 -18.801 6.826 712 HD12 ILE 81 HD12 ILE 81 1.259 -19.709 8.319 713 HD13 ILE 81 HD13 ILE 81 0.525 -18.117 8.128 714 H GLY 82 HN GLY 82 -3.983 -21.950 5.981 715 HA2 GLY 82 HA2 GLY 82 -4.178 -22.085 8.822 716 HA3 GLY 82 HA1 GLY 82 -5.463 -22.442 7.676 717 H LYS 83 HN LYS 83 -3.948 -24.484 6.282 718 HA LYS 83 HA LYS 83 -4.513 -26.690 8.047 719 HB2 LYS 83 HB2 LYS 83 -3.918 -28.096 6.109 720 HB3 LYS 83 HB1 LYS 83 -5.102 -26.866 5.692 721 HG2 LYS 83 HG2 LYS 83 -3.360 -25.510 4.667 722 HG3 LYS 83 HG1 LYS 83 -2.147 -26.707 5.125 723 HD2 LYS 83 HD2 LYS 83 -3.279 -28.378 3.735 724 HD3 LYS 83 HD1 LYS 83 -4.482 -27.173 3.271 725 HE2 LYS 83 HE2 LYS 83 -2.764 -25.825 2.218 726 HE3 LYS 83 HE1 LYS 83 -1.520 -26.956 2.745 727 HZ1 LYS 83 HZ1 LYS 83 -3.742 -27.600 0.888 728 HZ2 LYS 83 HZ2 LYS 83 -2.507 -28.653 1.359 729 HZ3 LYS 83 HZ3 LYS 83 -2.147 -27.288 0.425 730 H LYS 84 HN LYS 84 -1.946 -24.687 7.727 731 HA LYS 84 HA LYS 84 0.076 -26.731 8.287 732 HB2 LYS 84 HB2 LYS 84 0.532 -24.989 6.556 733 HB3 LYS 84 HB1 LYS 84 0.421 -23.764 7.810 734 HG2 LYS 84 HG2 LYS 84 2.332 -24.786 8.957 735 HG3 LYS 84 HG1 LYS 84 2.453 -25.979 7.663 736 HD2 LYS 84 HD2 LYS 84 2.890 -24.219 6.049 737 HD3 LYS 84 HD1 LYS 84 2.691 -22.993 7.303 738 HE2 LYS 84 HE2 LYS 84 4.804 -25.143 7.258 739 HE3 LYS 84 HE1 LYS 84 5.052 -23.450 6.838 740 HZ1 LYS 84 HZ1 LYS 84 4.378 -22.865 9.114 741 HZ2 LYS 84 HZ2 LYS 84 5.759 -23.840 9.084 742 HZ3 LYS 84 HZ3 LYS 84 4.266 -24.509 9.498 743 H LYS 85 HN LYS 85 -2.076 -24.784 9.877 744 HA LYS 85 HA LYS 85 -0.563 -23.806 12.046 745 HB2 LYS 85 HB2 LYS 85 -2.789 -22.945 11.520 746 HB3 LYS 85 HB1 LYS 85 -3.499 -24.511 11.884 747 HG2 LYS 85 HG2 LYS 85 -2.865 -24.296 14.207 748 HG3 LYS 85 HG1 LYS 85 -2.056 -22.767 13.865 749 HD2 LYS 85 HD2 LYS 85 -4.179 -21.768 13.219 750 HD3 LYS 85 HD1 LYS 85 -5.003 -23.305 13.498 751 HE2 LYS 85 HE2 LYS 85 -5.289 -21.760 15.381 752 HE3 LYS 85 HE1 LYS 85 -4.419 -23.218 15.852 753 HZ1 LYS 85 HZ1 LYS 85 -3.356 -21.313 16.804 754 HZ2 LYS 85 HZ2 LYS 85 -3.232 -20.554 15.299 755 HZ3 LYS 85 HZ3 LYS 85 -2.338 -21.953 15.617 756 H ARG 86 HN ARG 86 -2.694 -26.649 11.819 757 HA ARG 86 HA ARG 86 -2.733 -28.634 12.917 758 HB2 ARG 86 HB2 ARG 86 0.251 -28.167 12.876 759 HB3 ARG 86 HB1 ARG 86 -0.510 -29.699 13.280 760 HG2 ARG 86 HG2 ARG 86 -0.850 -28.279 10.649 761 HG3 ARG 86 HG1 ARG 86 0.323 -29.561 10.949 762 HD2 ARG 86 HD2 ARG 86 -2.668 -29.830 11.248 763 HD3 ARG 86 HD1 ARG 86 -1.733 -30.382 9.860 764 HE ARG 86 HE ARG 86 -0.711 -31.488 12.260 765 HH11 ARG 86 HH11 ARG 86 -3.391 -31.785 10.027 766 HH12 ARG 86 HH12 ARG 86 -3.649 -33.468 10.365 767 HH21 ARG 86 HH21 ARG 86 -1.045 -33.701 12.713 768 HH22 ARG 86 HH22 ARG 86 -2.311 -34.558 11.895 769 H GLN 87 HN GLN 87 -3.687 -27.129 14.654 770 HA GLN 87 HA GLN 87 -2.161 -27.557 17.136 771 HB2 GLN 87 HB2 GLN 87 -2.490 -25.150 16.481 772 HB3 GLN 87 HB1 GLN 87 -4.220 -25.401 16.643 773 HG2 GLN 87 HG2 GLN 87 -3.998 -25.840 18.988 774 HG3 GLN 87 HG1 GLN 87 -2.239 -25.800 18.869 775 HE21 GLN 87 HE21 GLN 87 -4.008 -24.178 20.519 776 HE22 GLN 87 HE22 GLN 87 -3.695 -22.535 20.083 777 H LYS 88 HN LYS 88 -3.562 -27.926 19.053 778 HA LYS 88 HA LYS 88 -5.137 -29.106 20.174 779 HB2 LYS 88 HB2 LYS 88 -6.799 -28.744 17.676 780 HB3 LYS 88 HB1 LYS 88 -7.384 -29.489 19.154 781 HG2 LYS 88 HG2 LYS 88 -6.983 -27.385 20.354 782 HG3 LYS 88 HG1 LYS 88 -6.445 -26.646 18.843 783 HD2 LYS 88 HD2 LYS 88 -8.646 -27.087 17.854 784 HD3 LYS 88 HD1 LYS 88 -9.180 -27.813 19.371 785 HE2 LYS 88 HE2 LYS 88 -9.984 -25.528 19.183 786 HE3 LYS 88 HE1 LYS 88 -8.833 -25.673 20.509 787 HZ1 LYS 88 HZ1 LYS 88 -7.148 -24.667 19.191 788 HZ2 LYS 88 HZ2 LYS 88 -8.518 -23.681 19.091 789 HZ3 LYS 88 HZ3 LYS 88 -8.114 -24.699 17.802 790 H LYS 89 HN LYS 89 -5.492 -30.191 16.811 791 HA LYS 89 HA LYS 89 -5.681 -32.281 15.930 792 HB2 LYS 89 HB2 LYS 89 -3.575 -33.571 16.045 793 HB3 LYS 89 HB1 LYS 89 -3.331 -31.876 15.665 794 HG2 LYS 89 HG2 LYS 89 -2.572 -31.440 17.914 795 HG3 LYS 89 HG1 LYS 89 -2.930 -33.103 18.386 796 HD2 LYS 89 HD2 LYS 89 -1.275 -33.905 16.757 797 HD3 LYS 89 HD1 LYS 89 -0.908 -32.236 16.321 798 HE2 LYS 89 HE2 LYS 89 -0.554 -33.440 19.064 799 HE3 LYS 89 HE1 LYS 89 0.734 -33.191 17.889 800 HZ1 LYS 89 HZ1 LYS 89 0.301 -30.810 17.988 801 HZ2 LYS 89 HZ2 LYS 89 0.687 -31.420 19.515 802 HZ3 LYS 89 HZ3 LYS 89 -0.917 -31.060 19.132 803 H ARG 90 HN ARG 90 -7.398 -32.398 17.810 804 HA ARG 90 HA ARG 90 -8.577 -33.700 19.229 805 HB2 ARG 90 HB2 ARG 90 -6.784 -35.876 18.140 806 HB3 ARG 90 HB1 ARG 90 -8.241 -36.152 19.089 807 HG2 ARG 90 HG2 ARG 90 -9.560 -35.018 17.348 808 HG3 ARG 90 HG1 ARG 90 -8.092 -34.822 16.392 809 HD2 ARG 90 HD2 ARG 90 -7.839 -37.277 16.344 810 HD3 ARG 90 HD1 ARG 90 -9.362 -37.428 17.221 811 HE ARG 90 HE ARG 90 -9.799 -35.859 14.945 812 HH11 ARG 90 HH11 ARG 90 -9.062 -39.171 15.789 813 HH12 ARG 90 HH12 ARG 90 -9.792 -39.834 14.363 814 HH21 ARG 90 HH21 ARG 90 -10.756 -36.716 13.061 815 HH22 ARG 90 HH22 ARG 90 -10.769 -38.430 12.810 816 H LYS 91 HN LYS 91 -7.399 -32.349 20.815 817 HA LYS 91 HA LYS 91 -5.265 -33.629 22.282 818 HB2 LYS 91 HB2 LYS 91 -5.533 -31.522 23.754 819 HB3 LYS 91 HB1 LYS 91 -4.899 -31.341 22.128 820 HG2 LYS 91 HG2 LYS 91 -6.418 -29.569 22.458 821 HG3 LYS 91 HG1 LYS 91 -7.225 -30.719 21.398 822 HD2 LYS 91 HD2 LYS 91 -8.816 -29.966 23.017 823 HD3 LYS 91 HD1 LYS 91 -8.395 -31.633 23.412 824 HE2 LYS 91 HE2 LYS 91 -6.836 -30.828 25.122 825 HE3 LYS 91 HE1 LYS 91 -7.267 -29.163 24.730 826 HZ1 LYS 91 HZ1 LYS 91 -9.546 -29.652 25.398 827 HZ2 LYS 91 HZ2 LYS 91 -8.464 -29.930 26.665 828 HZ3 LYS 91 HZ3 LYS 91 -9.103 -31.232 25.801 829 H ALA 92 HN ALA 92 -8.138 -34.623 22.207 830 HA ALA 92 HA ALA 92 -9.080 -34.473 24.892 831 HB1 ALA 92 HB1 ALA 92 -10.584 -34.961 23.024 832 HB2 ALA 92 HB2 ALA 92 -10.632 -36.241 24.235 833 HB3 ALA 92 HB3 ALA 92 -9.737 -36.479 22.735 834 H ALA 93 HN ALA 93 -6.903 -36.549 23.129 835 HA ALA 93 HA ALA 93 -6.603 -38.430 25.302 836 HB1 ALA 93 HB1 ALA 93 -4.846 -39.424 23.912 837 HB2 ALA 93 HB2 ALA 93 -4.980 -38.078 22.780 838 HB3 ALA 93 HB3 ALA 93 -6.334 -39.187 22.994 839 H GLN 94 HN GLN 94 -6.211 -36.514 26.754 840 HA GLN 94 HA GLN 94 -3.540 -35.359 26.541 841 HB2 GLN 94 HB2 GLN 94 -4.328 -33.891 28.413 842 HB3 GLN 94 HB1 GLN 94 -5.265 -33.756 26.932 843 HG2 GLN 94 HG2 GLN 94 -6.978 -35.221 27.892 844 HG3 GLN 94 HG1 GLN 94 -6.044 -35.319 29.383 845 HE21 GLN 94 HE21 GLN 94 -8.745 -34.302 28.866 846 HE22 GLN 94 HE22 GLN 94 -8.757 -32.676 29.449 847 H LYS 95 HN LYS 95 -4.633 -38.133 27.712 848 HA LYS 95 HA LYS 95 -3.539 -38.151 30.343 849 HB2 LYS 95 HB2 LYS 95 -3.730 -40.616 30.179 850 HB3 LYS 95 HB1 LYS 95 -5.218 -39.775 29.786 851 HG2 LYS 95 HG2 LYS 95 -4.750 -40.100 27.395 852 HG3 LYS 95 HG1 LYS 95 -3.288 -40.994 27.823 853 HD2 LYS 95 HD2 LYS 95 -4.589 -42.678 28.953 854 HD3 LYS 95 HD1 LYS 95 -6.069 -41.750 28.714 855 HE2 LYS 95 HE2 LYS 95 -5.977 -43.556 27.116 856 HE3 LYS 95 HE1 LYS 95 -5.805 -42.016 26.277 857 HZ1 LYS 95 HZ1 LYS 95 -3.601 -43.876 26.972 858 HZ2 LYS 95 HZ2 LYS 95 -3.406 -42.378 26.224 859 HZ3 LYS 95 HZ3 LYS 95 -4.239 -43.615 25.428 860 H ARG 96 HN ARG 96 -2.102 -37.999 27.357 861 HA ARG 96 HA ARG 96 0.427 -39.057 28.421 862 HB2 ARG 96 HB2 ARG 96 1.217 -38.992 26.044 863 HB3 ARG 96 HB1 ARG 96 -0.107 -40.115 26.320 864 HG2 ARG 96 HG2 ARG 96 -1.681 -38.539 25.373 865 HG3 ARG 96 HG1 ARG 96 -0.396 -37.349 25.169 866 HD2 ARG 96 HD2 ARG 96 -0.383 -40.066 23.870 867 HD3 ARG 96 HD1 ARG 96 -1.023 -38.621 23.097 868 HE ARG 96 HE ARG 96 1.728 -38.494 24.046 869 HH11 ARG 96 HH11 ARG 96 -0.464 -38.911 21.343 870 HH12 ARG 96 HH12 ARG 96 0.754 -38.595 20.148 871 HH21 ARG 96 HH21 ARG 96 3.322 -38.066 22.484 872 HH22 ARG 96 HH22 ARG 96 2.908 -38.125 20.793 873 H LYS 97 HN LYS 97 2.043 -37.660 28.830 874 HA LYS 97 HA LYS 97 1.535 -34.828 28.317 875 HB2 LYS 97 HB2 LYS 97 3.610 -36.185 30.040 876 HB3 LYS 97 HB1 LYS 97 3.449 -34.445 29.858 877 HG2 LYS 97 HG2 LYS 97 1.196 -34.560 30.801 878 HG3 LYS 97 HG1 LYS 97 1.374 -36.303 30.999 879 HD2 LYS 97 HD2 LYS 97 3.259 -35.942 32.512 880 HD3 LYS 97 HD1 LYS 97 3.097 -34.198 32.300 881 HE2 LYS 97 HE2 LYS 97 1.022 -36.040 33.479 882 HE3 LYS 97 HE1 LYS 97 2.063 -34.944 34.383 883 HZ1 LYS 97 HZ1 LYS 97 0.030 -34.138 32.375 884 HZ2 LYS 97 HZ2 LYS 97 1.035 -33.083 33.231 885 HZ3 LYS 97 HZ3 LYS 97 -0.126 -33.998 34.054 886 H ASN 98 HN ASN 98 3.506 -37.439 27.282 887 HA ASN 98 HA ASN 98 5.187 -35.627 25.704 888 HB2 ASN 98 HB2 ASN 98 5.397 -38.605 26.211 889 HB3 ASN 98 HB1 ASN 98 6.467 -37.709 25.140 890 HD21 ASN 98 HD21 ASN 98 7.035 -39.230 27.572 891 HD22 ASN 98 HD22 ASN 98 7.826 -38.128 28.644 Start of MODEL 16 1 H1 LYS 1 HT1 LYS 1 -5.355 15.675 0.378 2 H2 LYS 1 HT2 LYS 1 -5.252 17.360 0.348 3 H3 LYS 1 HT3 LYS 1 -5.472 16.553 1.816 4 HA LYS 1 HA LYS 1 -3.207 17.292 1.603 5 HB2 LYS 1 HB2 LYS 1 -3.853 15.060 2.686 6 HB3 LYS 1 HB1 LYS 1 -3.289 14.298 1.207 7 HG2 LYS 1 HG2 LYS 1 -1.554 14.199 2.860 8 HG3 LYS 1 HG1 LYS 1 -1.063 15.309 1.578 9 HD2 LYS 1 HD2 LYS 1 -1.693 17.212 2.953 10 HD3 LYS 1 HD1 LYS 1 -2.277 16.132 4.217 11 HE2 LYS 1 HE2 LYS 1 -0.031 15.279 4.555 12 HE3 LYS 1 HE1 LYS 1 0.570 16.286 3.237 13 HZ1 LYS 1 HZ1 LYS 1 -0.027 18.249 4.493 14 HZ2 LYS 1 HZ2 LYS 1 1.005 17.275 5.408 15 HZ3 LYS 1 HZ3 LYS 1 -0.649 17.302 5.748 16 HA PRO 2 HA PRO 2 -2.057 17.359 -2.731 17 HB2 PRO 2 HB2 PRO 2 0.074 18.997 -2.470 18 HB3 PRO 2 HB1 PRO 2 -1.588 19.594 -2.406 19 HG2 PRO 2 HG2 PRO 2 0.287 18.971 -0.160 20 HG3 PRO 2 HG1 PRO 2 -0.780 20.372 -0.364 21 HD2 PRO 2 HD2 PRO 2 -1.420 18.264 1.212 22 HD3 PRO 2 HD1 PRO 2 -2.641 19.215 0.344 23 H VAL 3 HN VAL 3 -0.326 16.596 -4.007 24 HA VAL 3 HA VAL 3 1.143 14.468 -2.712 25 HB VAL 3 HB VAL 3 1.752 13.824 -5.046 26 HG11 VAL 3 HG11 VAL 3 -0.207 12.879 -3.939 27 HG12 VAL 3 HG12 VAL 3 -0.483 13.066 -5.670 28 HG13 VAL 3 HG13 VAL 3 -1.192 14.214 -4.534 29 HG21 VAL 3 HG21 VAL 3 0.607 14.911 -6.914 30 HG22 VAL 3 HG22 VAL 3 1.670 16.040 -6.074 31 HG23 VAL 3 HG23 VAL 3 -0.072 16.103 -5.805 32 H SER 4 HN SER 4 2.143 16.867 -1.879 33 HA SER 4 HA SER 4 4.504 17.428 -3.523 34 HB2 SER 4 HB2 SER 4 3.469 18.962 -1.130 35 HB3 SER 4 HB1 SER 4 4.681 19.497 -2.297 36 HG SER 4 HG SER 4 2.354 20.203 -2.528 37 H LEU 5 HN LEU 5 4.121 15.063 -1.709 38 HA LEU 5 HA LEU 5 6.428 15.537 0.064 39 HB2 LEU 5 HB2 LEU 5 4.091 13.695 0.554 40 HB3 LEU 5 HB1 LEU 5 5.473 13.900 1.609 41 HG LEU 5 HG LEU 5 3.479 16.070 0.953 42 HD11 LEU 5 HD11 LEU 5 2.683 15.745 3.242 43 HD12 LEU 5 HD12 LEU 5 3.775 14.373 3.426 44 HD13 LEU 5 HD13 LEU 5 2.452 14.298 2.263 45 HD21 LEU 5 HD21 LEU 5 5.728 15.965 2.963 46 HD22 LEU 5 HD22 LEU 5 4.558 17.273 2.794 47 HD23 LEU 5 HD23 LEU 5 5.693 16.935 1.490 48 H SER 6 HN SER 6 7.000 14.803 -2.406 49 HA SER 6 HA SER 6 7.096 11.921 -2.664 50 HB2 SER 6 HB2 SER 6 6.705 13.480 -4.609 51 HB3 SER 6 HB1 SER 6 8.370 14.023 -4.433 52 HG SER 6 HG SER 6 8.497 11.417 -4.505 53 H TYR 7 HN TYR 7 8.327 12.306 -0.423 54 HA TYR 7 HA TYR 7 11.209 12.568 -0.960 55 HB2 TYR 7 HB2 TYR 7 9.668 12.899 1.625 56 HB3 TYR 7 HB1 TYR 7 11.411 13.050 1.464 57 HD1 TYR 7 HD1 TYR 7 8.240 14.712 1.122 58 HD2 TYR 7 HD2 TYR 7 12.348 14.904 0.051 59 HE1 TYR 7 HE1 TYR 7 7.976 17.090 0.562 60 HE2 TYR 7 HE2 TYR 7 12.098 17.282 -0.512 61 HH TYR 7 HH TYR 7 9.265 19.075 0.294 62 H ARG 8 HN ARG 8 12.161 11.358 1.360 63 HA ARG 8 HA ARG 8 11.924 8.601 0.716 64 HB2 ARG 8 HB2 ARG 8 13.365 8.259 2.746 65 HB3 ARG 8 HB1 ARG 8 14.036 9.309 1.511 66 HG2 ARG 8 HG2 ARG 8 13.159 11.247 2.916 67 HG3 ARG 8 HG1 ARG 8 12.924 10.052 4.194 68 HD2 ARG 8 HD2 ARG 8 15.092 11.195 4.382 69 HD3 ARG 8 HD1 ARG 8 15.273 9.462 4.107 70 HE ARG 8 HE ARG 8 15.399 11.270 1.804 71 HH11 ARG 8 HH11 ARG 8 17.058 9.140 4.041 72 HH12 ARG 8 HH12 ARG 8 18.448 8.949 3.024 73 HH21 ARG 8 HH21 ARG 8 17.229 11.017 0.466 74 HH22 ARG 8 HH22 ARG 8 18.542 10.010 0.985 75 H CYS 9 HN CYS 9 9.730 8.303 0.876 76 HA CYS 9 HA CYS 9 8.130 8.617 3.129 77 HB2 CYS 9 HB2 CYS 9 8.018 7.108 0.580 78 HB3 CYS 9 HB1 CYS 9 6.899 6.616 1.841 79 HA PRO 10 HA PRO 10 8.348 5.691 6.343 80 HB2 PRO 10 HB2 PRO 10 6.419 4.017 4.804 81 HB3 PRO 10 HB1 PRO 10 6.442 4.385 6.530 82 HG2 PRO 10 HG2 PRO 10 4.877 5.708 4.748 83 HG3 PRO 10 HG1 PRO 10 5.493 6.442 6.233 84 HD2 PRO 10 HD2 PRO 10 6.173 7.068 3.492 85 HD3 PRO 10 HD1 PRO 10 6.670 7.904 4.971 86 H CYS 11 HN CYS 11 8.164 3.953 3.244 87 HA CYS 11 HA CYS 11 9.778 1.800 4.344 88 HB2 CYS 11 HB2 CYS 11 7.852 2.035 2.258 89 HB3 CYS 11 HB1 CYS 11 9.364 1.508 1.537 90 H ARG 12 HN ARG 12 11.838 1.383 3.845 91 HA ARG 12 HA ARG 12 13.438 3.378 2.562 92 HB2 ARG 12 HB2 ARG 12 14.213 0.576 3.399 93 HB3 ARG 12 HB1 ARG 12 15.316 1.879 2.973 94 HG2 ARG 12 HG2 ARG 12 13.444 1.873 5.335 95 HG3 ARG 12 HG1 ARG 12 15.171 1.534 5.392 96 HD2 ARG 12 HD2 ARG 12 14.993 3.771 6.048 97 HD3 ARG 12 HD1 ARG 12 15.482 3.849 4.359 98 HE ARG 12 HE ARG 12 12.801 4.012 4.191 99 HH11 ARG 12 HH11 ARG 12 15.149 5.730 6.133 100 HH12 ARG 12 HH12 ARG 12 14.203 7.179 6.227 101 HH21 ARG 12 HH21 ARG 12 11.541 5.933 4.308 102 HH22 ARG 12 HH22 ARG 12 12.150 7.293 5.202 103 H PHE 13 HN PHE 13 15.240 1.934 1.011 104 HA PHE 13 HA PHE 13 13.651 1.922 -1.382 105 HB2 PHE 13 HB2 PHE 13 16.583 1.222 -1.063 106 HB3 PHE 13 HB1 PHE 13 15.767 1.685 -2.552 107 HD1 PHE 13 HD1 PHE 13 15.201 3.986 -2.997 108 HD2 PHE 13 HD2 PHE 13 17.145 2.877 0.621 109 HE1 PHE 13 HE1 PHE 13 15.768 6.331 -2.592 110 HE2 PHE 13 HE2 PHE 13 17.711 5.222 1.038 111 HZ PHE 13 HZ PHE 13 16.972 6.965 -0.502 112 H PHE 14 HN PHE 14 13.260 0.180 -2.725 113 HA PHE 14 HA PHE 14 12.718 -2.111 -1.049 114 HB2 PHE 14 HB2 PHE 14 11.605 -2.318 -3.694 115 HB3 PHE 14 HB1 PHE 14 10.792 -2.221 -2.144 116 HD1 PHE 14 HD1 PHE 14 10.147 -0.046 -1.202 117 HD2 PHE 14 HD2 PHE 14 11.822 -0.394 -5.099 118 HE1 PHE 14 HE1 PHE 14 9.337 2.212 -1.748 119 HE2 PHE 14 HE2 PHE 14 11.016 1.862 -5.652 120 HZ PHE 14 HZ PHE 14 9.776 3.174 -3.960 121 H GLU 15 HN GLU 15 12.904 -4.255 -1.745 122 HA GLU 15 HA GLU 15 15.399 -4.710 -3.181 123 HB2 GLU 15 HB2 GLU 15 13.645 -6.611 -1.622 124 HB3 GLU 15 HB1 GLU 15 15.239 -6.985 -2.263 125 HG2 GLU 15 HG2 GLU 15 14.598 -4.967 -0.130 126 HG3 GLU 15 HG1 GLU 15 15.319 -6.552 0.119 127 H SER 16 HN SER 16 15.176 -4.904 -5.305 128 HA SER 16 HA SER 16 12.728 -5.879 -6.505 129 HB2 SER 16 HB2 SER 16 15.326 -5.119 -7.859 130 HB3 SER 16 HB1 SER 16 13.738 -5.253 -8.611 131 HG SER 16 HG SER 16 13.783 -3.553 -6.465 132 H HIS 17 HN HIS 17 13.976 -7.778 -4.911 133 HA HIS 17 HA HIS 17 14.850 -9.776 -6.879 134 HB2 HIS 17 HB2 HIS 17 16.842 -9.031 -5.736 135 HB3 HIS 17 HB1 HIS 17 16.067 -9.199 -4.169 136 HD1 HIS 17 HD1 HIS 17 16.447 -11.344 -2.985 137 HD2 HIS 17 HD2 HIS 17 17.245 -11.647 -7.054 138 HE1 HIS 17 HE1 HIS 17 17.394 -13.649 -3.320 139 HE2 HIS 17 HE2 HIS 17 18.017 -13.747 -5.756 140 H ILE 18 HN ILE 18 12.958 -8.934 -4.150 141 HA ILE 18 HA ILE 18 12.586 -11.433 -2.947 142 HB ILE 18 HB ILE 18 10.598 -9.172 -3.047 143 HG12 ILE 18 HG12 ILE 18 12.740 -9.715 -0.998 144 HG13 ILE 18 HG11 ILE 18 12.869 -8.501 -2.262 145 HG21 ILE 18 HG21 ILE 18 9.885 -10.137 -0.847 146 HG22 ILE 18 HG22 ILE 18 10.920 -11.527 -1.194 147 HG23 ILE 18 HG23 ILE 18 9.552 -11.161 -2.244 148 HD11 ILE 18 HD11 ILE 18 10.825 -8.553 -0.052 149 HD12 ILE 18 HD12 ILE 18 10.928 -7.342 -1.330 150 HD13 ILE 18 HD13 ILE 18 12.232 -7.498 -0.154 151 H ALA 19 HN ALA 19 11.126 -13.016 -3.187 152 HA ALA 19 HA ALA 19 9.552 -13.053 -5.667 153 HB1 ALA 19 HB1 ALA 19 11.363 -14.752 -5.376 154 HB2 ALA 19 HB2 ALA 19 9.757 -15.434 -5.624 155 HB3 ALA 19 HB3 ALA 19 10.458 -15.394 -4.006 156 H ARG 20 HN ARG 20 7.474 -14.228 -5.550 157 HA ARG 20 HA ARG 20 5.863 -13.440 -3.372 158 HB2 ARG 20 HB2 ARG 20 5.361 -14.187 -5.920 159 HB3 ARG 20 HB1 ARG 20 4.983 -15.694 -5.103 160 HG2 ARG 20 HG2 ARG 20 3.756 -13.020 -4.492 161 HG3 ARG 20 HG1 ARG 20 3.007 -14.298 -5.449 162 HD2 ARG 20 HD2 ARG 20 3.934 -14.694 -2.632 163 HD3 ARG 20 HD1 ARG 20 2.305 -14.132 -3.022 164 HE ARG 20 HE ARG 20 2.453 -16.350 -4.495 165 HH11 ARG 20 HH11 ARG 20 3.372 -15.803 -1.160 166 HH12 ARG 20 HH12 ARG 20 3.013 -17.424 -0.661 167 HH21 ARG 20 HH21 ARG 20 1.992 -18.486 -3.844 168 HH22 ARG 20 HH22 ARG 20 2.250 -18.957 -2.196 169 H ALA 21 HN ALA 21 7.551 -16.355 -4.234 170 HA ALA 21 HA ALA 21 6.439 -17.892 -2.048 171 HB1 ALA 21 HB1 ALA 21 8.612 -18.602 -4.010 172 HB2 ALA 21 HB2 ALA 21 6.899 -18.979 -4.193 173 HB3 ALA 21 HB3 ALA 21 7.827 -19.710 -2.883 174 H ASN 22 HN ASN 22 8.589 -15.510 -2.178 175 HA ASN 22 HA ASN 22 10.338 -16.701 -0.149 176 HB2 ASN 22 HB2 ASN 22 11.287 -15.579 -2.298 177 HB3 ASN 22 HB1 ASN 22 10.855 -14.095 -1.495 178 HD21 ASN 22 HD21 ASN 22 13.116 -13.612 -1.621 179 HD22 ASN 22 HD22 ASN 22 14.187 -14.240 -0.427 180 H VAL 23 HN VAL 23 7.659 -14.855 -0.511 181 HA VAL 23 HA VAL 23 8.318 -13.178 1.799 182 HB VAL 23 HB VAL 23 7.832 -11.835 -0.146 183 HG11 VAL 23 HG11 VAL 23 5.595 -11.860 -1.175 184 HG12 VAL 23 HG12 VAL 23 5.200 -13.283 -0.211 185 HG13 VAL 23 HG13 VAL 23 6.476 -13.373 -1.435 186 HG21 VAL 23 HG21 VAL 23 6.143 -10.428 0.758 187 HG22 VAL 23 HG22 VAL 23 7.109 -11.106 2.077 188 HG23 VAL 23 HG23 VAL 23 5.507 -11.755 1.733 189 H LYS 24 HN LYS 24 6.976 -12.958 3.427 190 HA LYS 24 HA LYS 24 4.774 -14.855 3.728 191 HB2 LYS 24 HB2 LYS 24 6.235 -13.261 5.847 192 HB3 LYS 24 HB1 LYS 24 4.990 -14.462 6.130 193 HG2 LYS 24 HG2 LYS 24 6.624 -16.015 4.826 194 HG3 LYS 24 HG1 LYS 24 7.811 -14.815 5.340 195 HD2 LYS 24 HD2 LYS 24 5.984 -15.674 7.457 196 HD3 LYS 24 HD1 LYS 24 7.002 -16.958 6.821 197 HE2 LYS 24 HE2 LYS 24 8.984 -15.618 7.241 198 HE3 LYS 24 HE1 LYS 24 7.973 -14.307 7.857 199 HZ1 LYS 24 HZ1 LYS 24 8.995 -15.762 9.587 200 HZ2 LYS 24 HZ2 LYS 24 8.019 -17.028 9.038 201 HZ3 LYS 24 HZ3 LYS 24 7.308 -15.635 9.687 202 H HIS 25 HN HIS 25 3.665 -13.390 5.909 203 HA HIS 25 HA HIS 25 1.520 -12.120 4.989 204 HB2 HIS 25 HB2 HIS 25 2.850 -10.555 7.128 205 HB3 HIS 25 HB1 HIS 25 1.207 -11.169 7.060 206 HD1 HIS 25 HD1 HIS 25 2.915 -11.263 9.596 207 HD2 HIS 25 HD2 HIS 25 2.635 -14.438 6.917 208 HE1 HIS 25 HE1 HIS 25 3.505 -13.315 10.910 209 HE2 HIS 25 HE2 HIS 25 3.256 -15.231 9.298 210 H LEU 26 HN LEU 26 1.340 -10.633 3.405 211 HA LEU 26 HA LEU 26 3.400 -8.561 3.245 212 HB2 LEU 26 HB2 LEU 26 2.335 -10.199 1.298 213 HB3 LEU 26 HB1 LEU 26 1.548 -8.665 1.008 214 HG LEU 26 HG LEU 26 4.525 -9.131 1.125 215 HD11 LEU 26 HD11 LEU 26 2.752 -8.508 -1.228 216 HD12 LEU 26 HD12 LEU 26 3.500 -10.069 -0.884 217 HD13 LEU 26 HD13 LEU 26 4.514 -8.667 -1.255 218 HD21 LEU 26 HD21 LEU 26 4.299 -6.964 1.843 219 HD22 LEU 26 HD22 LEU 26 2.869 -6.670 0.851 220 HD23 LEU 26 HD23 LEU 26 4.459 -6.762 0.096 221 H LYS 27 HN LYS 27 2.914 -6.464 3.032 222 HA LYS 27 HA LYS 27 0.219 -5.541 3.722 223 HB2 LYS 27 HB2 LYS 27 1.167 -5.871 5.877 224 HB3 LYS 27 HB1 LYS 27 2.711 -5.201 5.377 225 HG2 LYS 27 HG2 LYS 27 1.684 -3.589 6.749 226 HG3 LYS 27 HG1 LYS 27 1.561 -3.009 5.084 227 HD2 LYS 27 HD2 LYS 27 -0.569 -2.602 5.884 228 HD3 LYS 27 HD1 LYS 27 -0.766 -4.190 5.144 229 HE2 LYS 27 HE2 LYS 27 -0.300 -3.658 8.079 230 HE3 LYS 27 HE1 LYS 27 -1.850 -4.053 7.342 231 HZ1 LYS 27 HZ1 LYS 27 0.537 -5.808 7.507 232 HZ2 LYS 27 HZ2 LYS 27 -0.860 -6.189 6.637 233 HZ3 LYS 27 HZ3 LYS 27 -0.934 -6.010 8.315 234 H ILE 28 HN ILE 28 -0.111 -3.299 3.242 235 HA ILE 28 HA ILE 28 2.068 -2.073 1.695 236 HB ILE 28 HB ILE 28 -0.820 -1.393 1.270 237 HG12 ILE 28 HG12 ILE 28 0.431 -3.198 -0.672 238 HG13 ILE 28 HG11 ILE 28 0.160 -3.932 0.904 239 HG21 ILE 28 HG21 ILE 28 1.708 -1.134 -0.381 240 HG22 ILE 28 HG22 ILE 28 0.757 0.170 0.344 241 HG23 ILE 28 HG23 ILE 28 0.083 -0.776 -0.982 242 HD11 ILE 28 HD11 ILE 28 -1.914 -2.589 -0.794 243 HD12 ILE 28 HD12 ILE 28 -2.185 -3.329 0.784 244 HD13 ILE 28 HD13 ILE 28 -1.700 -4.327 -0.589 245 H LEU 29 HN LEU 29 2.633 0.006 2.174 246 HA LEU 29 HA LEU 29 1.480 1.143 4.600 247 HB2 LEU 29 HB2 LEU 29 4.035 0.981 3.891 248 HB3 LEU 29 HB1 LEU 29 3.663 2.482 3.057 249 HG LEU 29 HG LEU 29 4.666 2.947 5.206 250 HD11 LEU 29 HD11 LEU 29 2.926 4.380 6.203 251 HD12 LEU 29 HD12 LEU 29 1.724 3.617 5.155 252 HD13 LEU 29 HD13 LEU 29 3.042 4.556 4.452 253 HD21 LEU 29 HD21 LEU 29 2.368 1.413 6.405 254 HD22 LEU 29 HD22 LEU 29 3.582 2.324 7.300 255 HD23 LEU 29 HD23 LEU 29 4.055 0.903 6.369 256 H ASN 30 HN ASN 30 -0.097 2.585 4.498 257 HA ASN 30 HA ASN 30 -0.727 3.996 2.084 258 HB2 ASN 30 HB2 ASN 30 -1.925 3.625 4.710 259 HB3 ASN 30 HB1 ASN 30 -2.057 5.289 4.151 260 HD21 ASN 30 HD21 ASN 30 -2.928 1.979 3.527 261 HD22 ASN 30 HD22 ASN 30 -4.154 2.314 2.350 262 H THR 31 HN THR 31 0.912 5.269 1.478 263 HA THR 31 HA THR 31 2.374 6.863 3.350 264 HB THR 31 HB THR 31 3.494 7.554 1.143 265 HG1 THR 31 HG1 THR 31 2.663 5.135 0.079 266 HG21 THR 31 HG21 THR 31 4.515 6.099 2.797 267 HG22 THR 31 HG22 THR 31 4.862 5.519 1.169 268 HG23 THR 31 HG23 THR 31 3.631 4.719 2.147 269 HA PRO 32 HA PRO 32 1.147 11.098 2.662 270 HB2 PRO 32 HB2 PRO 32 3.513 11.720 1.171 271 HB3 PRO 32 HB1 PRO 32 3.009 12.208 2.781 272 HG2 PRO 32 HG2 PRO 32 4.927 10.226 2.053 273 HG3 PRO 32 HG1 PRO 32 4.485 10.829 3.652 274 HD2 PRO 32 HD2 PRO 32 3.944 8.302 2.647 275 HD3 PRO 32 HD1 PRO 32 3.224 9.043 4.062 276 H ASN 33 HN ASN 33 1.083 8.950 0.279 277 HA ASN 33 HA ASN 33 0.342 8.883 -1.860 278 HB2 ASN 33 HB2 ASN 33 0.743 11.883 -1.973 279 HB3 ASN 33 HB1 ASN 33 0.133 10.890 -3.287 280 HD21 ASN 33 HD21 ASN 33 -0.690 10.456 0.094 281 HD22 ASN 33 HD22 ASN 33 -2.334 10.943 -0.038 282 H CYS 34 HN CYS 34 2.613 8.127 -1.033 283 HA CYS 34 HA CYS 34 4.532 8.666 -3.171 284 HB2 CYS 34 HB2 CYS 34 4.578 7.314 -0.518 285 HB3 CYS 34 HB1 CYS 34 5.628 6.653 -1.740 286 H ALA 35 HN ALA 35 5.395 6.461 -4.121 287 HA ALA 35 HA ALA 35 3.316 4.889 -5.173 288 HB1 ALA 35 HB1 ALA 35 5.023 3.224 -5.723 289 HB2 ALA 35 HB2 ALA 35 6.178 4.056 -4.680 290 HB3 ALA 35 HB3 ALA 35 5.573 4.850 -6.133 291 H LEU 36 HN LEU 36 2.219 3.164 -4.372 292 HA LEU 36 HA LEU 36 1.901 2.905 -1.643 293 HB2 LEU 36 HB2 LEU 36 1.101 1.316 -4.034 294 HB3 LEU 36 HB1 LEU 36 0.862 0.622 -2.453 295 HG LEU 36 HG LEU 36 -0.572 2.493 -1.808 296 HD11 LEU 36 HD11 LEU 36 -1.237 4.182 -3.429 297 HD12 LEU 36 HD12 LEU 36 -0.122 3.501 -4.613 298 HD13 LEU 36 HD13 LEU 36 0.502 4.243 -3.139 299 HD21 LEU 36 HD21 LEU 36 -2.433 2.053 -3.346 300 HD22 LEU 36 HD22 LEU 36 -1.616 0.575 -2.841 301 HD23 LEU 36 HD23 LEU 36 -1.316 1.247 -4.443 302 H GLN 37 HN GLN 37 3.111 2.022 -0.162 303 HA GLN 37 HA GLN 37 5.563 0.759 -0.949 304 HB2 GLN 37 HB2 GLN 37 4.495 1.311 1.813 305 HB3 GLN 37 HB1 GLN 37 6.153 0.922 1.400 306 HG2 GLN 37 HG2 GLN 37 4.774 3.333 0.290 307 HG3 GLN 37 HG1 GLN 37 5.567 3.351 1.863 308 HE21 GLN 37 HE21 GLN 37 7.041 4.837 1.208 309 HE22 GLN 37 HE22 GLN 37 8.331 4.452 0.146 310 H ILE 38 HN ILE 38 5.699 -1.309 -1.298 311 HA ILE 38 HA ILE 38 3.880 -3.218 -0.128 312 HB ILE 38 HB ILE 38 6.328 -3.969 -1.689 313 HG12 ILE 38 HG12 ILE 38 5.344 -2.129 -2.980 314 HG13 ILE 38 HG11 ILE 38 5.133 -3.665 -3.807 315 HG21 ILE 38 HG21 ILE 38 3.745 -5.182 -0.990 316 HG22 ILE 38 HG22 ILE 38 5.333 -5.923 -1.244 317 HG23 ILE 38 HG23 ILE 38 4.323 -5.498 -2.625 318 HD11 ILE 38 HD11 ILE 38 3.167 -2.242 -3.963 319 HD12 ILE 38 HD12 ILE 38 3.023 -2.246 -2.204 320 HD13 ILE 38 HD13 ILE 38 2.819 -3.747 -3.107 321 H VAL 39 HN VAL 39 4.326 -3.468 2.057 322 HA VAL 39 HA VAL 39 7.138 -3.956 2.772 323 HB VAL 39 HB VAL 39 5.791 -2.126 3.978 324 HG11 VAL 39 HG11 VAL 39 4.474 -2.780 5.881 325 HG12 VAL 39 HG12 VAL 39 4.659 -4.479 5.449 326 HG13 VAL 39 HG13 VAL 39 3.759 -3.394 4.390 327 HG21 VAL 39 HG21 VAL 39 7.969 -2.934 4.696 328 HG22 VAL 39 HG22 VAL 39 7.202 -4.254 5.582 329 HG23 VAL 39 HG23 VAL 39 6.940 -2.581 6.082 330 H ALA 40 HN ALA 40 7.762 -5.904 3.360 331 HA ALA 40 HA ALA 40 5.699 -7.953 3.790 332 HB1 ALA 40 HB1 ALA 40 8.025 -8.211 1.894 333 HB2 ALA 40 HB2 ALA 40 6.369 -7.837 1.417 334 HB3 ALA 40 HB3 ALA 40 6.737 -9.388 2.163 335 H ARG 41 HN ARG 41 6.431 -9.847 4.831 336 HA ARG 41 HA ARG 41 9.074 -9.589 6.114 337 HB2 ARG 41 HB2 ARG 41 6.547 -10.990 6.949 338 HB3 ARG 41 HB1 ARG 41 8.107 -11.429 7.641 339 HG2 ARG 41 HG2 ARG 41 7.638 -8.561 7.647 340 HG3 ARG 41 HG1 ARG 41 6.440 -9.456 8.565 341 HD2 ARG 41 HD2 ARG 41 8.235 -10.570 9.810 342 HD3 ARG 41 HD1 ARG 41 9.421 -9.640 8.897 343 HE ARG 41 HE ARG 41 7.490 -7.999 10.238 344 HH11 ARG 41 HH11 ARG 41 10.494 -9.758 10.664 345 HH12 ARG 41 HH12 ARG 41 11.041 -8.744 11.963 346 HH21 ARG 41 HH21 ARG 41 8.205 -6.685 11.958 347 HH22 ARG 41 HH22 ARG 41 9.743 -7.000 12.697 348 H LEU 42 HN LEU 42 10.629 -10.977 5.528 349 HA LEU 42 HA LEU 42 10.114 -12.634 3.268 350 HB2 LEU 42 HB2 LEU 42 12.539 -12.082 4.929 351 HB3 LEU 42 HB1 LEU 42 12.568 -13.328 3.695 352 HG LEU 42 HG LEU 42 11.846 -10.454 3.140 353 HD11 LEU 42 HD11 LEU 42 14.103 -10.257 2.188 354 HD12 LEU 42 HD12 LEU 42 14.489 -11.863 2.806 355 HD13 LEU 42 HD13 LEU 42 14.136 -10.548 3.928 356 HD21 LEU 42 HD21 LEU 42 10.966 -12.000 1.501 357 HD22 LEU 42 HD22 LEU 42 12.541 -12.777 1.343 358 HD23 LEU 42 HD23 LEU 42 12.321 -11.111 0.806 359 H LYS 43 HN LYS 43 10.237 -14.816 3.010 360 HA LYS 43 HA LYS 43 8.745 -16.312 4.764 361 HB2 LYS 43 HB2 LYS 43 9.103 -16.792 2.380 362 HB3 LYS 43 HB1 LYS 43 10.732 -17.315 2.755 363 HG2 LYS 43 HG2 LYS 43 9.793 -19.109 4.171 364 HG3 LYS 43 HG1 LYS 43 8.178 -18.615 3.652 365 HD2 LYS 43 HD2 LYS 43 8.931 -18.978 1.283 366 HD3 LYS 43 HD1 LYS 43 10.414 -19.677 1.935 367 HE2 LYS 43 HE2 LYS 43 9.138 -21.393 3.088 368 HE3 LYS 43 HE1 LYS 43 7.632 -20.682 2.514 369 HZ1 LYS 43 HZ1 LYS 43 8.254 -22.580 1.178 370 HZ2 LYS 43 HZ2 LYS 43 9.746 -21.877 0.805 371 HZ3 LYS 43 HZ3 LYS 43 8.318 -21.173 0.244 372 H ASN 44 HN ASN 44 12.177 -16.936 4.132 373 HA ASN 44 HA ASN 44 12.352 -18.488 6.567 374 HB2 ASN 44 HB2 ASN 44 14.403 -17.871 4.456 375 HB3 ASN 44 HB1 ASN 44 14.663 -18.954 5.813 376 HD21 ASN 44 HD21 ASN 44 14.769 -19.477 2.955 377 HD22 ASN 44 HD22 ASN 44 13.611 -20.721 2.637 378 H ASN 45 HN ASN 45 13.387 -15.423 5.305 379 HA ASN 45 HA ASN 45 15.464 -15.042 7.211 380 HB2 ASN 45 HB2 ASN 45 15.284 -14.040 4.864 381 HB3 ASN 45 HB1 ASN 45 14.202 -12.868 5.586 382 HD21 ASN 45 HD21 ASN 45 15.635 -11.204 5.055 383 HD22 ASN 45 HD22 ASN 45 17.086 -10.941 5.955 384 H ASN 46 HN ASN 46 12.079 -14.326 7.120 385 HA ASN 46 HA ASN 46 10.632 -13.577 8.687 386 HB2 ASN 46 HB2 ASN 46 13.020 -13.819 10.508 387 HB3 ASN 46 HB1 ASN 46 11.405 -13.413 11.069 388 HD21 ASN 46 HD21 ASN 46 13.106 -15.708 11.685 389 HD22 ASN 46 HD22 ASN 46 12.182 -17.107 11.260 390 H ARG 47 HN ARG 47 13.025 -11.732 7.483 391 HA ARG 47 HA ARG 47 12.714 -9.470 9.254 392 HB2 ARG 47 HB2 ARG 47 14.307 -9.852 6.726 393 HB3 ARG 47 HB1 ARG 47 14.217 -8.321 7.584 394 HG2 ARG 47 HG2 ARG 47 15.120 -9.501 9.598 395 HG3 ARG 47 HG1 ARG 47 15.395 -10.905 8.565 396 HD2 ARG 47 HD2 ARG 47 17.429 -9.682 8.677 397 HD3 ARG 47 HD1 ARG 47 16.744 -9.456 7.069 398 HE ARG 47 HE ARG 47 15.989 -7.384 8.896 399 HH11 ARG 47 HH11 ARG 47 18.529 -8.466 6.741 400 HH12 ARG 47 HH12 ARG 47 19.150 -6.872 6.464 401 HH21 ARG 47 HH21 ARG 47 16.800 -5.279 8.524 402 HH22 ARG 47 HH22 ARG 47 18.169 -5.058 7.484 403 H GLN 48 HN GLN 48 11.743 -7.615 8.820 404 HA GLN 48 HA GLN 48 9.715 -7.554 6.782 405 HB2 GLN 48 HB2 GLN 48 9.196 -6.546 8.919 406 HB3 GLN 48 HB1 GLN 48 10.588 -5.477 8.800 407 HG2 GLN 48 HG2 GLN 48 9.553 -4.462 6.794 408 HG3 GLN 48 HG1 GLN 48 8.131 -5.464 7.077 409 HE21 GLN 48 HE21 GLN 48 8.222 -5.233 9.952 410 HE22 GLN 48 HE22 GLN 48 7.729 -3.622 10.335 411 H VAL 49 HN VAL 49 9.886 -6.624 4.858 412 HA VAL 49 HA VAL 49 12.147 -4.873 4.235 413 HB VAL 49 HB VAL 49 12.846 -7.209 3.758 414 HG11 VAL 49 HG11 VAL 49 10.670 -8.171 3.284 415 HG12 VAL 49 HG12 VAL 49 11.790 -8.465 1.953 416 HG13 VAL 49 HG13 VAL 49 10.555 -7.215 1.807 417 HG21 VAL 49 HG21 VAL 49 13.771 -5.391 2.426 418 HG22 VAL 49 HG22 VAL 49 12.435 -5.538 1.284 419 HG23 VAL 49 HG23 VAL 49 13.594 -6.856 1.460 420 H CYS 50 HN CYS 50 11.816 -3.793 2.108 421 HA CYS 50 HA CYS 50 8.978 -3.555 1.463 422 HB2 CYS 50 HB2 CYS 50 11.230 -1.666 0.740 423 HB3 CYS 50 HB1 CYS 50 9.509 -1.373 0.589 424 H ILE 51 HN ILE 51 8.294 -4.300 -0.445 425 HA ILE 51 HA ILE 51 10.252 -5.463 -2.273 426 HB ILE 51 HB ILE 51 7.333 -5.561 -2.867 427 HG12 ILE 51 HG12 ILE 51 8.625 -7.184 -0.662 428 HG13 ILE 51 HG11 ILE 51 7.339 -5.993 -0.464 429 HG21 ILE 51 HG21 ILE 51 9.300 -7.816 -2.909 430 HG22 ILE 51 HG22 ILE 51 9.251 -6.627 -4.207 431 HG23 ILE 51 HG23 ILE 51 7.827 -7.610 -3.857 432 HD11 ILE 51 HD11 ILE 51 6.277 -8.080 -0.387 433 HD12 ILE 51 HD12 ILE 51 7.198 -8.696 -1.753 434 HD13 ILE 51 HD13 ILE 51 5.959 -7.472 -2.010 435 H ASP 52 HN ASP 52 10.390 -4.938 -4.446 436 HA ASP 52 HA ASP 52 9.934 -2.214 -5.108 437 HB2 ASP 52 HB2 ASP 52 11.824 -3.389 -6.056 438 HB3 ASP 52 HB1 ASP 52 10.765 -4.577 -6.799 439 HA PRO 53 HA PRO 53 5.656 -2.689 -6.208 440 HB2 PRO 53 HB2 PRO 53 5.361 -0.248 -7.378 441 HB3 PRO 53 HB1 PRO 53 5.359 -0.510 -5.630 442 HG2 PRO 53 HG2 PRO 53 7.580 0.418 -7.407 443 HG3 PRO 53 HG1 PRO 53 7.096 1.023 -5.811 444 HD2 PRO 53 HD2 PRO 53 9.183 -0.629 -6.113 445 HD3 PRO 53 HD1 PRO 53 8.121 -0.725 -4.698 446 H LYS 54 HN LYS 54 8.251 -2.334 -8.370 447 HA LYS 54 HA LYS 54 6.546 -2.386 -10.745 448 HB2 LYS 54 HB2 LYS 54 9.534 -2.017 -10.496 449 HB3 LYS 54 HB1 LYS 54 8.618 -1.939 -11.991 450 HG2 LYS 54 HG2 LYS 54 7.537 -0.160 -9.999 451 HG3 LYS 54 HG1 LYS 54 9.240 0.166 -10.316 452 HD2 LYS 54 HD2 LYS 54 7.693 1.455 -11.754 453 HD3 LYS 54 HD1 LYS 54 8.804 0.446 -12.672 454 HE2 LYS 54 HE2 LYS 54 6.142 -0.602 -11.948 455 HE3 LYS 54 HE1 LYS 54 6.229 0.598 -13.224 456 HZ1 LYS 54 HZ1 LYS 54 7.578 -2.049 -13.178 457 HZ2 LYS 54 HZ2 LYS 54 7.846 -0.869 -14.353 458 HZ3 LYS 54 HZ3 LYS 54 6.317 -1.566 -14.192 459 H LEU 55 HN LEU 55 8.088 -4.529 -8.713 460 HA LEU 55 HA LEU 55 9.105 -6.510 -10.359 461 HB2 LEU 55 HB2 LEU 55 7.886 -6.361 -7.665 462 HB3 LEU 55 HB1 LEU 55 8.070 -7.960 -8.360 463 HG LEU 55 HG LEU 55 10.354 -6.009 -8.143 464 HD11 LEU 55 HD11 LEU 55 9.578 -6.331 -5.915 465 HD12 LEU 55 HD12 LEU 55 11.027 -7.313 -6.135 466 HD13 LEU 55 HD13 LEU 55 9.434 -8.073 -6.152 467 HD21 LEU 55 HD21 LEU 55 10.204 -8.992 -8.510 468 HD22 LEU 55 HD22 LEU 55 11.691 -8.058 -8.329 469 HD23 LEU 55 HD23 LEU 55 10.649 -7.802 -9.731 470 H LYS 56 HN LYS 56 8.228 -8.297 -11.354 471 HA LYS 56 HA LYS 56 5.820 -7.664 -12.705 472 HB2 LYS 56 HB2 LYS 56 7.486 -10.183 -12.826 473 HB3 LYS 56 HB1 LYS 56 6.223 -9.737 -13.964 474 HG2 LYS 56 HG2 LYS 56 8.735 -8.154 -13.468 475 HG3 LYS 56 HG1 LYS 56 8.482 -9.268 -14.812 476 HD2 LYS 56 HD2 LYS 56 6.744 -7.907 -15.713 477 HD3 LYS 56 HD1 LYS 56 6.711 -6.891 -14.273 478 HE2 LYS 56 HE2 LYS 56 7.857 -5.787 -16.135 479 HE3 LYS 56 HE1 LYS 56 8.940 -6.068 -14.774 480 HZ1 LYS 56 HZ1 LYS 56 9.867 -7.961 -15.923 481 HZ2 LYS 56 HZ2 LYS 56 9.969 -6.591 -16.909 482 HZ3 LYS 56 HZ3 LYS 56 8.786 -7.759 -17.207 483 H TRP 57 HN TRP 57 6.551 -9.808 -10.034 484 HA TRP 57 HA TRP 57 3.859 -10.910 -10.137 485 HB2 TRP 57 HB2 TRP 57 4.467 -12.264 -8.269 486 HB3 TRP 57 HB1 TRP 57 5.827 -12.283 -9.372 487 HD1 TRP 57 HD1 TRP 57 8.080 -11.189 -8.536 488 HE1 TRP 57 HE1 TRP 57 8.936 -10.533 -6.196 489 HE3 TRP 57 HE3 TRP 57 3.637 -11.265 -6.020 490 HZ2 TRP 57 HZ2 TRP 57 7.849 -10.103 -3.624 491 HZ3 TRP 57 HZ3 TRP 57 3.622 -10.700 -3.632 492 HH2 TRP 57 HH2 TRP 57 5.688 -10.140 -2.454 493 H ILE 58 HN ILE 58 5.601 -8.340 -8.700 494 HA ILE 58 HA ILE 58 3.821 -7.798 -6.553 495 HB ILE 58 HB ILE 58 5.984 -6.246 -7.916 496 HG12 ILE 58 HG12 ILE 58 6.561 -8.047 -6.317 497 HG13 ILE 58 HG11 ILE 58 7.107 -6.462 -5.782 498 HG21 ILE 58 HG21 ILE 58 5.664 -4.495 -6.200 499 HG22 ILE 58 HG22 ILE 58 4.127 -5.250 -5.783 500 HG23 ILE 58 HG23 ILE 58 4.374 -4.586 -7.402 501 HD11 ILE 58 HD11 ILE 58 5.451 -6.330 -4.143 502 HD12 ILE 58 HD12 ILE 58 6.063 -7.982 -4.055 503 HD13 ILE 58 HD13 ILE 58 4.530 -7.652 -4.848 504 H GLN 59 HN GLN 59 4.090 -6.659 -9.878 505 HA GLN 59 HA GLN 59 2.204 -4.634 -9.923 506 HB2 GLN 59 HB2 GLN 59 2.894 -6.764 -11.898 507 HB3 GLN 59 HB1 GLN 59 1.775 -5.473 -12.298 508 HG2 GLN 59 HG2 GLN 59 4.607 -5.029 -11.390 509 HG3 GLN 59 HG1 GLN 59 4.131 -5.156 -13.081 510 HE21 GLN 59 HE21 GLN 59 4.072 -3.188 -10.226 511 HE22 GLN 59 HE22 GLN 59 3.468 -1.757 -10.988 512 H GLU 60 HN GLU 60 1.792 -8.057 -9.779 513 HA GLU 60 HA GLU 60 -1.015 -8.158 -10.284 514 HB2 GLU 60 HB2 GLU 60 0.733 -10.119 -8.780 515 HB3 GLU 60 HB1 GLU 60 -0.861 -10.448 -9.430 516 HG2 GLU 60 HG2 GLU 60 1.512 -9.712 -11.114 517 HG3 GLU 60 HG1 GLU 60 1.048 -11.369 -10.744 518 H TYR 61 HN TYR 61 1.016 -7.905 -7.448 519 HA TYR 61 HA TYR 61 -1.128 -8.193 -5.546 520 HB2 TYR 61 HB2 TYR 61 1.153 -8.873 -4.950 521 HB3 TYR 61 HB1 TYR 61 1.734 -7.246 -5.231 522 HD1 TYR 61 HD1 TYR 61 -0.194 -9.373 -2.977 523 HD2 TYR 61 HD2 TYR 61 1.451 -5.510 -3.629 524 HE1 TYR 61 HE1 TYR 61 -0.559 -8.822 -0.630 525 HE2 TYR 61 HE2 TYR 61 1.085 -4.950 -1.262 526 HH TYR 61 HH TYR 61 0.362 -7.267 1.080 527 H LEU 62 HN LEU 62 0.589 -5.695 -7.183 528 HA LEU 62 HA LEU 62 -0.245 -3.447 -5.804 529 HB2 LEU 62 HB2 LEU 62 1.023 -4.107 -8.242 530 HB3 LEU 62 HB1 LEU 62 -0.210 -2.896 -8.588 531 HG LEU 62 HG LEU 62 0.808 -1.501 -6.744 532 HD11 LEU 62 HD11 LEU 62 2.007 -3.080 -5.501 533 HD12 LEU 62 HD12 LEU 62 3.235 -2.100 -6.310 534 HD13 LEU 62 HD13 LEU 62 2.821 -3.706 -6.933 535 HD21 LEU 62 HD21 LEU 62 2.538 -2.163 -9.122 536 HD22 LEU 62 HD22 LEU 62 2.647 -0.702 -8.141 537 HD23 LEU 62 HD23 LEU 62 1.200 -1.016 -9.098 538 H GLU 63 HN GLU 63 -1.762 -5.224 -8.445 539 HA GLU 63 HA GLU 63 -3.998 -3.682 -8.884 540 HB2 GLU 63 HB2 GLU 63 -3.745 -6.671 -8.836 541 HB3 GLU 63 HB1 GLU 63 -5.084 -5.791 -9.543 542 HG2 GLU 63 HG2 GLU 63 -3.520 -4.669 -11.035 543 HG3 GLU 63 HG1 GLU 63 -2.222 -5.650 -10.380 544 H LYS 64 HN LYS 64 -3.286 -5.894 -6.329 545 HA LYS 64 HA LYS 64 -5.869 -5.930 -5.109 546 HB2 LYS 64 HB2 LYS 64 -3.258 -6.395 -3.699 547 HB3 LYS 64 HB1 LYS 64 -4.836 -7.041 -3.275 548 HG2 LYS 64 HG2 LYS 64 -3.177 -7.791 -5.658 549 HG3 LYS 64 HG1 LYS 64 -3.427 -8.770 -4.212 550 HD2 LYS 64 HD2 LYS 64 -5.911 -8.653 -4.799 551 HD3 LYS 64 HD1 LYS 64 -5.379 -8.041 -6.365 552 HE2 LYS 64 HE2 LYS 64 -4.665 -10.694 -5.132 553 HE3 LYS 64 HE1 LYS 64 -5.732 -10.426 -6.508 554 HZ1 LYS 64 HZ1 LYS 64 -3.812 -9.509 -7.716 555 HZ2 LYS 64 HZ2 LYS 64 -3.586 -11.124 -7.274 556 HZ3 LYS 64 HZ3 LYS 64 -2.813 -9.900 -6.408 557 H ALA 65 HN ALA 65 -2.821 -4.316 -4.503 558 HA ALA 65 HA ALA 65 -3.495 -2.863 -2.224 559 HB1 ALA 65 HB1 ALA 65 -1.492 -1.561 -2.712 560 HB2 ALA 65 HB2 ALA 65 -1.466 -2.212 -4.351 561 HB3 ALA 65 HB3 ALA 65 -1.206 -3.283 -2.974 562 H LEU 66 HN LEU 66 -3.977 -2.198 -5.589 563 HA LEU 66 HA LEU 66 -4.608 0.592 -5.111 564 HB2 LEU 66 HB2 LEU 66 -4.371 -1.129 -7.519 565 HB3 LEU 66 HB1 LEU 66 -5.362 0.312 -7.634 566 HG LEU 66 HG LEU 66 -3.437 1.670 -6.937 567 HD11 LEU 66 HD11 LEU 66 -1.230 0.726 -6.809 568 HD12 LEU 66 HD12 LEU 66 -1.859 -0.872 -7.221 569 HD13 LEU 66 HD13 LEU 66 -2.291 -0.129 -5.682 570 HD21 LEU 66 HD21 LEU 66 -3.917 1.375 -9.300 571 HD22 LEU 66 HD22 LEU 66 -2.945 -0.096 -9.327 572 HD23 LEU 66 HD23 LEU 66 -2.177 1.464 -9.026 573 H ASN 67 HN ASN 67 -6.259 -2.373 -5.331 574 HA ASN 67 HA ASN 67 -8.833 -1.129 -5.758 575 HB2 ASN 67 HB2 ASN 67 -7.838 -3.893 -5.780 576 HB3 ASN 67 HB1 ASN 67 -9.517 -3.660 -5.374 577 HD21 ASN 67 HD21 ASN 67 -7.099 -3.360 -7.831 578 HD22 ASN 67 HD22 ASN 67 -8.194 -3.131 -9.153 579 H LYS 68 HN LYS 68 -6.902 -2.061 -3.135 580 HA LYS 68 HA LYS 68 -9.164 -1.710 -1.309 581 HB2 LYS 68 HB2 LYS 68 -7.286 -4.059 -1.373 582 HB3 LYS 68 HB1 LYS 68 -8.183 -3.615 0.073 583 HG2 LYS 68 HG2 LYS 68 -10.229 -4.169 -0.877 584 HG3 LYS 68 HG1 LYS 68 -9.610 -4.042 -2.523 585 HD2 LYS 68 HD2 LYS 68 -10.008 -6.371 -1.871 586 HD3 LYS 68 HD1 LYS 68 -8.308 -6.066 -2.214 587 HE2 LYS 68 HE2 LYS 68 -8.462 -7.431 -0.259 588 HE3 LYS 68 HE1 LYS 68 -7.910 -5.829 0.219 589 HZ1 LYS 68 HZ1 LYS 68 -10.690 -6.847 0.464 590 HZ2 LYS 68 HZ2 LYS 68 -10.162 -5.307 0.922 591 HZ3 LYS 68 HZ3 LYS 68 -9.584 -6.671 1.732 592 H GLY 69 HN GLY 69 -8.702 -0.435 0.355 593 HA2 GLY 69 HA2 GLY 69 -7.426 0.318 2.168 594 HA3 GLY 69 HA1 GLY 69 -6.004 -0.405 1.430 595 H ARG 70 HN ARG 70 -8.300 1.823 -0.054 596 HA ARG 70 HA ARG 70 -6.078 3.672 -0.590 597 HB2 ARG 70 HB2 ARG 70 -7.543 2.706 -2.453 598 HB3 ARG 70 HB1 ARG 70 -8.831 3.723 -1.827 599 HG2 ARG 70 HG2 ARG 70 -7.326 5.696 -2.187 600 HG3 ARG 70 HG1 ARG 70 -6.215 4.606 -3.018 601 HD2 ARG 70 HD2 ARG 70 -9.051 5.262 -3.787 602 HD3 ARG 70 HD1 ARG 70 -7.582 5.692 -4.660 603 HE ARG 70 HE ARG 70 -7.394 3.052 -4.693 604 HH11 ARG 70 HH11 ARG 70 -10.145 5.119 -5.323 605 HH12 ARG 70 HH12 ARG 70 -10.917 3.988 -6.385 606 HH21 ARG 70 HH21 ARG 70 -8.412 1.546 -6.068 607 HH22 ARG 70 HH22 ARG 70 -9.939 1.944 -6.796 608 H ARG 71 HN ARG 71 -7.634 3.410 1.955 609 HA ARG 71 HA ARG 71 -8.642 4.659 3.553 610 HB2 ARG 71 HB2 ARG 71 -7.747 7.000 1.852 611 HB3 ARG 71 HB1 ARG 71 -8.341 7.111 3.503 612 HG2 ARG 71 HG2 ARG 71 -6.424 5.561 4.128 613 HG3 ARG 71 HG1 ARG 71 -5.783 5.893 2.521 614 HD2 ARG 71 HD2 ARG 71 -6.444 7.990 4.580 615 HD3 ARG 71 HD1 ARG 71 -4.832 7.349 4.286 616 HE ARG 71 HE ARG 71 -5.272 8.226 1.900 617 HH11 ARG 71 HH11 ARG 71 -6.433 9.729 4.845 618 HH12 ARG 71 HH12 ARG 71 -6.372 11.338 4.198 619 HH21 ARG 71 HH21 ARG 71 -5.177 10.358 1.058 620 HH22 ARG 71 HH22 ARG 71 -5.665 11.692 2.053 621 H GLU 72 HN GLU 72 -10.163 3.634 1.415 622 HA GLU 72 HA GLU 72 -12.214 5.629 0.835 623 HB2 GLU 72 HB2 GLU 72 -11.416 4.082 -0.942 624 HB3 GLU 72 HB1 GLU 72 -11.998 2.724 0.008 625 HG2 GLU 72 HG2 GLU 72 -14.290 3.719 -0.145 626 HG3 GLU 72 HG1 GLU 72 -13.628 4.884 -1.293 627 H GLU 73 HN GLU 73 -11.488 3.149 3.035 628 HA GLU 73 HA GLU 73 -14.157 2.359 3.666 629 HB2 GLU 73 HB2 GLU 73 -13.080 1.219 5.604 630 HB3 GLU 73 HB1 GLU 73 -12.398 0.786 4.044 631 HG2 GLU 73 HG2 GLU 73 -10.569 2.437 4.490 632 HG3 GLU 73 HG1 GLU 73 -11.216 2.609 6.122 633 H LYS 74 HN LYS 74 -15.528 3.143 5.139 634 HA LYS 74 HA LYS 74 -14.659 5.511 6.642 635 HB2 LYS 74 HB2 LYS 74 -17.405 4.623 5.760 636 HB3 LYS 74 HB1 LYS 74 -17.125 5.982 6.838 637 HG2 LYS 74 HG2 LYS 74 -16.133 5.731 4.005 638 HG3 LYS 74 HG1 LYS 74 -17.470 6.741 4.561 639 HD2 LYS 74 HD2 LYS 74 -15.923 8.014 5.966 640 HD3 LYS 74 HD1 LYS 74 -14.588 7.004 5.416 641 HE2 LYS 74 HE2 LYS 74 -15.050 7.758 3.098 642 HE3 LYS 74 HE1 LYS 74 -16.266 8.860 3.740 643 HZ1 LYS 74 HZ1 LYS 74 -14.516 9.926 5.051 644 HZ2 LYS 74 HZ2 LYS 74 -14.194 10.008 3.396 645 HZ3 LYS 74 HZ3 LYS 74 -13.364 8.898 4.362 646 H VAL 75 HN VAL 75 -15.798 2.284 6.990 647 HA VAL 75 HA VAL 75 -16.483 2.660 9.795 648 HB VAL 75 HB VAL 75 -16.356 0.038 8.302 649 HG11 VAL 75 HG11 VAL 75 -17.961 -0.703 9.984 650 HG12 VAL 75 HG12 VAL 75 -17.914 0.890 10.737 651 HG13 VAL 75 HG13 VAL 75 -16.474 -0.126 10.733 652 HG21 VAL 75 HG21 VAL 75 -18.761 0.290 7.871 653 HG22 VAL 75 HG22 VAL 75 -17.812 1.530 7.052 654 HG23 VAL 75 HG23 VAL 75 -18.698 1.926 8.524 655 H GLY 76 HN GLY 76 -13.804 1.954 7.868 656 HA2 GLY 76 HA2 GLY 76 -12.386 0.362 9.822 657 HA3 GLY 76 HA1 GLY 76 -11.756 0.944 8.288 658 H LYS 77 HN LYS 77 -12.738 2.081 11.493 659 HA LYS 77 HA LYS 77 -11.136 4.459 11.292 660 HB2 LYS 77 HB2 LYS 77 -12.551 3.225 13.661 661 HB3 LYS 77 HB1 LYS 77 -11.800 4.814 13.652 662 HG2 LYS 77 HG2 LYS 77 -14.066 3.991 11.848 663 HG3 LYS 77 HG1 LYS 77 -14.257 4.863 13.369 664 HD2 LYS 77 HD2 LYS 77 -12.904 6.700 12.490 665 HD3 LYS 77 HD1 LYS 77 -12.694 5.823 10.973 666 HE2 LYS 77 HE2 LYS 77 -14.443 7.540 10.811 667 HE3 LYS 77 HE1 LYS 77 -15.080 5.916 10.553 668 HZ1 LYS 77 HZ1 LYS 77 -15.248 7.422 13.107 669 HZ2 LYS 77 HZ2 LYS 77 -15.922 5.903 12.800 670 HZ3 LYS 77 HZ3 LYS 77 -16.504 7.267 11.990 671 H LYS 78 HN LYS 78 -9.170 3.255 10.746 672 HA LYS 78 HA LYS 78 -7.822 1.885 12.915 673 HB2 LYS 78 HB2 LYS 78 -7.113 2.561 10.080 674 HB3 LYS 78 HB1 LYS 78 -5.855 2.088 11.204 675 HG2 LYS 78 HG2 LYS 78 -6.422 0.131 10.081 676 HG3 LYS 78 HG1 LYS 78 -7.238 0.002 11.636 677 HD2 LYS 78 HD2 LYS 78 -9.339 0.624 10.644 678 HD3 LYS 78 HD1 LYS 78 -8.556 0.960 9.098 679 HE2 LYS 78 HE2 LYS 78 -7.907 -1.397 8.923 680 HE3 LYS 78 HE1 LYS 78 -8.702 -1.726 10.461 681 HZ1 LYS 78 HZ1 LYS 78 -10.802 -1.128 9.492 682 HZ2 LYS 78 HZ2 LYS 78 -10.074 -2.320 8.545 683 HZ3 LYS 78 HZ3 LYS 78 -10.068 -0.707 8.024 684 H GLU 79 HN GLU 79 -5.606 2.593 13.539 685 HA GLU 79 HA GLU 79 -5.552 5.494 13.947 686 HB2 GLU 79 HB2 GLU 79 -3.944 3.285 15.245 687 HB3 GLU 79 HB1 GLU 79 -3.854 4.990 15.669 688 HG2 GLU 79 HG2 GLU 79 -6.108 4.978 16.465 689 HG3 GLU 79 HG1 GLU 79 -6.361 3.340 15.865 690 H LYS 80 HN LYS 80 -4.663 3.600 11.624 691 HA LYS 80 HA LYS 80 -2.094 4.946 11.151 692 HB2 LYS 80 HB2 LYS 80 -1.564 2.985 9.656 693 HB3 LYS 80 HB1 LYS 80 -1.631 2.624 11.375 694 HG2 LYS 80 HG2 LYS 80 -3.919 1.763 11.074 695 HG3 LYS 80 HG1 LYS 80 -3.773 2.049 9.341 696 HD2 LYS 80 HD2 LYS 80 -1.939 0.475 9.204 697 HD3 LYS 80 HD1 LYS 80 -1.964 0.255 10.956 698 HE2 LYS 80 HE2 LYS 80 -4.233 -0.649 10.802 699 HE3 LYS 80 HE1 LYS 80 -4.197 -0.442 9.053 700 HZ1 LYS 80 HZ1 LYS 80 -3.706 -2.714 9.684 701 HZ2 LYS 80 HZ2 LYS 80 -2.396 -2.203 10.624 702 HZ3 LYS 80 HZ3 LYS 80 -2.359 -2.003 8.946 703 H ILE 81 HN ILE 81 -5.289 4.366 10.013 704 HA ILE 81 HA ILE 81 -4.902 4.977 7.278 705 HB ILE 81 HB ILE 81 -6.974 3.929 8.004 706 HG12 ILE 81 HG12 ILE 81 -7.504 6.701 6.919 707 HG13 ILE 81 HG11 ILE 81 -6.999 5.314 5.962 708 HG21 ILE 81 HG21 ILE 81 -7.588 6.502 9.444 709 HG22 ILE 81 HG22 ILE 81 -7.194 4.958 10.198 710 HG23 ILE 81 HG23 ILE 81 -8.679 5.129 9.264 711 HD11 ILE 81 HD11 ILE 81 -9.571 5.531 7.507 712 HD12 ILE 81 HD12 ILE 81 -9.069 4.167 6.506 713 HD13 ILE 81 HD13 ILE 81 -9.389 5.737 5.764 714 H GLY 82 HN GLY 82 -5.764 6.980 10.074 715 HA2 GLY 82 HA2 GLY 82 -4.764 9.318 8.581 716 HA3 GLY 82 HA1 GLY 82 -5.876 9.405 9.947 717 H LYS 83 HN LYS 83 -2.729 7.955 9.203 718 HA LYS 83 HA LYS 83 -1.892 7.673 11.843 719 HB2 LYS 83 HB2 LYS 83 0.392 7.395 10.877 720 HB3 LYS 83 HB1 LYS 83 -0.841 6.388 10.133 721 HG2 LYS 83 HG2 LYS 83 -0.960 7.889 8.233 722 HG3 LYS 83 HG1 LYS 83 0.205 8.974 8.991 723 HD2 LYS 83 HD2 LYS 83 1.309 7.600 7.325 724 HD3 LYS 83 HD1 LYS 83 1.888 7.176 8.936 725 HE2 LYS 83 HE2 LYS 83 1.524 5.170 7.640 726 HE3 LYS 83 HE1 LYS 83 0.352 5.249 8.952 727 HZ1 LYS 83 HZ1 LYS 83 -0.179 5.993 6.122 728 HZ2 LYS 83 HZ2 LYS 83 -1.310 6.028 7.383 729 HZ3 LYS 83 HZ3 LYS 83 -0.661 4.554 6.868 730 H LYS 84 HN LYS 84 0.004 8.657 12.850 731 HA LYS 84 HA LYS 84 1.009 10.399 13.862 732 HB2 LYS 84 HB2 LYS 84 0.378 11.855 11.293 733 HB3 LYS 84 HB1 LYS 84 1.311 12.553 12.609 734 HG2 LYS 84 HG2 LYS 84 2.984 10.791 12.366 735 HG3 LYS 84 HG1 LYS 84 2.049 10.084 11.048 736 HD2 LYS 84 HD2 LYS 84 2.867 12.948 10.882 737 HD3 LYS 84 HD1 LYS 84 4.064 11.695 10.557 738 HE2 LYS 84 HE2 LYS 84 3.064 12.386 8.484 739 HE3 LYS 84 HE1 LYS 84 2.546 10.745 8.853 740 HZ1 LYS 84 HZ1 LYS 84 0.941 13.211 9.271 741 HZ2 LYS 84 HZ2 LYS 84 0.438 11.642 9.649 742 HZ3 LYS 84 HZ3 LYS 84 0.718 12.071 8.042 743 H LYS 85 HN LYS 85 -1.596 9.782 14.464 744 HA LYS 85 HA LYS 85 -3.297 12.041 14.618 745 HB2 LYS 85 HB2 LYS 85 -3.165 9.489 16.224 746 HB3 LYS 85 HB1 LYS 85 -4.397 10.712 16.485 747 HG2 LYS 85 HG2 LYS 85 -4.091 9.786 13.709 748 HG3 LYS 85 HG1 LYS 85 -4.695 8.592 14.858 749 HD2 LYS 85 HD2 LYS 85 -6.578 9.718 13.887 750 HD3 LYS 85 HD1 LYS 85 -6.427 10.243 15.562 751 HE2 LYS 85 HE2 LYS 85 -6.914 12.160 14.215 752 HE3 LYS 85 HE1 LYS 85 -5.241 12.277 14.752 753 HZ1 LYS 85 HZ1 LYS 85 -5.303 12.850 12.472 754 HZ2 LYS 85 HZ2 LYS 85 -6.223 11.492 12.069 755 HZ3 LYS 85 HZ3 LYS 85 -4.613 11.308 12.550 756 H ARG 86 HN ARG 86 -0.953 10.626 16.849 757 HA ARG 86 HA ARG 86 -1.446 12.635 18.863 758 HB2 ARG 86 HB2 ARG 86 0.593 10.415 18.693 759 HB3 ARG 86 HB1 ARG 86 0.406 11.482 20.077 760 HG2 ARG 86 HG2 ARG 86 -1.802 10.646 20.498 761 HG3 ARG 86 HG1 ARG 86 -1.764 9.687 19.016 762 HD2 ARG 86 HD2 ARG 86 0.052 9.339 21.399 763 HD3 ARG 86 HD1 ARG 86 -1.319 8.309 20.990 764 HE ARG 86 HE ARG 86 0.328 8.331 18.769 765 HH11 ARG 86 HH11 ARG 86 0.554 7.338 22.113 766 HH12 ARG 86 HH12 ARG 86 1.709 6.084 21.799 767 HH21 ARG 86 HH21 ARG 86 1.844 6.684 18.343 768 HH22 ARG 86 HH22 ARG 86 2.454 5.717 19.648 769 H GLN 87 HN GLN 87 -0.798 14.095 16.774 770 HA GLN 87 HA GLN 87 2.039 14.781 17.166 771 HB2 GLN 87 HB2 GLN 87 1.360 14.115 14.837 772 HB3 GLN 87 HB1 GLN 87 0.316 15.531 14.798 773 HG2 GLN 87 HG2 GLN 87 2.285 16.963 15.156 774 HG3 GLN 87 HG1 GLN 87 3.310 15.530 15.117 775 HE21 GLN 87 HE21 GLN 87 3.321 17.867 13.401 776 HE22 GLN 87 HE22 GLN 87 3.097 17.288 11.789 777 H LYS 88 HN LYS 88 1.064 15.787 19.153 778 HA LYS 88 HA LYS 88 0.707 17.681 20.351 779 HB2 LYS 88 HB2 LYS 88 2.462 18.491 18.698 780 HB3 LYS 88 HB1 LYS 88 1.145 19.209 17.786 781 HG2 LYS 88 HG2 LYS 88 0.566 20.595 19.719 782 HG3 LYS 88 HG1 LYS 88 1.904 19.881 20.622 783 HD2 LYS 88 HD2 LYS 88 2.154 21.450 18.055 784 HD3 LYS 88 HD1 LYS 88 2.507 22.064 19.671 785 HE2 LYS 88 HE2 LYS 88 4.289 20.458 19.933 786 HE3 LYS 88 HE1 LYS 88 3.891 19.712 18.388 787 HZ1 LYS 88 HZ1 LYS 88 4.860 22.492 18.750 788 HZ2 LYS 88 HZ2 LYS 88 4.506 21.751 17.275 789 HZ3 LYS 88 HZ3 LYS 88 5.791 21.187 18.214 790 H LYS 89 HN LYS 89 -1.507 16.329 19.088 791 HA LYS 89 HA LYS 89 -3.371 18.591 18.817 792 HB2 LYS 89 HB2 LYS 89 -2.976 17.397 16.654 793 HB3 LYS 89 HB1 LYS 89 -3.602 15.930 17.396 794 HG2 LYS 89 HG2 LYS 89 -5.737 17.168 17.826 795 HG3 LYS 89 HG1 LYS 89 -5.091 18.483 16.844 796 HD2 LYS 89 HD2 LYS 89 -4.874 16.961 14.945 797 HD3 LYS 89 HD1 LYS 89 -5.506 15.639 15.929 798 HE2 LYS 89 HE2 LYS 89 -6.962 18.159 15.136 799 HE3 LYS 89 HE1 LYS 89 -7.269 16.532 14.532 800 HZ1 LYS 89 HZ1 LYS 89 -7.852 15.889 16.828 801 HZ2 LYS 89 HZ2 LYS 89 -8.881 17.066 16.195 802 HZ3 LYS 89 HZ3 LYS 89 -7.689 17.503 17.306 803 H ARG 90 HN ARG 90 -3.533 18.284 21.163 804 HA ARG 90 HA ARG 90 -5.774 16.555 21.744 805 HB2 ARG 90 HB2 ARG 90 -3.813 15.109 22.202 806 HB3 ARG 90 HB1 ARG 90 -3.209 16.311 23.335 807 HG2 ARG 90 HG2 ARG 90 -5.213 16.000 24.714 808 HG3 ARG 90 HG1 ARG 90 -5.782 14.767 23.588 809 HD2 ARG 90 HD2 ARG 90 -3.802 13.416 24.065 810 HD3 ARG 90 HD1 ARG 90 -3.221 14.655 25.177 811 HE ARG 90 HE ARG 90 -5.840 13.751 25.855 812 HH11 ARG 90 HH11 ARG 90 -2.440 12.948 26.117 813 HH12 ARG 90 HH12 ARG 90 -2.651 11.984 27.543 814 HH21 ARG 90 HH21 ARG 90 -6.109 12.505 27.751 815 HH22 ARG 90 HH22 ARG 90 -4.731 11.729 28.469 816 H LYS 91 HN LYS 91 -6.905 18.465 22.076 817 HA LYS 91 HA LYS 91 -6.096 19.930 24.499 818 HB2 LYS 91 HB2 LYS 91 -5.848 21.340 22.506 819 HB3 LYS 91 HB1 LYS 91 -7.533 21.060 22.092 820 HG2 LYS 91 HG2 LYS 91 -8.303 22.306 23.937 821 HG3 LYS 91 HG1 LYS 91 -6.707 22.322 24.689 822 HD2 LYS 91 HD2 LYS 91 -5.862 23.726 22.878 823 HD3 LYS 91 HD1 LYS 91 -7.448 23.691 22.103 824 HE2 LYS 91 HE2 LYS 91 -8.440 24.891 23.902 825 HE3 LYS 91 HE1 LYS 91 -6.992 24.720 24.893 826 HZ1 LYS 91 HZ1 LYS 91 -5.808 26.177 23.442 827 HZ2 LYS 91 HZ2 LYS 91 -7.254 26.940 23.866 828 HZ3 LYS 91 HZ3 LYS 91 -7.089 26.233 22.343 829 H ALA 92 HN ALA 92 -8.693 18.509 22.660 830 HA ALA 92 HA ALA 92 -10.794 17.856 23.168 831 HB1 ALA 92 HB1 ALA 92 -11.404 17.421 25.480 832 HB2 ALA 92 HB2 ALA 92 -10.001 18.332 26.037 833 HB3 ALA 92 HB3 ALA 92 -9.778 16.829 25.141 834 H ALA 93 HN ALA 93 -10.303 20.323 25.694 835 HA ALA 93 HA ALA 93 -12.781 21.615 24.980 836 HB1 ALA 93 HB1 ALA 93 -12.089 21.457 27.326 837 HB2 ALA 93 HB2 ALA 93 -12.280 23.137 26.823 838 HB3 ALA 93 HB3 ALA 93 -10.668 22.439 26.972 839 H GLN 94 HN GLN 94 -11.960 21.923 22.748 840 HA GLN 94 HA GLN 94 -9.906 23.869 22.277 841 HB2 GLN 94 HB2 GLN 94 -10.282 22.068 20.685 842 HB3 GLN 94 HB1 GLN 94 -11.939 22.593 20.436 843 HG2 GLN 94 HG2 GLN 94 -11.183 24.628 19.393 844 HG3 GLN 94 HG1 GLN 94 -9.505 24.216 19.740 845 HE21 GLN 94 HE21 GLN 94 -11.812 21.800 18.742 846 HE22 GLN 94 HE22 GLN 94 -11.155 21.548 17.162 847 H LYS 95 HN LYS 95 -13.312 23.897 21.221 848 HA LYS 95 HA LYS 95 -13.581 26.646 22.132 849 HB2 LYS 95 HB2 LYS 95 -13.666 25.816 19.246 850 HB3 LYS 95 HB1 LYS 95 -14.584 27.205 19.808 851 HG2 LYS 95 HG2 LYS 95 -11.607 26.891 20.140 852 HG3 LYS 95 HG1 LYS 95 -12.382 27.777 18.825 853 HD2 LYS 95 HD2 LYS 95 -13.454 29.251 20.483 854 HD3 LYS 95 HD1 LYS 95 -12.622 28.384 21.772 855 HE2 LYS 95 HE2 LYS 95 -11.249 29.851 19.526 856 HE3 LYS 95 HE1 LYS 95 -11.526 30.516 21.132 857 HZ1 LYS 95 HZ1 LYS 95 -10.186 28.714 22.051 858 HZ2 LYS 95 HZ2 LYS 95 -9.306 29.639 20.947 859 HZ3 LYS 95 HZ3 LYS 95 -9.891 28.122 20.493 860 H ARG 96 HN ARG 96 -15.036 25.541 23.582 861 HA ARG 96 HA ARG 96 -17.586 24.796 22.337 862 HB2 ARG 96 HB2 ARG 96 -18.210 23.894 24.537 863 HB3 ARG 96 HB1 ARG 96 -16.726 23.170 23.939 864 HG2 ARG 96 HG2 ARG 96 -15.419 24.614 25.412 865 HG3 ARG 96 HG1 ARG 96 -16.908 25.354 26.005 866 HD2 ARG 96 HD2 ARG 96 -17.651 23.155 26.822 867 HD3 ARG 96 HD1 ARG 96 -16.138 22.447 26.259 868 HE ARG 96 HE ARG 96 -15.500 24.557 27.967 869 HH11 ARG 96 HH11 ARG 96 -17.065 21.434 28.127 870 HH12 ARG 96 HH12 ARG 96 -16.642 21.166 29.787 871 HH21 ARG 96 HH21 ARG 96 -14.926 24.198 30.150 872 HH22 ARG 96 HH22 ARG 96 -15.426 22.734 30.938 873 H LYS 97 HN LYS 97 -19.544 25.752 23.088 874 HA LYS 97 HA LYS 97 -20.857 27.558 23.450 875 HB2 LYS 97 HB2 LYS 97 -18.858 27.992 25.667 876 HB3 LYS 97 HB1 LYS 97 -20.294 28.985 25.462 877 HG2 LYS 97 HG2 LYS 97 -21.685 26.960 25.694 878 HG3 LYS 97 HG1 LYS 97 -20.219 26.024 25.996 879 HD2 LYS 97 HD2 LYS 97 -19.746 27.351 27.972 880 HD3 LYS 97 HD1 LYS 97 -21.153 28.367 27.651 881 HE2 LYS 97 HE2 LYS 97 -22.619 26.434 27.940 882 HE3 LYS 97 HE1 LYS 97 -21.216 25.409 28.239 883 HZ1 LYS 97 HZ1 LYS 97 -22.297 26.091 30.292 884 HZ2 LYS 97 HZ2 LYS 97 -22.040 27.719 29.914 885 HZ3 LYS 97 HZ3 LYS 97 -20.723 26.700 30.208 886 H ASN 98 HN ASN 98 -20.082 28.285 21.333 887 HA ASN 98 HA ASN 98 -18.332 30.638 21.482 888 HB2 ASN 98 HB2 ASN 98 -19.305 29.141 19.034 889 HB3 ASN 98 HB1 ASN 98 -18.157 30.474 19.040 890 HD21 ASN 98 HD21 ASN 98 -18.644 27.120 19.604 891 HD22 ASN 98 HD22 ASN 98 -16.986 26.698 19.863 Start of MODEL 17 1 H1 LYS 1 HT1 LYS 1 21.533 9.590 -15.835 2 H2 LYS 1 HT2 LYS 1 20.467 8.405 -15.267 3 H3 LYS 1 HT3 LYS 1 21.836 8.815 -14.365 4 HA LYS 1 HA LYS 1 20.987 11.014 -13.973 5 HB2 LYS 1 HB2 LYS 1 18.545 10.012 -15.454 6 HB3 LYS 1 HB1 LYS 1 18.671 11.550 -14.618 7 HG2 LYS 1 HG2 LYS 1 20.436 12.235 -16.190 8 HG3 LYS 1 HG1 LYS 1 20.232 10.706 -17.050 9 HD2 LYS 1 HD2 LYS 1 17.871 11.287 -17.467 10 HD3 LYS 1 HD1 LYS 1 18.128 12.836 -16.664 11 HE2 LYS 1 HE2 LYS 1 18.237 13.125 -19.060 12 HE3 LYS 1 HE1 LYS 1 19.827 13.400 -18.353 13 HZ1 LYS 1 HZ1 LYS 1 19.890 12.050 -20.386 14 HZ2 LYS 1 HZ2 LYS 1 18.968 10.858 -19.620 15 HZ3 LYS 1 HZ3 LYS 1 20.515 11.228 -19.050 16 HA PRO 2 HA PRO 2 19.209 8.640 -10.590 17 HB2 PRO 2 HB2 PRO 2 20.075 10.178 -8.606 18 HB3 PRO 2 HB1 PRO 2 21.216 9.194 -9.530 19 HG2 PRO 2 HG2 PRO 2 20.623 12.116 -9.749 20 HG3 PRO 2 HG1 PRO 2 22.188 11.288 -9.800 21 HD2 PRO 2 HD2 PRO 2 20.753 12.113 -12.026 22 HD3 PRO 2 HD1 PRO 2 22.004 10.855 -12.033 23 H VAL 3 HN VAL 3 17.358 8.875 -9.393 24 HA VAL 3 HA VAL 3 15.559 10.975 -10.028 25 HB VAL 3 HB VAL 3 15.396 8.975 -7.763 26 HG11 VAL 3 HG11 VAL 3 13.247 10.660 -9.046 27 HG12 VAL 3 HG12 VAL 3 13.911 10.876 -7.426 28 HG13 VAL 3 HG13 VAL 3 12.989 9.424 -7.814 29 HG21 VAL 3 HG21 VAL 3 14.279 8.853 -10.564 30 HG22 VAL 3 HG22 VAL 3 13.943 7.693 -9.278 31 HG23 VAL 3 HG23 VAL 3 15.581 7.857 -9.911 32 H SER 4 HN SER 4 16.040 12.982 -9.416 33 HA SER 4 HA SER 4 17.233 13.470 -6.802 34 HB2 SER 4 HB2 SER 4 16.680 15.432 -9.040 35 HB3 SER 4 HB1 SER 4 17.710 15.697 -7.632 36 HG SER 4 HG SER 4 18.252 13.508 -9.289 37 H LEU 5 HN LEU 5 14.318 12.861 -7.681 38 HA LEU 5 HA LEU 5 12.949 15.024 -6.284 39 HB2 LEU 5 HB2 LEU 5 11.793 12.508 -7.495 40 HB3 LEU 5 HB1 LEU 5 10.894 13.896 -6.917 41 HG LEU 5 HG LEU 5 12.732 13.873 -9.313 42 HD11 LEU 5 HD11 LEU 5 10.668 12.633 -9.689 43 HD12 LEU 5 HD12 LEU 5 10.680 14.139 -10.604 44 HD13 LEU 5 HD13 LEU 5 9.726 14.015 -9.128 45 HD21 LEU 5 HD21 LEU 5 12.753 16.040 -8.242 46 HD22 LEU 5 HD22 LEU 5 10.993 16.055 -8.167 47 HD23 LEU 5 HD23 LEU 5 11.809 16.125 -9.728 48 H SER 6 HN SER 6 13.885 14.637 -4.256 49 HA SER 6 HA SER 6 13.876 12.025 -3.101 50 HB2 SER 6 HB2 SER 6 15.634 13.799 -2.715 51 HB3 SER 6 HB1 SER 6 14.459 14.637 -1.703 52 HG SER 6 HG SER 6 14.775 13.239 -0.162 53 H TYR 7 HN TYR 7 11.376 12.116 -3.571 54 HA TYR 7 HA TYR 7 9.900 13.009 -1.228 55 HB2 TYR 7 HB2 TYR 7 9.067 11.102 -3.404 56 HB3 TYR 7 HB1 TYR 7 8.002 11.816 -2.209 57 HD1 TYR 7 HD1 TYR 7 7.810 14.412 -2.243 58 HD2 TYR 7 HD2 TYR 7 9.310 12.104 -5.487 59 HE1 TYR 7 HE1 TYR 7 7.296 16.256 -3.787 60 HE2 TYR 7 HE2 TYR 7 8.802 13.942 -7.037 61 HH TYR 7 HH TYR 7 7.299 15.870 -7.166 62 H ARG 8 HN ARG 8 11.395 11.895 0.224 63 HA ARG 8 HA ARG 8 11.590 9.039 0.102 64 HB2 ARG 8 HB2 ARG 8 12.534 10.984 2.207 65 HB3 ARG 8 HB1 ARG 8 12.898 9.260 2.198 66 HG2 ARG 8 HG2 ARG 8 13.959 9.550 -0.021 67 HG3 ARG 8 HG1 ARG 8 13.696 11.285 0.122 68 HD2 ARG 8 HD2 ARG 8 15.105 11.350 2.103 69 HD3 ARG 8 HD1 ARG 8 15.335 9.603 2.011 70 HE ARG 8 HE ARG 8 16.208 11.416 -0.151 71 HH11 ARG 8 HH11 ARG 8 16.876 8.862 2.154 72 HH12 ARG 8 HH12 ARG 8 18.404 8.448 1.449 73 HH21 ARG 8 HH21 ARG 8 18.240 10.863 -1.083 74 HH22 ARG 8 HH22 ARG 8 19.178 9.584 -0.383 75 H CYS 9 HN CYS 9 9.549 8.331 0.210 76 HA CYS 9 HA CYS 9 7.732 8.864 2.317 77 HB2 CYS 9 HB2 CYS 9 7.847 7.257 -0.111 78 HB3 CYS 9 HB1 CYS 9 6.950 6.471 1.187 79 HA PRO 10 HA PRO 10 8.123 6.407 5.861 80 HB2 PRO 10 HB2 PRO 10 6.507 4.275 4.562 81 HB3 PRO 10 HB1 PRO 10 6.358 4.956 6.183 82 HG2 PRO 10 HG2 PRO 10 4.795 5.677 4.053 83 HG3 PRO 10 HG1 PRO 10 5.108 6.711 5.452 84 HD2 PRO 10 HD2 PRO 10 5.971 7.067 2.729 85 HD3 PRO 10 HD1 PRO 10 6.216 8.151 4.109 86 H CYS 11 HN CYS 11 8.104 4.107 3.138 87 HA CYS 11 HA CYS 11 10.119 2.528 4.525 88 HB2 CYS 11 HB2 CYS 11 8.248 1.332 3.495 89 HB3 CYS 11 HB1 CYS 11 8.688 1.979 1.917 90 H ARG 12 HN ARG 12 12.119 2.153 3.885 91 HA ARG 12 HA ARG 12 13.436 3.949 2.099 92 HB2 ARG 12 HB2 ARG 12 14.476 1.488 3.510 93 HB3 ARG 12 HB1 ARG 12 15.467 2.675 2.669 94 HG2 ARG 12 HG2 ARG 12 13.810 3.114 5.143 95 HG3 ARG 12 HG1 ARG 12 15.570 3.117 5.016 96 HD2 ARG 12 HD2 ARG 12 15.533 5.109 3.688 97 HD3 ARG 12 HD1 ARG 12 13.778 5.054 3.569 98 HE ARG 12 HE ARG 12 15.242 5.577 6.074 99 HH11 ARG 12 HH11 ARG 12 12.464 6.035 3.981 100 HH12 ARG 12 HH12 ARG 12 11.743 7.243 4.989 101 HH21 ARG 12 HH21 ARG 12 14.283 7.166 7.407 102 HH22 ARG 12 HH22 ARG 12 12.777 7.891 6.934 103 H PHE 13 HN PHE 13 15.315 2.262 0.814 104 HA PHE 13 HA PHE 13 13.687 1.874 -1.508 105 HB2 PHE 13 HB2 PHE 13 16.605 1.168 -1.107 106 HB3 PHE 13 HB1 PHE 13 15.780 1.353 -2.648 107 HD1 PHE 13 HD1 PHE 13 15.346 3.525 -3.565 108 HD2 PHE 13 HD2 PHE 13 17.175 3.107 0.252 109 HE1 PHE 13 HE1 PHE 13 15.986 5.885 -3.617 110 HE2 PHE 13 HE2 PHE 13 17.815 5.471 0.212 111 HZ PHE 13 HZ PHE 13 17.222 6.874 -1.726 112 H PHE 14 HN PHE 14 13.187 -0.011 -2.522 113 HA PHE 14 HA PHE 14 12.941 -2.204 -0.640 114 HB2 PHE 14 HB2 PHE 14 11.297 -2.630 -2.891 115 HB3 PHE 14 HB1 PHE 14 10.815 -2.152 -1.279 116 HD1 PHE 14 HD1 PHE 14 10.032 -0.003 -0.821 117 HD2 PHE 14 HD2 PHE 14 11.831 -0.839 -4.583 118 HE1 PHE 14 HE1 PHE 14 9.301 2.185 -1.651 119 HE2 PHE 14 HE2 PHE 14 11.100 1.352 -5.423 120 HZ PHE 14 HZ PHE 14 9.830 2.872 -3.957 121 H GLU 15 HN GLU 15 12.783 -4.420 -1.614 122 HA GLU 15 HA GLU 15 15.251 -4.819 -3.116 123 HB2 GLU 15 HB2 GLU 15 13.504 -6.726 -1.567 124 HB3 GLU 15 HB1 GLU 15 15.009 -7.169 -2.355 125 HG2 GLU 15 HG2 GLU 15 14.779 -5.109 -0.181 126 HG3 GLU 15 HG1 GLU 15 15.185 -6.803 0.091 127 H SER 16 HN SER 16 15.072 -5.022 -5.223 128 HA SER 16 HA SER 16 12.579 -5.859 -6.446 129 HB2 SER 16 HB2 SER 16 15.124 -5.274 -7.945 130 HB3 SER 16 HB1 SER 16 13.455 -5.000 -8.448 131 HG SER 16 HG SER 16 13.381 -3.171 -7.317 132 H HIS 17 HN HIS 17 13.963 -7.829 -4.899 133 HA HIS 17 HA HIS 17 14.419 -9.818 -7.010 134 HB2 HIS 17 HB2 HIS 17 16.115 -9.373 -4.555 135 HB3 HIS 17 HB1 HIS 17 16.118 -10.893 -5.439 136 HD1 HIS 17 HD1 HIS 17 17.598 -11.032 -7.465 137 HD2 HIS 17 HD2 HIS 17 17.115 -7.132 -6.106 138 HE1 HIS 17 HE1 HIS 17 19.217 -9.646 -8.797 139 HE2 HIS 17 HE2 HIS 17 18.781 -7.270 -8.078 140 H ILE 18 HN ILE 18 12.575 -8.886 -4.467 141 HA ILE 18 HA ILE 18 12.342 -11.335 -3.029 142 HB ILE 18 HB ILE 18 10.546 -8.917 -3.075 143 HG12 ILE 18 HG12 ILE 18 12.622 -9.821 -1.086 144 HG13 ILE 18 HG11 ILE 18 12.821 -8.511 -2.240 145 HG21 ILE 18 HG21 ILE 18 9.282 -10.872 -2.365 146 HG22 ILE 18 HG22 ILE 18 9.572 -9.790 -1.001 147 HG23 ILE 18 HG23 ILE 18 10.531 -11.261 -1.181 148 HD11 ILE 18 HD11 ILE 18 11.020 -7.280 -1.139 149 HD12 ILE 18 HD12 ILE 18 12.335 -7.654 -0.024 150 HD13 ILE 18 HD13 ILE 18 10.842 -8.589 0.029 151 H ALA 19 HN ALA 19 10.909 -12.938 -3.197 152 HA ALA 19 HA ALA 19 9.117 -12.931 -5.540 153 HB1 ALA 19 HB1 ALA 19 11.060 -14.487 -5.686 154 HB2 ALA 19 HB2 ALA 19 9.491 -15.288 -5.757 155 HB3 ALA 19 HB3 ALA 19 10.429 -15.324 -4.265 156 H ARG 20 HN ARG 20 7.189 -14.181 -5.360 157 HA ARG 20 HA ARG 20 5.681 -13.684 -3.090 158 HB2 ARG 20 HB2 ARG 20 4.865 -15.986 -4.725 159 HB3 ARG 20 HB1 ARG 20 4.025 -14.516 -4.324 160 HG2 ARG 20 HG2 ARG 20 5.282 -13.305 -6.028 161 HG3 ARG 20 HG1 ARG 20 6.069 -14.817 -6.472 162 HD2 ARG 20 HD2 ARG 20 3.103 -14.310 -6.574 163 HD3 ARG 20 HD1 ARG 20 4.190 -14.245 -7.960 164 HE ARG 20 HE ARG 20 4.443 -16.742 -6.669 165 HH11 ARG 20 HH11 ARG 20 2.211 -14.939 -8.684 166 HH12 ARG 20 HH12 ARG 20 1.506 -16.359 -9.385 167 HH21 ARG 20 HH21 ARG 20 3.505 -18.606 -7.589 168 HH22 ARG 20 HH22 ARG 20 2.229 -18.445 -8.754 169 H ALA 21 HN ALA 21 7.394 -16.533 -4.156 170 HA ALA 21 HA ALA 21 6.545 -18.172 -1.951 171 HB1 ALA 21 HB1 ALA 21 7.022 -19.153 -4.140 172 HB2 ALA 21 HB2 ALA 21 8.036 -19.853 -2.879 173 HB3 ALA 21 HB3 ALA 21 8.707 -18.657 -3.987 174 H ASN 22 HN ASN 22 8.679 -15.692 -2.138 175 HA ASN 22 HA ASN 22 10.431 -16.850 -0.103 176 HB2 ASN 22 HB2 ASN 22 10.822 -14.840 -2.239 177 HB3 ASN 22 HB1 ASN 22 11.608 -14.491 -0.711 178 HD21 ASN 22 HD21 ASN 22 13.633 -14.726 -1.605 179 HD22 ASN 22 HD22 ASN 22 14.293 -16.269 -2.018 180 H VAL 23 HN VAL 23 7.789 -14.842 -0.510 181 HA VAL 23 HA VAL 23 8.517 -13.206 1.807 182 HB VAL 23 HB VAL 23 7.876 -11.916 -0.143 183 HG11 VAL 23 HG11 VAL 23 5.252 -13.370 0.065 184 HG12 VAL 23 HG12 VAL 23 6.397 -13.439 -1.276 185 HG13 VAL 23 HG13 VAL 23 5.528 -11.940 -0.931 186 HG21 VAL 23 HG21 VAL 23 5.751 -11.769 1.954 187 HG22 VAL 23 HG22 VAL 23 6.279 -10.475 0.874 188 HG23 VAL 23 HG23 VAL 23 7.378 -11.111 2.106 189 H LYS 24 HN LYS 24 7.246 -12.935 3.502 190 HA LYS 24 HA LYS 24 5.094 -14.854 3.989 191 HB2 LYS 24 HB2 LYS 24 6.662 -13.240 6.012 192 HB3 LYS 24 HB1 LYS 24 5.537 -14.548 6.350 193 HG2 LYS 24 HG2 LYS 24 7.083 -16.012 4.953 194 HG3 LYS 24 HG1 LYS 24 8.230 -14.694 5.087 195 HD2 LYS 24 HD2 LYS 24 6.997 -16.025 7.452 196 HD3 LYS 24 HD1 LYS 24 8.506 -16.550 6.779 197 HE2 LYS 24 HE2 LYS 24 9.486 -14.399 7.227 198 HE3 LYS 24 HE1 LYS 24 7.930 -13.784 7.766 199 HZ1 LYS 24 HZ1 LYS 24 7.983 -15.389 9.590 200 HZ2 LYS 24 HZ2 LYS 24 9.321 -14.362 9.650 201 HZ3 LYS 24 HZ3 LYS 24 9.495 -15.942 9.074 202 H HIS 25 HN HIS 25 4.084 -13.237 6.212 203 HA HIS 25 HA HIS 25 1.874 -12.103 5.205 204 HB2 HIS 25 HB2 HIS 25 3.246 -10.427 7.266 205 HB3 HIS 25 HB1 HIS 25 1.557 -10.882 7.157 206 HD1 HIS 25 HD1 HIS 25 2.771 -11.039 9.817 207 HD2 HIS 25 HD2 HIS 25 3.023 -14.228 7.160 208 HE1 HIS 25 HE1 HIS 25 3.220 -13.058 11.227 209 HE2 HIS 25 HE2 HIS 25 3.261 -14.999 9.620 210 H LEU 26 HN LEU 26 1.439 -10.568 3.732 211 HA LEU 26 HA LEU 26 3.473 -8.493 3.299 212 HB2 LEU 26 HB2 LEU 26 3.307 -10.002 1.414 213 HB3 LEU 26 HB1 LEU 26 1.575 -9.741 1.308 214 HG LEU 26 HG LEU 26 1.901 -7.472 0.559 215 HD11 LEU 26 HD11 LEU 26 4.068 -6.460 0.363 216 HD12 LEU 26 HD12 LEU 26 4.851 -7.941 0.903 217 HD13 LEU 26 HD13 LEU 26 3.855 -7.018 2.015 218 HD21 LEU 26 HD21 LEU 26 2.410 -9.574 -0.983 219 HD22 LEU 26 HD22 LEU 26 4.030 -8.849 -1.013 220 HD23 LEU 26 HD23 LEU 26 2.628 -7.923 -1.566 221 H LYS 27 HN LYS 27 2.938 -6.440 3.358 222 HA LYS 27 HA LYS 27 0.119 -5.631 3.542 223 HB2 LYS 27 HB2 LYS 27 0.771 -5.745 5.827 224 HB3 LYS 27 HB1 LYS 27 2.356 -5.082 5.478 225 HG2 LYS 27 HG2 LYS 27 1.062 -3.432 6.619 226 HG3 LYS 27 HG1 LYS 27 1.311 -2.921 4.946 227 HD2 LYS 27 HD2 LYS 27 -0.973 -2.467 5.552 228 HD3 LYS 27 HD1 LYS 27 -0.955 -3.811 4.415 229 HE2 LYS 27 HE2 LYS 27 -1.142 -5.380 6.308 230 HE3 LYS 27 HE1 LYS 27 -1.237 -4.007 7.408 231 HZ1 LYS 27 HZ1 LYS 27 -3.245 -3.290 6.209 232 HZ2 LYS 27 HZ2 LYS 27 -3.430 -4.808 6.929 233 HZ3 LYS 27 HZ3 LYS 27 -3.170 -4.691 5.263 234 H ILE 28 HN ILE 28 -0.251 -3.526 2.730 235 HA ILE 28 HA ILE 28 2.069 -2.377 1.328 236 HB ILE 28 HB ILE 28 -0.814 -1.929 0.579 237 HG12 ILE 28 HG12 ILE 28 -0.385 -4.295 0.378 238 HG13 ILE 28 HG11 ILE 28 -0.404 -3.587 -1.226 239 HG21 ILE 28 HG21 ILE 28 1.780 -1.498 -0.907 240 HG22 ILE 28 HG22 ILE 28 0.733 -0.246 -0.236 241 HG23 ILE 28 HG23 ILE 28 0.166 -1.242 -1.576 242 HD11 ILE 28 HD11 ILE 28 2.036 -4.341 0.343 243 HD12 ILE 28 HD12 ILE 28 2.032 -3.598 -1.257 244 HD13 ILE 28 HD13 ILE 28 1.357 -5.216 -1.032 245 H LEU 29 HN LEU 29 2.626 -0.337 1.674 246 HA LEU 29 HA LEU 29 1.270 1.097 3.802 247 HB2 LEU 29 HB2 LEU 29 3.861 0.903 3.324 248 HB3 LEU 29 HB1 LEU 29 3.553 2.253 2.244 249 HG LEU 29 HG LEU 29 4.357 3.086 4.356 250 HD11 LEU 29 HD11 LEU 29 1.401 3.612 4.005 251 HD12 LEU 29 HD12 LEU 29 2.745 4.514 3.296 252 HD13 LEU 29 HD13 LEU 29 2.483 4.554 5.038 253 HD21 LEU 29 HD21 LEU 29 3.167 2.713 6.447 254 HD22 LEU 29 HD22 LEU 29 3.740 1.196 5.756 255 HD23 LEU 29 HD23 LEU 29 2.038 1.640 5.623 256 H ASN 30 HN ASN 30 -0.388 2.364 3.363 257 HA ASN 30 HA ASN 30 -0.795 3.534 0.775 258 HB2 ASN 30 HB2 ASN 30 -2.231 3.490 3.362 259 HB3 ASN 30 HB1 ASN 30 -2.511 4.887 2.333 260 HD21 ASN 30 HD21 ASN 30 -4.614 4.367 1.841 261 HD22 ASN 30 HD22 ASN 30 -5.041 3.024 0.838 262 H THR 31 HN THR 31 0.873 4.834 0.304 263 HA THR 31 HA THR 31 1.917 6.732 2.177 264 HB THR 31 HB THR 31 3.284 7.321 0.090 265 HG1 THR 31 HG1 THR 31 2.980 4.820 -0.920 266 HG21 THR 31 HG21 THR 31 3.501 4.601 1.361 267 HG22 THR 31 HG22 THR 31 4.156 6.108 2.007 268 HG23 THR 31 HG23 THR 31 4.794 5.440 0.505 269 HA PRO 32 HA PRO 32 0.445 10.737 0.920 270 HB2 PRO 32 HB2 PRO 32 2.945 11.430 -0.306 271 HB3 PRO 32 HB1 PRO 32 2.181 12.026 1.161 272 HG2 PRO 32 HG2 PRO 32 4.325 10.151 0.923 273 HG3 PRO 32 HG1 PRO 32 3.610 10.866 2.368 274 HD2 PRO 32 HD2 PRO 32 3.415 8.222 1.579 275 HD3 PRO 32 HD1 PRO 32 2.434 9.029 2.786 276 H ASN 33 HN ASN 33 0.886 8.394 -1.240 277 HA ASN 33 HA ASN 33 0.448 8.082 -3.438 278 HB2 ASN 33 HB2 ASN 33 0.576 11.083 -3.771 279 HB3 ASN 33 HB1 ASN 33 0.241 9.938 -5.057 280 HD21 ASN 33 HD21 ASN 33 -0.970 9.729 -1.769 281 HD22 ASN 33 HD22 ASN 33 -2.624 10.026 -2.145 282 H CYS 34 HN CYS 34 2.658 7.669 -2.248 283 HA CYS 34 HA CYS 34 4.789 8.248 -4.150 284 HB2 CYS 34 HB2 CYS 34 4.595 6.874 -1.474 285 HB3 CYS 34 HB1 CYS 34 5.990 6.630 -2.484 286 H ALA 35 HN ALA 35 5.972 6.086 -4.811 287 HA ALA 35 HA ALA 35 4.303 4.201 -5.986 288 HB1 ALA 35 HB1 ALA 35 7.048 3.722 -4.815 289 HB2 ALA 35 HB2 ALA 35 6.711 4.305 -6.447 290 HB3 ALA 35 HB3 ALA 35 6.217 2.678 -5.971 291 H LEU 36 HN LEU 36 3.174 2.466 -5.205 292 HA LEU 36 HA LEU 36 2.472 2.397 -2.500 293 HB2 LEU 36 HB2 LEU 36 2.092 0.514 -4.803 294 HB3 LEU 36 HB1 LEU 36 1.632 0.023 -3.191 295 HG LEU 36 HG LEU 36 -0.295 0.852 -4.411 296 HD11 LEU 36 HD11 LEU 36 0.550 2.780 -2.255 297 HD12 LEU 36 HD12 LEU 36 -0.215 1.211 -1.997 298 HD13 LEU 36 HD13 LEU 36 -1.099 2.499 -2.816 299 HD21 LEU 36 HD21 LEU 36 -0.450 3.200 -5.097 300 HD22 LEU 36 HD22 LEU 36 0.825 2.346 -5.964 301 HD23 LEU 36 HD23 LEU 36 1.239 3.438 -4.643 302 H GLN 37 HN GLN 37 3.741 1.848 -0.882 303 HA GLN 37 HA GLN 37 6.127 0.322 -1.399 304 HB2 GLN 37 HB2 GLN 37 5.279 1.186 1.341 305 HB3 GLN 37 HB1 GLN 37 6.899 1.059 0.669 306 HG2 GLN 37 HG2 GLN 37 6.090 2.982 -0.896 307 HG3 GLN 37 HG1 GLN 37 4.878 3.225 0.356 308 HE21 GLN 37 HE21 GLN 37 8.199 3.481 -0.491 309 HE22 GLN 37 HE22 GLN 37 8.707 4.343 0.915 310 H ILE 38 HN ILE 38 6.160 -1.757 -1.335 311 HA ILE 38 HA ILE 38 3.962 -3.248 -0.165 312 HB ILE 38 HB ILE 38 6.287 -4.457 -1.635 313 HG12 ILE 38 HG12 ILE 38 5.534 -2.491 -2.969 314 HG13 ILE 38 HG11 ILE 38 5.269 -4.025 -3.785 315 HG21 ILE 38 HG21 ILE 38 3.527 -5.212 -0.949 316 HG22 ILE 38 HG22 ILE 38 4.985 -6.212 -1.136 317 HG23 ILE 38 HG23 ILE 38 4.081 -5.683 -2.556 318 HD11 ILE 38 HD11 ILE 38 2.907 -3.930 -3.176 319 HD12 ILE 38 HD12 ILE 38 3.406 -2.517 -4.107 320 HD13 ILE 38 HD13 ILE 38 3.184 -2.389 -2.363 321 H VAL 39 HN VAL 39 4.306 -3.476 2.066 322 HA VAL 39 HA VAL 39 7.055 -3.981 2.920 323 HB VAL 39 HB VAL 39 5.528 -2.212 4.049 324 HG11 VAL 39 HG11 VAL 39 3.597 -3.593 4.478 325 HG12 VAL 39 HG12 VAL 39 4.281 -2.977 5.983 326 HG13 VAL 39 HG13 VAL 39 4.564 -4.651 5.507 327 HG21 VAL 39 HG21 VAL 39 6.676 -2.572 6.197 328 HG22 VAL 39 HG22 VAL 39 7.753 -2.773 4.816 329 HG23 VAL 39 HG23 VAL 39 7.134 -4.192 5.664 330 H ALA 40 HN ALA 40 7.734 -5.876 3.395 331 HA ALA 40 HA ALA 40 5.802 -8.067 3.747 332 HB1 ALA 40 HB1 ALA 40 8.313 -8.209 2.087 333 HB2 ALA 40 HB2 ALA 40 6.730 -7.828 1.414 334 HB3 ALA 40 HB3 ALA 40 7.007 -9.393 2.174 335 H ARG 41 HN ARG 41 6.641 -9.903 4.867 336 HA ARG 41 HA ARG 41 9.223 -9.461 6.209 337 HB2 ARG 41 HB2 ARG 41 6.818 -11.094 7.002 338 HB3 ARG 41 HB1 ARG 41 8.398 -11.333 7.740 339 HG2 ARG 41 HG2 ARG 41 7.569 -8.543 7.672 340 HG3 ARG 41 HG1 ARG 41 6.500 -9.575 8.605 341 HD2 ARG 41 HD2 ARG 41 9.461 -9.681 8.956 342 HD3 ARG 41 HD1 ARG 41 8.487 -8.479 9.800 343 HE ARG 41 HE ARG 41 7.590 -11.211 10.111 344 HH11 ARG 41 HH11 ARG 41 9.643 -8.675 11.373 345 HH12 ARG 41 HH12 ARG 41 9.653 -9.308 12.986 346 HH21 ARG 41 HH21 ARG 41 7.610 -12.052 12.248 347 HH22 ARG 41 HH22 ARG 41 8.512 -11.223 13.480 348 H LEU 42 HN LEU 42 10.866 -10.728 5.595 349 HA LEU 42 HA LEU 42 10.436 -12.439 3.347 350 HB2 LEU 42 HB2 LEU 42 12.838 -11.743 4.999 351 HB3 LEU 42 HB1 LEU 42 12.926 -12.954 3.736 352 HG LEU 42 HG LEU 42 12.033 -10.117 3.265 353 HD11 LEU 42 HD11 LEU 42 14.253 -9.750 2.297 354 HD12 LEU 42 HD12 LEU 42 14.744 -11.363 2.814 355 HD13 LEU 42 HD13 LEU 42 14.356 -10.131 4.016 356 HD21 LEU 42 HD21 LEU 42 12.849 -12.330 1.389 357 HD22 LEU 42 HD22 LEU 42 12.442 -10.681 0.917 358 HD23 LEU 42 HD23 LEU 42 11.212 -11.721 1.633 359 H LYS 43 HN LYS 43 10.211 -14.528 3.226 360 HA LYS 43 HA LYS 43 9.482 -16.025 5.496 361 HB2 LYS 43 HB2 LYS 43 8.551 -16.648 3.413 362 HB3 LYS 43 HB1 LYS 43 10.128 -16.763 2.657 363 HG2 LYS 43 HG2 LYS 43 10.634 -18.729 4.028 364 HG3 LYS 43 HG1 LYS 43 9.023 -18.625 4.739 365 HD2 LYS 43 HD2 LYS 43 7.993 -19.048 2.618 366 HD3 LYS 43 HD1 LYS 43 9.547 -18.936 1.784 367 HE2 LYS 43 HE2 LYS 43 8.896 -21.263 2.060 368 HE3 LYS 43 HE1 LYS 43 10.334 -20.904 3.019 369 HZ1 LYS 43 HZ1 LYS 43 8.982 -20.760 4.984 370 HZ2 LYS 43 HZ2 LYS 43 8.692 -22.245 4.228 371 HZ3 LYS 43 HZ3 LYS 43 7.565 -20.992 4.089 372 H ASN 44 HN ASN 44 12.443 -15.772 3.651 373 HA ASN 44 HA ASN 44 13.759 -17.890 5.090 374 HB2 ASN 44 HB2 ASN 44 14.812 -15.885 3.109 375 HB3 ASN 44 HB1 ASN 44 15.744 -17.219 3.766 376 HD21 ASN 44 HD21 ASN 44 15.073 -16.642 1.006 377 HD22 ASN 44 HD22 ASN 44 14.197 -18.012 0.418 378 H ASN 45 HN ASN 45 13.707 -14.381 5.090 379 HA ASN 45 HA ASN 45 16.067 -14.298 6.788 380 HB2 ASN 45 HB2 ASN 45 15.628 -12.837 4.681 381 HB3 ASN 45 HB1 ASN 45 14.645 -11.877 5.772 382 HD21 ASN 45 HD21 ASN 45 17.023 -11.117 4.354 383 HD22 ASN 45 HD22 ASN 45 18.179 -10.638 5.547 384 H ASN 46 HN ASN 46 12.619 -13.805 6.979 385 HA ASN 46 HA ASN 46 11.228 -13.436 8.730 386 HB2 ASN 46 HB2 ASN 46 13.056 -14.782 9.993 387 HB3 ASN 46 HB1 ASN 46 13.555 -13.216 10.617 388 HD21 ASN 46 HD21 ASN 46 11.204 -15.720 10.732 389 HD22 ASN 46 HD22 ASN 46 10.289 -15.092 12.060 390 H ARG 47 HN ARG 47 13.373 -11.324 7.546 391 HA ARG 47 HA ARG 47 12.877 -9.153 9.398 392 HB2 ARG 47 HB2 ARG 47 14.532 -9.385 6.899 393 HB3 ARG 47 HB1 ARG 47 14.270 -7.854 7.715 394 HG2 ARG 47 HG2 ARG 47 15.321 -8.745 9.729 395 HG3 ARG 47 HG1 ARG 47 15.596 -10.279 8.902 396 HD2 ARG 47 HD2 ARG 47 17.596 -8.938 8.853 397 HD3 ARG 47 HD1 ARG 47 16.945 -9.132 7.228 398 HE ARG 47 HE ARG 47 15.867 -6.788 8.016 399 HH11 ARG 47 HH11 ARG 47 19.163 -7.982 8.033 400 HH12 ARG 47 HH12 ARG 47 19.861 -6.414 7.784 401 HH21 ARG 47 HH21 ARG 47 16.785 -4.728 7.690 402 HH22 ARG 47 HH22 ARG 47 18.513 -4.564 7.588 403 H GLN 48 HN GLN 48 11.693 -7.426 9.015 404 HA GLN 48 HA GLN 48 9.741 -7.393 6.950 405 HB2 GLN 48 HB2 GLN 48 9.596 -6.304 9.257 406 HB3 GLN 48 HB1 GLN 48 10.601 -5.022 8.605 407 HG2 GLN 48 HG2 GLN 48 8.916 -4.611 6.879 408 HG3 GLN 48 HG1 GLN 48 7.900 -5.859 7.600 409 HE21 GLN 48 HE21 GLN 48 6.246 -4.522 8.125 410 HE22 GLN 48 HE22 GLN 48 6.344 -3.300 9.343 411 H VAL 49 HN VAL 49 9.862 -6.446 5.019 412 HA VAL 49 HA VAL 49 12.019 -4.624 4.305 413 HB VAL 49 HB VAL 49 12.911 -6.970 4.006 414 HG11 VAL 49 HG11 VAL 49 10.781 -7.132 1.882 415 HG12 VAL 49 HG12 VAL 49 10.863 -8.085 3.364 416 HG13 VAL 49 HG13 VAL 49 12.089 -8.293 2.113 417 HG21 VAL 49 HG21 VAL 49 13.843 -5.118 2.730 418 HG22 VAL 49 HG22 VAL 49 12.619 -5.348 1.482 419 HG23 VAL 49 HG23 VAL 49 13.830 -6.598 1.772 420 H CYS 50 HN CYS 50 11.628 -3.832 1.990 421 HA CYS 50 HA CYS 50 8.782 -4.036 1.368 422 HB2 CYS 50 HB2 CYS 50 10.803 -1.887 0.815 423 HB3 CYS 50 HB1 CYS 50 9.308 -1.993 -0.096 424 H ILE 51 HN ILE 51 8.123 -4.873 -0.456 425 HA ILE 51 HA ILE 51 10.019 -6.023 -2.321 426 HB ILE 51 HB ILE 51 7.094 -5.923 -2.925 427 HG12 ILE 51 HG12 ILE 51 8.285 -7.658 -0.746 428 HG13 ILE 51 HG11 ILE 51 7.076 -6.394 -0.529 429 HG21 ILE 51 HG21 ILE 51 7.469 -7.864 -4.070 430 HG22 ILE 51 HG22 ILE 51 8.753 -8.384 -2.984 431 HG23 ILE 51 HG23 ILE 51 9.073 -7.135 -4.187 432 HD11 ILE 51 HD11 ILE 51 6.729 -9.010 -1.974 433 HD12 ILE 51 HD12 ILE 51 5.526 -7.727 -1.949 434 HD13 ILE 51 HD13 ILE 51 5.994 -8.527 -0.449 435 H ASP 52 HN ASP 52 10.402 -5.265 -4.385 436 HA ASP 52 HA ASP 52 10.021 -2.522 -4.906 437 HB2 ASP 52 HB2 ASP 52 11.827 -3.967 -5.892 438 HB3 ASP 52 HB1 ASP 52 10.610 -4.678 -6.939 439 HA PRO 53 HA PRO 53 5.742 -2.685 -5.993 440 HB2 PRO 53 HB2 PRO 53 5.578 -0.212 -7.140 441 HB3 PRO 53 HB1 PRO 53 5.576 -0.496 -5.396 442 HG2 PRO 53 HG2 PRO 53 7.840 0.304 -7.182 443 HG3 PRO 53 HG1 PRO 53 7.404 0.924 -5.577 444 HD2 PRO 53 HD2 PRO 53 9.378 -0.851 -5.894 445 HD3 PRO 53 HD1 PRO 53 8.303 -0.913 -4.489 446 H LYS 54 HN LYS 54 8.309 -2.377 -8.239 447 HA LYS 54 HA LYS 54 6.463 -2.451 -10.508 448 HB2 LYS 54 HB2 LYS 54 9.355 -1.694 -10.327 449 HB3 LYS 54 HB1 LYS 54 8.514 -1.918 -11.860 450 HG2 LYS 54 HG2 LYS 54 6.900 -0.201 -11.229 451 HG3 LYS 54 HG1 LYS 54 7.741 0.016 -9.698 452 HD2 LYS 54 HD2 LYS 54 9.014 0.398 -12.383 453 HD3 LYS 54 HD1 LYS 54 8.300 1.713 -11.449 454 HE2 LYS 54 HE2 LYS 54 9.857 1.158 -9.601 455 HE3 LYS 54 HE1 LYS 54 10.600 -0.048 -10.647 456 HZ1 LYS 54 HZ1 LYS 54 11.170 1.728 -12.203 457 HZ2 LYS 54 HZ2 LYS 54 11.858 1.994 -10.682 458 HZ3 LYS 54 HZ3 LYS 54 10.495 2.872 -11.155 459 H LEU 55 HN LEU 55 8.018 -4.563 -8.591 460 HA LEU 55 HA LEU 55 9.088 -6.503 -10.258 461 HB2 LEU 55 HB2 LEU 55 7.815 -6.384 -7.601 462 HB3 LEU 55 HB1 LEU 55 7.900 -7.977 -8.335 463 HG LEU 55 HG LEU 55 10.293 -6.180 -8.023 464 HD11 LEU 55 HD11 LEU 55 9.243 -8.293 -6.159 465 HD12 LEU 55 HD12 LEU 55 9.512 -6.582 -5.819 466 HD13 LEU 55 HD13 LEU 55 10.885 -7.650 -6.103 467 HD21 LEU 55 HD21 LEU 55 11.501 -8.313 -8.297 468 HD22 LEU 55 HD22 LEU 55 10.542 -7.856 -9.706 469 HD23 LEU 55 HD23 LEU 55 9.954 -9.105 -8.610 470 H LYS 56 HN LYS 56 8.233 -8.249 -11.325 471 HA LYS 56 HA LYS 56 6.006 -7.554 -12.878 472 HB2 LYS 56 HB2 LYS 56 7.350 -10.257 -12.664 473 HB3 LYS 56 HB1 LYS 56 6.328 -9.712 -13.983 474 HG2 LYS 56 HG2 LYS 56 8.974 -8.499 -13.216 475 HG3 LYS 56 HG1 LYS 56 8.709 -9.628 -14.545 476 HD2 LYS 56 HD2 LYS 56 7.341 -6.956 -14.302 477 HD3 LYS 56 HD1 LYS 56 8.815 -7.228 -15.225 478 HE2 LYS 56 HE2 LYS 56 7.636 -8.865 -16.617 479 HE3 LYS 56 HE1 LYS 56 6.162 -8.581 -15.693 480 HZ1 LYS 56 HZ1 LYS 56 6.183 -7.336 -17.764 481 HZ2 LYS 56 HZ2 LYS 56 7.600 -6.541 -17.296 482 HZ3 LYS 56 HZ3 LYS 56 6.168 -6.294 -16.432 483 H TRP 57 HN TRP 57 6.316 -9.707 -10.120 484 HA TRP 57 HA TRP 57 3.566 -10.590 -10.454 485 HB2 TRP 57 HB2 TRP 57 3.964 -12.060 -8.607 486 HB3 TRP 57 HB1 TRP 57 5.362 -12.145 -9.654 487 HD1 TRP 57 HD1 TRP 57 7.646 -11.199 -8.695 488 HE1 TRP 57 HE1 TRP 57 8.447 -10.721 -6.286 489 HE3 TRP 57 HE3 TRP 57 3.121 -11.197 -6.381 490 HZ2 TRP 57 HZ2 TRP 57 7.265 -10.407 -3.727 491 HZ3 TRP 57 HZ3 TRP 57 3.019 -10.793 -3.968 492 HH2 TRP 57 HH2 TRP 57 5.049 -10.413 -2.659 493 H ILE 58 HN ILE 58 5.388 -8.212 -8.790 494 HA ILE 58 HA ILE 58 3.506 -7.664 -6.713 495 HB ILE 58 HB ILE 58 5.848 -6.159 -7.849 496 HG12 ILE 58 HG12 ILE 58 6.236 -8.133 -6.384 497 HG13 ILE 58 HG11 ILE 58 6.853 -6.632 -5.702 498 HG21 ILE 58 HG21 ILE 58 4.143 -4.543 -7.206 499 HG22 ILE 58 HG22 ILE 58 5.548 -4.484 -6.135 500 HG23 ILE 58 HG23 ILE 58 4.065 -5.269 -5.598 501 HD11 ILE 58 HD11 ILE 58 5.051 -6.493 -4.176 502 HD12 ILE 58 HD12 ILE 58 5.680 -8.139 -4.098 503 HD13 ILE 58 HD13 ILE 58 4.193 -7.805 -4.975 504 H GLN 59 HN GLN 59 4.161 -6.318 -9.915 505 HA GLN 59 HA GLN 59 2.332 -4.227 -9.998 506 HB2 GLN 59 HB2 GLN 59 3.206 -6.214 -12.050 507 HB3 GLN 59 HB1 GLN 59 2.183 -4.852 -12.468 508 HG2 GLN 59 HG2 GLN 59 4.880 -4.602 -11.190 509 HG3 GLN 59 HG1 GLN 59 4.635 -4.611 -12.931 510 HE21 GLN 59 HE21 GLN 59 4.208 -2.787 -9.994 511 HE22 GLN 59 HE22 GLN 59 3.778 -1.298 -10.762 512 H GLU 60 HN GLU 60 1.851 -7.643 -10.217 513 HA GLU 60 HA GLU 60 -0.907 -7.511 -10.957 514 HB2 GLU 60 HB2 GLU 60 0.724 -9.760 -9.763 515 HB3 GLU 60 HB1 GLU 60 -0.899 -9.925 -10.413 516 HG2 GLU 60 HG2 GLU 60 1.523 -9.066 -11.978 517 HG3 GLU 60 HG1 GLU 60 0.823 -10.685 -11.979 518 H TYR 61 HN TYR 61 0.903 -7.732 -7.956 519 HA TYR 61 HA TYR 61 -1.408 -8.195 -6.318 520 HB2 TYR 61 HB2 TYR 61 0.849 -8.922 -5.616 521 HB3 TYR 61 HB1 TYR 61 1.391 -7.255 -5.601 522 HD1 TYR 61 HD1 TYR 61 0.106 -9.881 -3.662 523 HD2 TYR 61 HD2 TYR 61 0.093 -5.656 -4.029 524 HE1 TYR 61 HE1 TYR 61 -0.541 -9.682 -1.311 525 HE2 TYR 61 HE2 TYR 61 -0.577 -5.451 -1.673 526 HH TYR 61 HH TYR 61 -1.643 -6.754 0.058 527 H LEU 62 HN LEU 62 0.473 -5.566 -7.490 528 HA LEU 62 HA LEU 62 -0.329 -3.412 -6.004 529 HB2 LEU 62 HB2 LEU 62 0.994 -3.911 -8.426 530 HB3 LEU 62 HB1 LEU 62 -0.241 -2.710 -8.772 531 HG LEU 62 HG LEU 62 0.762 -1.507 -6.669 532 HD11 LEU 62 HD11 LEU 62 3.107 -1.893 -6.360 533 HD12 LEU 62 HD12 LEU 62 3.109 -3.099 -7.652 534 HD13 LEU 62 HD13 LEU 62 2.242 -3.423 -6.150 535 HD21 LEU 62 HD21 LEU 62 2.155 -1.562 -9.344 536 HD22 LEU 62 HD22 LEU 62 2.278 -0.277 -8.141 537 HD23 LEU 62 HD23 LEU 62 0.737 -0.597 -8.935 538 H GLU 63 HN GLU 63 -1.870 -4.840 -8.816 539 HA GLU 63 HA GLU 63 -3.861 -3.029 -9.309 540 HB2 GLU 63 HB2 GLU 63 -4.151 -6.013 -9.290 541 HB3 GLU 63 HB1 GLU 63 -5.134 -4.885 -10.193 542 HG2 GLU 63 HG2 GLU 63 -3.258 -4.251 -11.526 543 HG3 GLU 63 HG1 GLU 63 -2.197 -5.275 -10.571 544 H LYS 64 HN LYS 64 -3.855 -5.655 -7.009 545 HA LYS 64 HA LYS 64 -6.475 -5.174 -5.984 546 HB2 LYS 64 HB2 LYS 64 -4.175 -6.836 -4.988 547 HB3 LYS 64 HB1 LYS 64 -5.764 -6.821 -4.234 548 HG2 LYS 64 HG2 LYS 64 -5.922 -8.677 -5.577 549 HG3 LYS 64 HG1 LYS 64 -6.596 -7.424 -6.616 550 HD2 LYS 64 HD2 LYS 64 -4.377 -7.178 -7.686 551 HD3 LYS 64 HD1 LYS 64 -3.805 -8.541 -6.725 552 HE2 LYS 64 HE2 LYS 64 -5.464 -9.990 -7.757 553 HE3 LYS 64 HE1 LYS 64 -6.108 -8.630 -8.673 554 HZ1 LYS 64 HZ1 LYS 64 -4.018 -8.448 -9.850 555 HZ2 LYS 64 HZ2 LYS 64 -4.617 -10.027 -9.994 556 HZ3 LYS 64 HZ3 LYS 64 -3.351 -9.701 -8.924 557 H ALA 65 HN ALA 65 -3.195 -4.435 -5.008 558 HA ALA 65 HA ALA 65 -3.750 -3.362 -2.467 559 HB1 ALA 65 HB1 ALA 65 -1.513 -2.363 -2.643 560 HB2 ALA 65 HB2 ALA 65 -1.480 -2.784 -4.357 561 HB3 ALA 65 HB3 ALA 65 -1.523 -4.057 -3.139 562 H LEU 66 HN LEU 66 -3.964 -2.089 -5.659 563 HA LEU 66 HA LEU 66 -4.179 0.673 -4.763 564 HB2 LEU 66 HB2 LEU 66 -4.102 -0.703 -7.395 565 HB3 LEU 66 HB1 LEU 66 -4.897 0.858 -7.317 566 HG LEU 66 HG LEU 66 -2.849 1.868 -6.456 567 HD11 LEU 66 HD11 LEU 66 -1.955 -0.071 -5.297 568 HD12 LEU 66 HD12 LEU 66 -0.766 0.588 -6.429 569 HD13 LEU 66 HD13 LEU 66 -1.673 -0.872 -6.841 570 HD21 LEU 66 HD21 LEU 66 -2.436 0.272 -8.975 571 HD22 LEU 66 HD22 LEU 66 -1.505 1.689 -8.492 572 HD23 LEU 66 HD23 LEU 66 -3.223 1.846 -8.857 573 H ASN 67 HN ASN 67 -6.198 -1.961 -5.404 574 HA ASN 67 HA ASN 67 -8.609 -0.454 -5.618 575 HB2 ASN 67 HB2 ASN 67 -7.918 -3.310 -5.691 576 HB3 ASN 67 HB1 ASN 67 -9.531 -2.899 -5.190 577 HD21 ASN 67 HD21 ASN 67 -7.255 -2.888 -7.802 578 HD22 ASN 67 HD22 ASN 67 -8.411 -2.565 -9.050 579 H LYS 68 HN LYS 68 -9.958 -0.060 -4.123 580 HA LYS 68 HA LYS 68 -10.967 0.223 -2.102 581 HB2 LYS 68 HB2 LYS 68 -9.453 -2.275 -1.329 582 HB3 LYS 68 HB1 LYS 68 -10.717 -1.524 -0.370 583 HG2 LYS 68 HG2 LYS 68 -12.351 -1.977 -2.082 584 HG3 LYS 68 HG1 LYS 68 -11.100 -2.630 -3.141 585 HD2 LYS 68 HD2 LYS 68 -10.666 -4.418 -1.564 586 HD3 LYS 68 HD1 LYS 68 -11.857 -3.752 -0.444 587 HE2 LYS 68 HE2 LYS 68 -12.387 -4.824 -3.206 588 HE3 LYS 68 HE1 LYS 68 -12.772 -5.632 -1.689 589 HZ1 LYS 68 HZ1 LYS 68 -13.942 -3.074 -2.644 590 HZ2 LYS 68 HZ2 LYS 68 -14.290 -3.812 -1.165 591 HZ3 LYS 68 HZ3 LYS 68 -14.720 -4.573 -2.610 592 H GLY 69 HN GLY 69 -8.025 -1.225 -0.804 593 HA2 GLY 69 HA2 GLY 69 -6.437 -0.392 0.616 594 HA3 GLY 69 HA1 GLY 69 -6.736 1.188 -0.096 595 H ARG 70 HN ARG 70 -7.837 2.671 1.043 596 HA ARG 70 HA ARG 70 -9.719 1.976 3.079 597 HB2 ARG 70 HB2 ARG 70 -7.595 1.629 4.312 598 HB3 ARG 70 HB1 ARG 70 -7.142 3.293 3.962 599 HG2 ARG 70 HG2 ARG 70 -9.105 4.073 5.210 600 HG3 ARG 70 HG1 ARG 70 -9.510 2.398 5.592 601 HD2 ARG 70 HD2 ARG 70 -7.338 2.166 6.730 602 HD3 ARG 70 HD1 ARG 70 -7.003 3.866 6.397 603 HE ARG 70 HE ARG 70 -9.462 3.696 7.718 604 HH11 ARG 70 HH11 ARG 70 -6.059 3.178 8.345 605 HH12 ARG 70 HH12 ARG 70 -6.194 3.495 10.046 606 HH21 ARG 70 HH21 ARG 70 -9.641 4.127 9.953 607 HH22 ARG 70 HH22 ARG 70 -8.232 4.031 10.959 608 H ARG 71 HN ARG 71 -7.480 4.575 2.159 609 HA ARG 71 HA ARG 71 -9.711 6.297 1.461 610 HB2 ARG 71 HB2 ARG 71 -9.306 6.685 3.898 611 HB3 ARG 71 HB1 ARG 71 -7.655 7.140 3.516 612 HG2 ARG 71 HG2 ARG 71 -8.681 9.184 3.708 613 HG3 ARG 71 HG1 ARG 71 -8.765 8.903 1.970 614 HD2 ARG 71 HD2 ARG 71 -10.981 8.315 3.926 615 HD3 ARG 71 HD1 ARG 71 -10.878 9.762 2.933 616 HE ARG 71 HE ARG 71 -10.992 8.194 0.981 617 HH11 ARG 71 HH11 ARG 71 -12.319 7.273 4.096 618 HH12 ARG 71 HH12 ARG 71 -13.541 6.253 3.410 619 HH21 ARG 71 HH21 ARG 71 -12.599 6.849 0.087 620 HH22 ARG 71 HH22 ARG 71 -13.696 6.008 1.134 621 H GLU 72 HN GLU 72 -9.176 7.340 -0.368 622 HA GLU 72 HA GLU 72 -6.417 7.299 -1.257 623 HB2 GLU 72 HB2 GLU 72 -8.957 8.248 -2.589 624 HB3 GLU 72 HB1 GLU 72 -7.370 8.329 -3.341 625 HG2 GLU 72 HG2 GLU 72 -7.188 5.873 -3.119 626 HG3 GLU 72 HG1 GLU 72 -8.832 5.841 -2.486 627 H GLU 73 HN GLU 73 -5.497 8.706 0.257 628 HA GLU 73 HA GLU 73 -6.461 11.386 0.577 629 HB2 GLU 73 HB2 GLU 73 -5.305 10.125 2.378 630 HB3 GLU 73 HB1 GLU 73 -3.829 10.170 1.429 631 HG2 GLU 73 HG2 GLU 73 -3.908 11.850 3.236 632 HG3 GLU 73 HG1 GLU 73 -3.690 12.546 1.630 633 H LYS 74 HN LYS 74 -5.174 13.283 0.109 634 HA LYS 74 HA LYS 74 -4.342 13.252 -2.642 635 HB2 LYS 74 HB2 LYS 74 -4.170 15.674 -2.381 636 HB3 LYS 74 HB1 LYS 74 -5.685 15.084 -1.708 637 HG2 LYS 74 HG2 LYS 74 -4.604 15.134 0.548 638 HG3 LYS 74 HG1 LYS 74 -3.221 15.931 -0.203 639 HD2 LYS 74 HD2 LYS 74 -4.640 17.607 0.768 640 HD3 LYS 74 HD1 LYS 74 -4.754 17.723 -0.988 641 HE2 LYS 74 HE2 LYS 74 -6.952 17.932 0.035 642 HE3 LYS 74 HE1 LYS 74 -6.853 16.466 -0.936 643 HZ1 LYS 74 HZ1 LYS 74 -7.943 16.016 1.149 644 HZ2 LYS 74 HZ2 LYS 74 -6.630 16.624 2.019 645 HZ3 LYS 74 HZ3 LYS 74 -6.456 15.202 1.116 646 H VAL 75 HN VAL 75 -2.369 14.686 -3.188 647 HA VAL 75 HA VAL 75 -0.065 13.324 -2.186 648 HB VAL 75 HB VAL 75 1.215 14.694 -3.748 649 HG11 VAL 75 HG11 VAL 75 -1.361 13.666 -4.922 650 HG12 VAL 75 HG12 VAL 75 0.113 12.742 -4.644 651 HG13 VAL 75 HG13 VAL 75 0.097 14.035 -5.839 652 HG21 VAL 75 HG21 VAL 75 0.083 16.823 -3.466 653 HG22 VAL 75 HG22 VAL 75 -1.372 16.172 -4.220 654 HG23 VAL 75 HG23 VAL 75 0.101 16.367 -5.170 655 H GLY 76 HN GLY 76 1.767 14.280 -1.197 656 HA2 GLY 76 HA2 GLY 76 1.130 16.598 0.487 657 HA3 GLY 76 HA1 GLY 76 2.455 15.467 0.746 658 H LYS 77 HN LYS 77 1.897 18.551 -0.031 659 HA LYS 77 HA LYS 77 3.513 18.783 -2.409 660 HB2 LYS 77 HB2 LYS 77 2.363 20.943 -0.636 661 HB3 LYS 77 HB1 LYS 77 3.078 21.186 -2.220 662 HG2 LYS 77 HG2 LYS 77 1.301 19.752 -3.188 663 HG3 LYS 77 HG1 LYS 77 0.554 19.676 -1.592 664 HD2 LYS 77 HD2 LYS 77 -0.624 21.405 -2.550 665 HD3 LYS 77 HD1 LYS 77 0.670 22.286 -1.739 666 HE2 LYS 77 HE2 LYS 77 0.618 21.509 -4.655 667 HE3 LYS 77 HE1 LYS 77 0.281 23.114 -4.014 668 HZ1 LYS 77 HZ1 LYS 77 2.869 21.666 -3.907 669 HZ2 LYS 77 HZ2 LYS 77 2.572 23.133 -3.127 670 HZ3 LYS 77 HZ3 LYS 77 2.511 23.047 -4.812 671 H LYS 78 HN LYS 78 4.912 17.620 -0.282 672 HA LYS 78 HA LYS 78 7.080 19.572 -0.003 673 HB2 LYS 78 HB2 LYS 78 5.985 17.805 2.187 674 HB3 LYS 78 HB1 LYS 78 7.571 18.555 2.267 675 HG2 LYS 78 HG2 LYS 78 6.500 20.766 2.108 676 HG3 LYS 78 HG1 LYS 78 4.921 19.976 2.119 677 HD2 LYS 78 HD2 LYS 78 5.355 19.061 4.315 678 HD3 LYS 78 HD1 LYS 78 6.993 19.716 4.299 679 HE2 LYS 78 HE2 LYS 78 6.055 21.988 4.186 680 HE3 LYS 78 HE1 LYS 78 4.431 21.308 4.264 681 HZ1 LYS 78 HZ1 LYS 78 4.921 20.422 6.439 682 HZ2 LYS 78 HZ2 LYS 78 5.226 22.086 6.427 683 HZ3 LYS 78 HZ3 LYS 78 6.511 20.992 6.360 684 H GLU 79 HN GLU 79 8.999 18.773 -0.591 685 HA GLU 79 HA GLU 79 9.238 16.025 -1.396 686 HB2 GLU 79 HB2 GLU 79 11.309 18.226 -1.207 687 HB3 GLU 79 HB1 GLU 79 11.575 16.651 -1.945 688 HG2 GLU 79 HG2 GLU 79 9.865 17.126 -3.610 689 HG3 GLU 79 HG1 GLU 79 9.559 18.689 -2.859 690 H LYS 80 HN LYS 80 9.103 14.667 0.266 691 HA LYS 80 HA LYS 80 9.836 15.215 2.898 692 HB2 LYS 80 HB2 LYS 80 9.277 12.628 1.473 693 HB3 LYS 80 HB1 LYS 80 9.591 12.711 3.201 694 HG2 LYS 80 HG2 LYS 80 7.673 14.210 3.469 695 HG3 LYS 80 HG1 LYS 80 7.354 14.097 1.738 696 HD2 LYS 80 HD2 LYS 80 6.855 11.775 1.902 697 HD3 LYS 80 HD1 LYS 80 7.439 11.708 3.566 698 HE2 LYS 80 HE2 LYS 80 5.004 11.727 3.493 699 HE3 LYS 80 HE1 LYS 80 5.630 13.176 4.274 700 HZ1 LYS 80 HZ1 LYS 80 4.728 13.032 1.446 701 HZ2 LYS 80 HZ2 LYS 80 5.245 14.418 2.266 702 HZ3 LYS 80 HZ3 LYS 80 3.815 13.649 2.730 703 H ILE 81 HN ILE 81 11.798 15.642 3.537 704 HA ILE 81 HA ILE 81 13.973 15.410 4.100 705 HB ILE 81 HB ILE 81 13.653 12.500 3.349 706 HG12 ILE 81 HG12 ILE 81 11.916 13.160 4.943 707 HG13 ILE 81 HG11 ILE 81 13.108 12.128 5.724 708 HG21 ILE 81 HG21 ILE 81 15.585 13.877 5.215 709 HG22 ILE 81 HG22 ILE 81 15.972 13.172 3.645 710 HG23 ILE 81 HG23 ILE 81 15.455 12.134 4.976 711 HD11 ILE 81 HD11 ILE 81 14.154 14.120 6.710 712 HD12 ILE 81 HD12 ILE 81 12.466 13.935 7.187 713 HD13 ILE 81 HD13 ILE 81 12.912 15.123 5.962 714 H GLY 82 HN GLY 82 14.372 16.745 2.171 715 HA2 GLY 82 HA2 GLY 82 16.634 16.494 0.976 716 HA3 GLY 82 HA1 GLY 82 15.791 15.244 0.081 717 H LYS 83 HN LYS 83 16.938 18.130 -0.308 718 HA LYS 83 HA LYS 83 14.791 18.946 -2.151 719 HB2 LYS 83 HB2 LYS 83 15.068 20.600 -0.351 720 HB3 LYS 83 HB1 LYS 83 16.787 20.705 -0.700 721 HG2 LYS 83 HG2 LYS 83 16.228 21.561 -2.957 722 HG3 LYS 83 HG1 LYS 83 14.526 21.567 -2.489 723 HD2 LYS 83 HD2 LYS 83 14.993 23.142 -0.704 724 HD3 LYS 83 HD1 LYS 83 16.716 23.084 -1.076 725 HE2 LYS 83 HE2 LYS 83 16.238 23.990 -3.313 726 HE3 LYS 83 HE1 LYS 83 14.532 24.102 -2.885 727 HZ1 LYS 83 HZ1 LYS 83 15.641 26.219 -2.613 728 HZ2 LYS 83 HZ2 LYS 83 16.755 25.534 -1.544 729 HZ3 LYS 83 HZ3 LYS 83 15.126 25.637 -1.111 730 H LYS 84 HN LYS 84 15.443 18.243 -4.088 731 HA LYS 84 HA LYS 84 16.731 17.669 -5.866 732 HB2 LYS 84 HB2 LYS 84 18.522 19.838 -4.762 733 HB3 LYS 84 HB1 LYS 84 18.840 18.998 -6.270 734 HG2 LYS 84 HG2 LYS 84 16.416 20.678 -5.664 735 HG3 LYS 84 HG1 LYS 84 17.796 21.162 -6.648 736 HD2 LYS 84 HD2 LYS 84 15.872 18.914 -7.242 737 HD3 LYS 84 HD1 LYS 84 15.942 20.472 -8.061 738 HE2 LYS 84 HE2 LYS 84 18.112 18.375 -8.047 739 HE3 LYS 84 HE1 LYS 84 17.018 18.722 -9.382 740 HZ1 LYS 84 HZ1 LYS 84 17.961 20.957 -9.506 741 HZ2 LYS 84 HZ2 LYS 84 19.148 19.774 -9.727 742 HZ3 LYS 84 HZ3 LYS 84 19.034 20.588 -8.252 743 H LYS 85 HN LYS 85 16.922 16.287 -3.381 744 HA LYS 85 HA LYS 85 19.717 15.545 -3.087 745 HB2 LYS 85 HB2 LYS 85 18.413 15.840 -1.057 746 HB3 LYS 85 HB1 LYS 85 17.228 14.667 -1.607 747 HG2 LYS 85 HG2 LYS 85 18.875 12.892 -1.456 748 HG3 LYS 85 HG1 LYS 85 20.109 14.055 -0.976 749 HD2 LYS 85 HD2 LYS 85 17.571 13.561 0.572 750 HD3 LYS 85 HD1 LYS 85 19.102 12.755 0.912 751 HE2 LYS 85 HE2 LYS 85 18.653 15.740 0.962 752 HE3 LYS 85 HE1 LYS 85 18.700 14.696 2.380 753 HZ1 LYS 85 HZ1 LYS 85 20.990 14.095 1.764 754 HZ2 LYS 85 HZ2 LYS 85 20.820 15.746 2.081 755 HZ3 LYS 85 HZ3 LYS 85 20.928 15.201 0.486 756 H ARG 86 HN ARG 86 20.592 13.688 -3.754 757 HA ARG 86 HA ARG 86 19.351 12.188 -5.801 758 HB2 ARG 86 HB2 ARG 86 21.788 12.534 -5.615 759 HB3 ARG 86 HB1 ARG 86 21.810 11.551 -4.159 760 HG2 ARG 86 HG2 ARG 86 21.006 9.633 -5.498 761 HG3 ARG 86 HG1 ARG 86 21.130 10.638 -6.943 762 HD2 ARG 86 HD2 ARG 86 23.108 9.246 -6.702 763 HD3 ARG 86 HD1 ARG 86 23.520 10.951 -6.516 764 HE ARG 86 HE ARG 86 22.986 9.764 -3.994 765 HH11 ARG 86 HH11 ARG 86 25.422 9.944 -6.496 766 HH12 ARG 86 HH12 ARG 86 26.735 9.589 -5.420 767 HH21 ARG 86 HH21 ARG 86 24.712 9.313 -2.571 768 HH22 ARG 86 HH22 ARG 86 26.330 9.216 -3.189 769 H GLN 87 HN GLN 87 17.614 10.979 -5.339 770 HA GLN 87 HA GLN 87 17.531 9.411 -2.888 771 HB2 GLN 87 HB2 GLN 87 15.518 10.636 -3.580 772 HB3 GLN 87 HB1 GLN 87 15.491 9.754 -5.099 773 HG2 GLN 87 HG2 GLN 87 15.224 7.654 -3.772 774 HG3 GLN 87 HG1 GLN 87 15.020 8.659 -2.340 775 HE21 GLN 87 HE21 GLN 87 13.154 9.887 -2.117 776 HE22 GLN 87 HE22 GLN 87 11.749 9.607 -3.080 777 H LYS 88 HN LYS 88 16.410 8.487 -6.109 778 HA LYS 88 HA LYS 88 17.684 5.875 -5.730 779 HB2 LYS 88 HB2 LYS 88 15.253 5.875 -6.059 780 HB3 LYS 88 HB1 LYS 88 15.447 6.742 -7.574 781 HG2 LYS 88 HG2 LYS 88 16.559 4.848 -8.567 782 HG3 LYS 88 HG1 LYS 88 16.519 3.983 -7.028 783 HD2 LYS 88 HD2 LYS 88 14.081 3.980 -7.078 784 HD3 LYS 88 HD1 LYS 88 14.104 4.876 -8.599 785 HE2 LYS 88 HE2 LYS 88 13.722 2.449 -8.899 786 HE3 LYS 88 HE1 LYS 88 15.163 3.038 -9.727 787 HZ1 LYS 88 HZ1 LYS 88 15.191 1.707 -7.075 788 HZ2 LYS 88 HZ2 LYS 88 16.532 2.143 -8.004 789 HZ3 LYS 88 HZ3 LYS 88 15.497 0.921 -8.538 790 H LYS 89 HN LYS 89 19.609 5.700 -6.694 791 HA LYS 89 HA LYS 89 20.191 7.410 -8.988 792 HB2 LYS 89 HB2 LYS 89 22.510 6.958 -8.585 793 HB3 LYS 89 HB1 LYS 89 21.753 7.330 -7.042 794 HG2 LYS 89 HG2 LYS 89 21.671 4.964 -6.491 795 HG3 LYS 89 HG1 LYS 89 22.382 4.564 -8.055 796 HD2 LYS 89 HD2 LYS 89 24.155 4.497 -6.494 797 HD3 LYS 89 HD1 LYS 89 24.348 6.009 -7.380 798 HE2 LYS 89 HE2 LYS 89 24.712 6.391 -5.023 799 HE3 LYS 89 HE1 LYS 89 23.233 7.200 -5.536 800 HZ1 LYS 89 HZ1 LYS 89 23.325 4.558 -4.186 801 HZ2 LYS 89 HZ2 LYS 89 21.936 5.435 -4.580 802 HZ3 LYS 89 HZ3 LYS 89 23.001 6.023 -3.408 803 H ARG 90 HN ARG 90 19.525 4.122 -8.252 804 HA ARG 90 HA ARG 90 20.661 3.227 -10.797 805 HB2 ARG 90 HB2 ARG 90 21.299 1.944 -8.805 806 HB3 ARG 90 HB1 ARG 90 19.604 1.622 -8.466 807 HG2 ARG 90 HG2 ARG 90 19.420 0.359 -10.546 808 HG3 ARG 90 HG1 ARG 90 21.117 0.692 -10.899 809 HD2 ARG 90 HD2 ARG 90 20.077 -0.825 -8.509 810 HD3 ARG 90 HD1 ARG 90 20.809 -1.541 -9.944 811 HE ARG 90 HE ARG 90 22.738 0.119 -9.146 812 HH11 ARG 90 HH11 ARG 90 20.814 -2.173 -7.337 813 HH12 ARG 90 HH12 ARG 90 22.064 -2.501 -6.181 814 HH21 ARG 90 HH21 ARG 90 24.386 -0.310 -7.628 815 HH22 ARG 90 HH22 ARG 90 24.089 -1.431 -6.336 816 H LYS 91 HN LYS 91 19.387 2.975 -12.487 817 HA LYS 91 HA LYS 91 16.518 2.563 -12.004 818 HB2 LYS 91 HB2 LYS 91 16.243 3.552 -14.347 819 HB3 LYS 91 HB1 LYS 91 16.667 4.657 -13.051 820 HG2 LYS 91 HG2 LYS 91 18.060 5.369 -14.723 821 HG3 LYS 91 HG1 LYS 91 19.110 4.238 -13.871 822 HD2 LYS 91 HD2 LYS 91 18.590 2.508 -15.512 823 HD3 LYS 91 HD1 LYS 91 17.504 3.616 -16.351 824 HE2 LYS 91 HE2 LYS 91 19.629 3.511 -17.505 825 HE3 LYS 91 HE1 LYS 91 19.405 5.109 -16.799 826 HZ1 LYS 91 HZ1 LYS 91 20.855 4.478 -14.981 827 HZ2 LYS 91 HZ2 LYS 91 21.646 4.283 -16.460 828 HZ3 LYS 91 HZ3 LYS 91 21.052 2.931 -15.637 829 H ALA 92 HN ALA 92 15.550 0.829 -12.863 830 HA ALA 92 HA ALA 92 17.251 -1.151 -14.139 831 HB1 ALA 92 HB1 ALA 92 15.791 -1.827 -12.294 832 HB2 ALA 92 HB2 ALA 92 15.388 -2.687 -13.780 833 HB3 ALA 92 HB3 ALA 92 14.379 -1.347 -13.233 834 H ALA 93 HN ALA 93 17.292 0.504 -16.008 835 HA ALA 93 HA ALA 93 15.243 -0.300 -17.945 836 HB1 ALA 93 HB1 ALA 93 14.586 1.896 -17.097 837 HB2 ALA 93 HB2 ALA 93 15.076 1.991 -18.789 838 HB3 ALA 93 HB3 ALA 93 16.171 2.541 -17.523 839 H GLN 94 HN GLN 94 15.940 0.573 -20.189 840 HA GLN 94 HA GLN 94 17.358 0.536 -21.946 841 HB2 GLN 94 HB2 GLN 94 19.474 1.271 -19.920 842 HB3 GLN 94 HB1 GLN 94 19.625 1.412 -21.664 843 HG2 GLN 94 HG2 GLN 94 17.664 2.923 -19.948 844 HG3 GLN 94 HG1 GLN 94 19.175 3.561 -20.588 845 HE21 GLN 94 HE21 GLN 94 18.178 5.185 -21.727 846 HE22 GLN 94 HE22 GLN 94 17.235 4.895 -23.147 847 H LYS 95 HN LYS 95 16.904 -1.868 -20.337 848 HA LYS 95 HA LYS 95 18.891 -3.518 -21.601 849 HB2 LYS 95 HB2 LYS 95 19.530 -4.699 -19.513 850 HB3 LYS 95 HB1 LYS 95 20.089 -3.035 -19.566 851 HG2 LYS 95 HG2 LYS 95 18.269 -2.361 -18.096 852 HG3 LYS 95 HG1 LYS 95 17.671 -4.022 -18.066 853 HD2 LYS 95 HD2 LYS 95 18.988 -3.482 -16.061 854 HD3 LYS 95 HD1 LYS 95 19.733 -4.768 -17.012 855 HE2 LYS 95 HE2 LYS 95 21.404 -3.168 -16.232 856 HE3 LYS 95 HE1 LYS 95 21.284 -3.152 -17.989 857 HZ1 LYS 95 HZ1 LYS 95 21.407 -0.918 -17.189 858 HZ2 LYS 95 HZ2 LYS 95 20.126 -1.166 -16.114 859 HZ3 LYS 95 HZ3 LYS 95 19.842 -1.172 -17.782 860 H ARG 96 HN ARG 96 18.408 -5.856 -21.255 861 HA ARG 96 HA ARG 96 16.982 -7.606 -21.432 862 HB2 ARG 96 HB2 ARG 96 15.317 -6.066 -19.432 863 HB3 ARG 96 HB1 ARG 96 15.152 -7.775 -19.814 864 HG2 ARG 96 HG2 ARG 96 17.423 -8.169 -18.968 865 HG3 ARG 96 HG1 ARG 96 17.548 -6.460 -18.548 866 HD2 ARG 96 HD2 ARG 96 15.571 -8.444 -17.436 867 HD3 ARG 96 HD1 ARG 96 16.968 -7.777 -16.595 868 HE ARG 96 HE ARG 96 15.562 -5.567 -17.267 869 HH11 ARG 96 HH11 ARG 96 14.724 -8.543 -15.638 870 HH12 ARG 96 HH12 ARG 96 13.446 -7.826 -14.712 871 HH21 ARG 96 HH21 ARG 96 13.885 -4.615 -16.033 872 HH22 ARG 96 HH22 ARG 96 12.962 -5.596 -14.940 873 H LYS 97 HN LYS 97 16.770 -5.458 -23.267 874 HA LYS 97 HA LYS 97 13.929 -5.178 -23.841 875 HB2 LYS 97 HB2 LYS 97 15.394 -3.211 -24.062 876 HB3 LYS 97 HB1 LYS 97 16.358 -4.061 -25.262 877 HG2 LYS 97 HG2 LYS 97 14.448 -4.138 -26.765 878 HG3 LYS 97 HG1 LYS 97 13.454 -3.325 -25.555 879 HD2 LYS 97 HD2 LYS 97 14.977 -1.385 -25.654 880 HD3 LYS 97 HD1 LYS 97 15.891 -2.194 -26.928 881 HE2 LYS 97 HE2 LYS 97 14.306 -0.567 -27.845 882 HE3 LYS 97 HE1 LYS 97 13.924 -2.211 -28.356 883 HZ1 LYS 97 HZ1 LYS 97 11.960 -0.926 -27.666 884 HZ2 LYS 97 HZ2 LYS 97 12.600 -0.799 -26.105 885 HZ3 LYS 97 HZ3 LYS 97 12.186 -2.315 -26.729 886 H ASN 98 HN ASN 98 12.882 -6.305 -25.380 887 HA ASN 98 HA ASN 98 14.227 -8.524 -26.613 888 HB2 ASN 98 HB2 ASN 98 11.901 -8.724 -25.815 889 HB3 ASN 98 HB1 ASN 98 11.397 -7.518 -26.994 890 HD21 ASN 98 HD21 ASN 98 11.339 -8.063 -29.171 891 HD22 ASN 98 HD22 ASN 98 11.355 -9.707 -29.709 Start of MODEL 18 1 H1 LYS 1 HT1 LYS 1 4.579 14.870 1.344 2 H2 LYS 1 HT2 LYS 1 5.364 16.346 1.113 3 H3 LYS 1 HT3 LYS 1 4.869 15.434 -0.219 4 HA LYS 1 HA LYS 1 3.426 17.300 0.144 5 HB2 LYS 1 HB2 LYS 1 2.462 15.388 -0.921 6 HB3 LYS 1 HB1 LYS 1 2.233 14.569 0.613 7 HG2 LYS 1 HG2 LYS 1 0.530 16.151 1.254 8 HG3 LYS 1 HG1 LYS 1 0.822 17.097 -0.208 9 HD2 LYS 1 HD2 LYS 1 0.070 15.257 -1.589 10 HD3 LYS 1 HD1 LYS 1 -0.119 14.232 -0.166 11 HE2 LYS 1 HE2 LYS 1 -1.630 16.800 -0.616 12 HE3 LYS 1 HE1 LYS 1 -2.250 15.204 -1.031 13 HZ1 LYS 1 HZ1 LYS 1 -2.064 14.569 1.296 14 HZ2 LYS 1 HZ2 LYS 1 -3.062 15.923 1.117 15 HZ3 LYS 1 HZ3 LYS 1 -1.485 16.109 1.689 16 HA PRO 2 HA PRO 2 1.538 17.064 4.517 17 HB2 PRO 2 HB2 PRO 2 2.236 15.076 6.225 18 HB3 PRO 2 HB1 PRO 2 0.865 14.952 5.117 19 HG2 PRO 2 HG2 PRO 2 3.622 13.837 4.852 20 HG3 PRO 2 HG1 PRO 2 2.068 13.080 4.462 21 HD2 PRO 2 HD2 PRO 2 3.697 14.171 2.585 22 HD3 PRO 2 HD1 PRO 2 1.932 14.125 2.427 23 H VAL 3 HN VAL 3 2.318 18.055 6.396 24 HA VAL 3 HA VAL 3 5.212 18.559 6.276 25 HB VAL 3 HB VAL 3 3.643 20.459 5.826 26 HG11 VAL 3 HG11 VAL 3 2.952 20.142 8.743 27 HG12 VAL 3 HG12 VAL 3 1.869 19.915 7.370 28 HG13 VAL 3 HG13 VAL 3 2.507 21.518 7.732 29 HG21 VAL 3 HG21 VAL 3 5.433 20.782 8.231 30 HG22 VAL 3 HG22 VAL 3 4.831 22.088 7.211 31 HG23 VAL 3 HG23 VAL 3 5.927 20.881 6.541 32 H SER 4 HN SER 4 3.319 16.617 7.922 33 HA SER 4 HA SER 4 3.920 17.318 10.646 34 HB2 SER 4 HB2 SER 4 1.853 16.088 9.919 35 HB3 SER 4 HB1 SER 4 2.872 14.693 9.582 36 HG SER 4 HG SER 4 3.080 14.313 11.650 37 H LEU 5 HN LEU 5 6.303 17.339 9.578 38 HA LEU 5 HA LEU 5 8.422 16.584 9.727 39 HB2 LEU 5 HB2 LEU 5 7.110 14.860 11.792 40 HB3 LEU 5 HB1 LEU 5 8.829 14.756 11.474 41 HG LEU 5 HG LEU 5 8.527 16.142 13.393 42 HD11 LEU 5 HD11 LEU 5 10.225 16.880 11.793 43 HD12 LEU 5 HD12 LEU 5 9.521 18.230 12.683 44 HD13 LEU 5 HD13 LEU 5 9.033 17.923 11.018 45 HD21 LEU 5 HD21 LEU 5 6.577 17.710 11.721 46 HD22 LEU 5 HD22 LEU 5 7.157 18.192 13.317 47 HD23 LEU 5 HD23 LEU 5 6.201 16.720 13.133 48 H SER 6 HN SER 6 6.198 15.078 8.130 49 HA SER 6 HA SER 6 7.333 12.457 7.796 50 HB2 SER 6 HB2 SER 6 5.485 12.451 5.941 51 HB3 SER 6 HB1 SER 6 5.008 12.441 7.641 52 HG SER 6 HG SER 6 5.070 14.638 5.849 53 H TYR 7 HN TYR 7 9.389 13.849 7.223 54 HA TYR 7 HA TYR 7 9.548 14.643 4.456 55 HB2 TYR 7 HB2 TYR 7 11.815 14.142 6.395 56 HB3 TYR 7 HB1 TYR 7 11.884 15.066 4.900 57 HD1 TYR 7 HD1 TYR 7 11.485 15.256 8.401 58 HD2 TYR 7 HD2 TYR 7 10.312 17.154 4.779 59 HE1 TYR 7 HE1 TYR 7 10.952 17.302 9.652 60 HE2 TYR 7 HE2 TYR 7 9.776 19.208 6.021 61 HH TYR 7 HH TYR 7 10.721 19.690 9.270 62 H ARG 8 HN ARG 8 10.132 13.386 2.781 63 HA ARG 8 HA ARG 8 10.615 11.543 1.554 64 HB2 ARG 8 HB2 ARG 8 12.127 10.778 4.050 65 HB3 ARG 8 HB1 ARG 8 12.134 9.807 2.582 66 HG2 ARG 8 HG2 ARG 8 13.154 11.609 1.346 67 HG3 ARG 8 HG1 ARG 8 13.045 12.670 2.751 68 HD2 ARG 8 HD2 ARG 8 14.642 10.117 2.593 69 HD3 ARG 8 HD1 ARG 8 15.300 11.749 2.476 70 HE ARG 8 HE ARG 8 13.992 11.790 4.842 71 HH11 ARG 8 HH11 ARG 8 16.392 9.640 3.478 72 HH12 ARG 8 HH12 ARG 8 17.079 9.224 5.016 73 HH21 ARG 8 HH21 ARG 8 14.867 11.233 6.864 74 HH22 ARG 8 HH22 ARG 8 16.203 10.125 6.946 75 H CYS 9 HN CYS 9 10.310 9.081 1.544 76 HA CYS 9 HA CYS 9 7.743 8.551 2.762 77 HB2 CYS 9 HB2 CYS 9 9.344 6.845 0.860 78 HB3 CYS 9 HB1 CYS 9 7.641 6.715 1.229 79 HA PRO 10 HA PRO 10 8.734 6.261 6.306 80 HB2 PRO 10 HB2 PRO 10 7.241 4.023 5.045 81 HB3 PRO 10 HB1 PRO 10 7.089 4.700 6.667 82 HG2 PRO 10 HG2 PRO 10 5.351 5.294 4.717 83 HG3 PRO 10 HG1 PRO 10 5.815 6.455 5.967 84 HD2 PRO 10 HD2 PRO 10 6.514 6.412 3.111 85 HD3 PRO 10 HD1 PRO 10 6.511 7.767 4.247 86 H CYS 11 HN CYS 11 8.771 3.960 3.584 87 HA CYS 11 HA CYS 11 10.840 2.437 4.927 88 HB2 CYS 11 HB2 CYS 11 8.907 1.304 3.843 89 HB3 CYS 11 HB1 CYS 11 9.451 1.909 2.287 90 H ARG 12 HN ARG 12 12.802 1.856 3.991 91 HA ARG 12 HA ARG 12 14.124 3.752 2.328 92 HB2 ARG 12 HB2 ARG 12 15.006 0.928 2.966 93 HB3 ARG 12 HB1 ARG 12 16.018 2.245 2.388 94 HG2 ARG 12 HG2 ARG 12 14.656 2.074 5.070 95 HG3 ARG 12 HG1 ARG 12 16.381 1.900 4.746 96 HD2 ARG 12 HD2 ARG 12 16.456 4.212 3.948 97 HD3 ARG 12 HD1 ARG 12 14.732 4.378 4.268 98 HE ARG 12 HE ARG 12 16.275 3.580 6.563 99 HH11 ARG 12 HH11 ARG 12 15.082 6.289 4.700 100 HH12 ARG 12 HH12 ARG 12 15.191 7.407 6.022 101 HH21 ARG 12 HH21 ARG 12 16.422 5.057 8.306 102 HH22 ARG 12 HH22 ARG 12 15.950 6.710 8.064 103 H PHE 13 HN PHE 13 15.513 2.203 0.458 104 HA PHE 13 HA PHE 13 13.463 2.243 -1.553 105 HB2 PHE 13 HB2 PHE 13 16.374 1.439 -1.802 106 HB3 PHE 13 HB1 PHE 13 15.288 1.850 -3.126 107 HD1 PHE 13 HD1 PHE 13 14.735 4.123 -3.619 108 HD2 PHE 13 HD2 PHE 13 17.231 3.169 -0.311 109 HE1 PHE 13 HE1 PHE 13 15.403 6.468 -3.459 110 HE2 PHE 13 HE2 PHE 13 17.903 5.521 -0.139 111 HZ PHE 13 HZ PHE 13 16.967 7.183 -1.650 112 H PHE 14 HN PHE 14 12.840 0.506 -2.862 113 HA PHE 14 HA PHE 14 12.353 -1.765 -1.207 114 HB2 PHE 14 HB2 PHE 14 11.367 -1.419 -4.013 115 HB3 PHE 14 HB1 PHE 14 10.561 -2.128 -2.628 116 HD1 PHE 14 HD1 PHE 14 10.138 -0.419 -0.627 117 HD2 PHE 14 HD2 PHE 14 10.674 0.651 -4.707 118 HE1 PHE 14 HE1 PHE 14 8.975 1.706 -0.216 119 HE2 PHE 14 HE2 PHE 14 9.523 2.781 -4.303 120 HZ PHE 14 HZ PHE 14 8.669 3.315 -2.055 121 H GLU 15 HN GLU 15 12.487 -3.961 -1.977 122 HA GLU 15 HA GLU 15 14.951 -4.398 -3.486 123 HB2 GLU 15 HB2 GLU 15 13.333 -6.202 -1.687 124 HB3 GLU 15 HB1 GLU 15 14.742 -6.739 -2.588 125 HG2 GLU 15 HG2 GLU 15 14.737 -4.571 -0.505 126 HG3 GLU 15 HG1 GLU 15 15.240 -6.239 -0.243 127 H SER 16 HN SER 16 14.927 -5.152 -5.474 128 HA SER 16 HA SER 16 12.415 -6.156 -6.592 129 HB2 SER 16 HB2 SER 16 13.750 -5.909 -8.785 130 HB3 SER 16 HB1 SER 16 13.268 -4.432 -7.951 131 HG SER 16 HG SER 16 15.299 -4.028 -7.436 132 H HIS 17 HN HIS 17 13.871 -7.763 -4.806 133 HA HIS 17 HA HIS 17 14.546 -10.001 -6.584 134 HB2 HIS 17 HB2 HIS 17 16.584 -8.922 -5.528 135 HB3 HIS 17 HB1 HIS 17 15.958 -9.442 -3.969 136 HD1 HIS 17 HD1 HIS 17 17.518 -10.744 -7.110 137 HD2 HIS 17 HD2 HIS 17 16.255 -12.168 -3.415 138 HE1 HIS 17 HE1 HIS 17 18.458 -13.068 -6.923 139 HE2 HIS 17 HE2 HIS 17 17.519 -13.973 -4.766 140 H ILE 18 HN ILE 18 12.708 -8.771 -4.066 141 HA ILE 18 HA ILE 18 12.321 -11.088 -2.483 142 HB ILE 18 HB ILE 18 10.618 -8.631 -2.844 143 HG12 ILE 18 HG12 ILE 18 12.478 -9.434 -0.612 144 HG13 ILE 18 HG11 ILE 18 12.888 -8.302 -1.891 145 HG21 ILE 18 HG21 ILE 18 9.476 -9.289 -0.772 146 HG22 ILE 18 HG22 ILE 18 10.363 -10.816 -0.786 147 HG23 ILE 18 HG23 ILE 18 9.214 -10.451 -2.075 148 HD11 ILE 18 HD11 ILE 18 10.713 -7.934 0.157 149 HD12 ILE 18 HD12 ILE 18 11.141 -6.792 -1.116 150 HD13 ILE 18 HD13 ILE 18 12.298 -7.149 0.173 151 H ALA 19 HN ALA 19 10.862 -12.698 -2.632 152 HA ALA 19 HA ALA 19 9.405 -12.897 -5.189 153 HB1 ALA 19 HB1 ALA 19 11.413 -14.345 -5.019 154 HB2 ALA 19 HB2 ALA 19 9.913 -15.246 -5.227 155 HB3 ALA 19 HB3 ALA 19 10.666 -15.150 -3.638 156 H ARG 20 HN ARG 20 7.477 -14.022 -5.247 157 HA ARG 20 HA ARG 20 5.680 -13.582 -3.196 158 HB2 ARG 20 HB2 ARG 20 5.053 -15.837 -4.963 159 HB3 ARG 20 HB1 ARG 20 4.197 -14.354 -4.663 160 HG2 ARG 20 HG2 ARG 20 5.799 -13.179 -6.149 161 HG3 ARG 20 HG1 ARG 20 6.453 -14.764 -6.566 162 HD2 ARG 20 HD2 ARG 20 3.581 -13.927 -6.930 163 HD3 ARG 20 HD1 ARG 20 4.799 -13.933 -8.203 164 HE ARG 20 HE ARG 20 4.840 -16.479 -7.243 165 HH11 ARG 20 HH11 ARG 20 2.326 -14.384 -8.493 166 HH12 ARG 20 HH12 ARG 20 1.396 -15.688 -9.157 167 HH21 ARG 20 HH21 ARG 20 3.610 -18.190 -8.102 168 HH22 ARG 20 HH22 ARG 20 2.118 -17.854 -8.920 169 H ALA 21 HN ALA 21 7.472 -16.465 -4.064 170 HA ALA 21 HA ALA 21 6.174 -18.093 -2.068 171 HB1 ALA 21 HB1 ALA 21 6.859 -19.072 -4.197 172 HB2 ALA 21 HB2 ALA 21 7.645 -19.873 -2.838 173 HB3 ALA 21 HB3 ALA 21 8.543 -18.714 -3.817 174 H ASN 22 HN ASN 22 8.654 -15.873 -2.011 175 HA ASN 22 HA ASN 22 9.985 -17.231 0.199 176 HB2 ASN 22 HB2 ASN 22 10.833 -15.069 -1.703 177 HB3 ASN 22 HB1 ASN 22 11.664 -15.307 -0.185 178 HD21 ASN 22 HD21 ASN 22 13.583 -15.885 -1.173 179 HD22 ASN 22 HD22 ASN 22 13.793 -17.400 -1.977 180 H VAL 23 HN VAL 23 7.582 -15.071 -0.296 181 HA VAL 23 HA VAL 23 8.356 -13.402 1.972 182 HB VAL 23 HB VAL 23 7.724 -12.175 -0.031 183 HG11 VAL 23 HG11 VAL 23 5.353 -12.125 -0.743 184 HG12 VAL 23 HG12 VAL 23 5.040 -13.492 0.330 185 HG13 VAL 23 HG13 VAL 23 6.132 -13.679 -1.044 186 HG21 VAL 23 HG21 VAL 23 7.366 -11.225 2.166 187 HG22 VAL 23 HG22 VAL 23 5.726 -11.878 2.175 188 HG23 VAL 23 HG23 VAL 23 6.177 -10.649 0.992 189 H LYS 24 HN LYS 24 7.151 -13.081 3.674 190 HA LYS 24 HA LYS 24 4.973 -14.937 4.265 191 HB2 LYS 24 HB2 LYS 24 6.495 -13.118 6.148 192 HB3 LYS 24 HB1 LYS 24 5.304 -14.320 6.599 193 HG2 LYS 24 HG2 LYS 24 7.050 -15.816 5.206 194 HG3 LYS 24 HG1 LYS 24 8.115 -14.629 5.956 195 HD2 LYS 24 HD2 LYS 24 6.211 -15.522 7.884 196 HD3 LYS 24 HD1 LYS 24 6.943 -16.919 7.106 197 HE2 LYS 24 HE2 LYS 24 8.178 -16.272 9.095 198 HE3 LYS 24 HE1 LYS 24 9.153 -16.100 7.639 199 HZ1 LYS 24 HZ1 LYS 24 9.418 -14.229 9.139 200 HZ2 LYS 24 HZ2 LYS 24 7.767 -13.892 9.049 201 HZ3 LYS 24 HZ3 LYS 24 8.737 -13.734 7.672 202 H HIS 25 HN HIS 25 3.923 -13.287 6.337 203 HA HIS 25 HA HIS 25 1.738 -12.100 5.376 204 HB2 HIS 25 HB2 HIS 25 3.208 -10.446 7.380 205 HB3 HIS 25 HB1 HIS 25 1.511 -10.896 7.348 206 HD1 HIS 25 HD1 HIS 25 3.100 -11.036 9.916 207 HD2 HIS 25 HD2 HIS 25 2.726 -14.271 7.328 208 HE1 HIS 25 HE1 HIS 25 3.536 -13.073 11.311 209 HE2 HIS 25 HE2 HIS 25 3.066 -15.021 9.780 210 H LEU 26 HN LEU 26 1.469 -10.719 3.717 211 HA LEU 26 HA LEU 26 3.484 -8.627 3.324 212 HB2 LEU 26 HB2 LEU 26 3.251 -10.120 1.440 213 HB3 LEU 26 HB1 LEU 26 1.523 -9.835 1.369 214 HG LEU 26 HG LEU 26 1.849 -7.591 0.590 215 HD11 LEU 26 HD11 LEU 26 3.799 -7.153 2.080 216 HD12 LEU 26 HD12 LEU 26 3.974 -6.536 0.450 217 HD13 LEU 26 HD13 LEU 26 4.803 -8.013 0.924 218 HD21 LEU 26 HD21 LEU 26 2.557 -9.764 -0.894 219 HD22 LEU 26 HD22 LEU 26 4.024 -8.773 -1.014 220 HD23 LEU 26 HD23 LEU 26 2.460 -8.119 -1.519 221 H LYS 27 HN LYS 27 3.002 -6.585 3.522 222 HA LYS 27 HA LYS 27 0.195 -5.747 3.838 223 HB2 LYS 27 HB2 LYS 27 0.948 -5.932 6.072 224 HB3 LYS 27 HB1 LYS 27 2.531 -5.299 5.670 225 HG2 LYS 27 HG2 LYS 27 1.426 -3.622 6.890 226 HG3 LYS 27 HG1 LYS 27 1.437 -3.103 5.201 227 HD2 LYS 27 HD2 LYS 27 -0.883 -4.014 4.997 228 HD3 LYS 27 HD1 LYS 27 -0.867 -4.315 6.733 229 HE2 LYS 27 HE2 LYS 27 -0.615 -1.650 5.349 230 HE3 LYS 27 HE1 LYS 27 -1.987 -2.226 6.292 231 HZ1 LYS 27 HZ1 LYS 27 -0.647 -0.719 7.586 232 HZ2 LYS 27 HZ2 LYS 27 0.736 -1.655 7.331 233 HZ3 LYS 27 HZ3 LYS 27 -0.540 -2.271 8.251 234 H ILE 28 HN ILE 28 -0.237 -3.630 3.148 235 HA ILE 28 HA ILE 28 1.962 -2.371 1.652 236 HB ILE 28 HB ILE 28 -0.994 -1.966 1.195 237 HG12 ILE 28 HG12 ILE 28 -0.453 -4.290 0.735 238 HG13 ILE 28 HG11 ILE 28 -0.672 -3.444 -0.782 239 HG21 ILE 28 HG21 ILE 28 -0.276 -1.011 -0.940 240 HG22 ILE 28 HG22 ILE 28 1.410 -1.273 -0.494 241 HG23 ILE 28 HG23 ILE 28 0.422 -0.133 0.422 242 HD11 ILE 28 HD11 ILE 28 1.979 -4.080 0.449 243 HD12 ILE 28 HD12 ILE 28 1.696 -3.335 -1.128 244 HD13 ILE 28 HD13 ILE 28 1.196 -5.004 -0.834 245 H LEU 29 HN LEU 29 2.661 -0.451 2.243 246 HA LEU 29 HA LEU 29 1.653 0.793 4.626 247 HB2 LEU 29 HB2 LEU 29 4.094 0.614 3.714 248 HB3 LEU 29 HB1 LEU 29 3.665 2.019 2.763 249 HG LEU 29 HG LEU 29 4.890 2.710 4.718 250 HD11 LEU 29 HD11 LEU 29 3.247 4.289 4.052 251 HD12 LEU 29 HD12 LEU 29 3.245 4.221 5.812 252 HD13 LEU 29 HD13 LEU 29 1.966 3.418 4.895 253 HD21 LEU 29 HD21 LEU 29 4.076 2.311 6.981 254 HD22 LEU 29 HD22 LEU 29 4.429 0.798 6.148 255 HD23 LEU 29 HD23 LEU 29 2.759 1.330 6.341 256 H ASN 30 HN ASN 30 0.008 2.186 4.664 257 HA ASN 30 HA ASN 30 -0.839 3.704 2.384 258 HB2 ASN 30 HB2 ASN 30 -1.522 3.818 5.317 259 HB3 ASN 30 HB1 ASN 30 -2.213 4.913 4.139 260 HD21 ASN 30 HD21 ASN 30 -3.765 4.161 2.722 261 HD22 ASN 30 HD22 ASN 30 -4.508 2.610 2.892 262 H THR 31 HN THR 31 0.905 4.964 1.686 263 HA THR 31 HA THR 31 2.470 6.429 3.560 264 HB THR 31 HB THR 31 3.310 7.343 1.239 265 HG1 THR 31 HG1 THR 31 2.865 5.007 0.065 266 HG21 THR 31 HG21 THR 31 4.867 5.473 1.186 267 HG22 THR 31 HG22 THR 31 3.791 4.547 2.229 268 HG23 THR 31 HG23 THR 31 4.571 6.005 2.842 269 HA PRO 32 HA PRO 32 1.414 10.818 3.359 270 HB2 PRO 32 HB2 PRO 32 3.915 10.753 1.705 271 HB3 PRO 32 HB1 PRO 32 3.419 11.919 2.938 272 HG2 PRO 32 HG2 PRO 32 5.125 9.987 3.542 273 HG3 PRO 32 HG1 PRO 32 3.858 10.454 4.685 274 HD2 PRO 32 HD2 PRO 32 4.098 8.025 3.032 275 HD3 PRO 32 HD1 PRO 32 3.253 8.270 4.566 276 H ASN 33 HN ASN 33 1.016 8.812 0.777 277 HA ASN 33 HA ASN 33 0.328 8.962 -1.366 278 HB2 ASN 33 HB2 ASN 33 -0.382 10.863 -2.388 279 HB3 ASN 33 HB1 ASN 33 -0.335 11.473 -0.747 280 HD21 ASN 33 HD21 ASN 33 2.484 11.897 -0.557 281 HD22 ASN 33 HD22 ASN 33 2.897 13.180 -1.639 282 H CYS 34 HN CYS 34 2.714 8.179 -0.410 283 HA CYS 34 HA CYS 34 4.625 8.727 -2.542 284 HB2 CYS 34 HB2 CYS 34 4.681 7.083 -0.010 285 HB3 CYS 34 HB1 CYS 34 5.928 6.934 -1.224 286 H ALA 35 HN ALA 35 5.567 6.561 -3.489 287 HA ALA 35 HA ALA 35 3.648 4.978 -4.701 288 HB1 ALA 35 HB1 ALA 35 5.415 3.307 -5.030 289 HB2 ALA 35 HB2 ALA 35 6.431 4.155 -3.862 290 HB3 ALA 35 HB3 ALA 35 5.993 4.938 -5.382 291 H LEU 36 HN LEU 36 2.565 3.129 -4.131 292 HA LEU 36 HA LEU 36 1.978 2.594 -1.470 293 HB2 LEU 36 HB2 LEU 36 1.606 1.180 -4.081 294 HB3 LEU 36 HB1 LEU 36 1.234 0.342 -2.602 295 HG LEU 36 HG LEU 36 -0.793 1.266 -3.522 296 HD11 LEU 36 HD11 LEU 36 -1.580 2.599 -1.660 297 HD12 LEU 36 HD12 LEU 36 0.080 2.905 -1.152 298 HD13 LEU 36 HD13 LEU 36 -0.575 1.268 -1.086 299 HD21 LEU 36 HD21 LEU 36 0.166 3.035 -4.877 300 HD22 LEU 36 HD22 LEU 36 0.611 3.933 -3.427 301 HD23 LEU 36 HD23 LEU 36 -1.089 3.681 -3.822 302 H GLN 37 HN GLN 37 3.483 1.918 -0.043 303 HA GLN 37 HA GLN 37 5.784 0.451 -0.986 304 HB2 GLN 37 HB2 GLN 37 5.281 0.936 1.914 305 HB3 GLN 37 HB1 GLN 37 6.798 0.962 1.025 306 HG2 GLN 37 HG2 GLN 37 5.849 3.062 -0.110 307 HG3 GLN 37 HG1 GLN 37 4.689 3.065 1.211 308 HE21 GLN 37 HE21 GLN 37 6.702 4.968 0.535 309 HE22 GLN 37 HE22 GLN 37 7.758 5.103 1.897 310 H ILE 38 HN ILE 38 5.775 -1.633 -1.171 311 HA ILE 38 HA ILE 38 3.752 -3.208 0.163 312 HB ILE 38 HB ILE 38 5.824 -4.118 -1.847 313 HG12 ILE 38 HG12 ILE 38 3.510 -3.904 -3.268 314 HG13 ILE 38 HG11 ILE 38 3.369 -2.516 -2.205 315 HG21 ILE 38 HG21 ILE 38 3.880 -5.723 -2.373 316 HG22 ILE 38 HG22 ILE 38 3.274 -5.263 -0.778 317 HG23 ILE 38 HG23 ILE 38 4.873 -6.021 -0.948 318 HD11 ILE 38 HD11 ILE 38 5.636 -3.085 -4.101 319 HD12 ILE 38 HD12 ILE 38 5.536 -1.703 -3.014 320 HD13 ILE 38 HD13 ILE 38 4.359 -1.886 -4.310 321 H VAL 39 HN VAL 39 4.331 -3.620 2.265 322 HA VAL 39 HA VAL 39 7.157 -4.071 2.855 323 HB VAL 39 HB VAL 39 5.642 -2.438 4.192 324 HG11 VAL 39 HG11 VAL 39 4.565 -3.390 6.161 325 HG12 VAL 39 HG12 VAL 39 4.856 -5.009 5.526 326 HG13 VAL 39 HG13 VAL 39 3.794 -3.900 4.659 327 HG21 VAL 39 HG21 VAL 39 7.909 -2.886 4.817 328 HG22 VAL 39 HG22 VAL 39 7.459 -4.435 5.533 329 HG23 VAL 39 HG23 VAL 39 6.911 -2.925 6.270 330 H ALA 40 HN ALA 40 7.972 -6.019 3.365 331 HA ALA 40 HA ALA 40 6.055 -8.224 3.663 332 HB1 ALA 40 HB1 ALA 40 8.342 -8.215 1.714 333 HB2 ALA 40 HB2 ALA 40 6.659 -7.925 1.289 334 HB3 ALA 40 HB3 ALA 40 7.145 -9.485 1.946 335 H ARG 41 HN ARG 41 6.692 -9.789 5.020 336 HA ARG 41 HA ARG 41 9.387 -9.622 6.149 337 HB2 ARG 41 HB2 ARG 41 6.884 -11.069 6.968 338 HB3 ARG 41 HB1 ARG 41 8.447 -11.458 7.672 339 HG2 ARG 41 HG2 ARG 41 7.828 -8.606 7.672 340 HG3 ARG 41 HG1 ARG 41 6.728 -9.586 8.623 341 HD2 ARG 41 HD2 ARG 41 8.691 -10.607 9.746 342 HD3 ARG 41 HD1 ARG 41 9.717 -9.475 8.872 343 HE ARG 41 HE ARG 41 7.732 -8.034 10.234 344 HH11 ARG 41 HH11 ARG 41 10.587 -9.948 10.898 345 HH12 ARG 41 HH12 ARG 41 10.921 -9.152 12.405 346 HH21 ARG 41 HH21 ARG 41 8.183 -6.970 12.208 347 HH22 ARG 41 HH22 ARG 41 9.553 -7.461 13.149 348 H LEU 42 HN LEU 42 10.949 -10.976 5.497 349 HA LEU 42 HA LEU 42 10.395 -12.782 3.374 350 HB2 LEU 42 HB2 LEU 42 12.832 -12.119 4.964 351 HB3 LEU 42 HB1 LEU 42 12.851 -13.493 3.877 352 HG LEU 42 HG LEU 42 12.174 -10.676 3.031 353 HD11 LEU 42 HD11 LEU 42 14.400 -10.650 2.004 354 HD12 LEU 42 HD12 LEU 42 14.751 -12.210 2.749 355 HD13 LEU 42 HD13 LEU 42 14.484 -10.790 3.759 356 HD21 LEU 42 HD21 LEU 42 11.185 -12.364 1.590 357 HD22 LEU 42 HD22 LEU 42 12.742 -13.179 1.440 358 HD23 LEU 42 HD23 LEU 42 12.523 -11.566 0.761 359 H LYS 43 HN LYS 43 10.569 -15.042 3.295 360 HA LYS 43 HA LYS 43 9.013 -16.260 5.268 361 HB2 LYS 43 HB2 LYS 43 9.158 -16.909 2.883 362 HB3 LYS 43 HB1 LYS 43 10.743 -17.582 3.206 363 HG2 LYS 43 HG2 LYS 43 9.756 -19.194 4.746 364 HG3 LYS 43 HG1 LYS 43 8.157 -18.517 4.418 365 HD2 LYS 43 HD2 LYS 43 8.504 -19.056 2.006 366 HD3 LYS 43 HD1 LYS 43 9.999 -19.877 2.457 367 HE2 LYS 43 HE2 LYS 43 8.760 -21.427 3.856 368 HE3 LYS 43 HE1 LYS 43 7.257 -20.580 3.492 369 HZ1 LYS 43 HZ1 LYS 43 8.961 -21.911 1.463 370 HZ2 LYS 43 HZ2 LYS 43 7.434 -21.226 1.212 371 HZ3 LYS 43 HZ3 LYS 43 7.591 -22.611 2.167 372 H ASN 44 HN ASN 44 12.341 -17.203 4.413 373 HA ASN 44 HA ASN 44 12.598 -18.544 6.968 374 HB2 ASN 44 HB2 ASN 44 14.388 -18.343 4.575 375 HB3 ASN 44 HB1 ASN 44 14.912 -19.092 6.075 376 HD21 ASN 44 HD21 ASN 44 12.881 -19.379 3.284 377 HD22 ASN 44 HD22 ASN 44 12.412 -21.024 3.535 378 H ASN 45 HN ASN 45 13.497 -15.576 5.504 379 HA ASN 45 HA ASN 45 15.722 -15.153 7.269 380 HB2 ASN 45 HB2 ASN 45 15.611 -14.407 4.848 381 HB3 ASN 45 HB1 ASN 45 14.557 -13.130 5.420 382 HD21 ASN 45 HD21 ASN 45 16.118 -11.626 4.653 383 HD22 ASN 45 HD22 ASN 45 17.541 -11.294 5.574 384 H ASN 46 HN ASN 46 12.358 -14.255 7.125 385 HA ASN 46 HA ASN 46 10.972 -13.419 8.697 386 HB2 ASN 46 HB2 ASN 46 13.381 -13.745 10.460 387 HB3 ASN 46 HB1 ASN 46 11.833 -13.167 11.063 388 HD21 ASN 46 HD21 ASN 46 13.297 -15.567 11.760 389 HD22 ASN 46 HD22 ASN 46 12.254 -16.898 11.402 390 H ARG 47 HN ARG 47 13.540 -11.656 7.566 391 HA ARG 47 HA ARG 47 13.179 -9.326 9.155 392 HB2 ARG 47 HB2 ARG 47 14.510 -9.544 6.465 393 HB3 ARG 47 HB1 ARG 47 14.767 -8.300 7.683 394 HG2 ARG 47 HG2 ARG 47 15.567 -10.207 9.176 395 HG3 ARG 47 HG1 ARG 47 15.644 -11.160 7.699 396 HD2 ARG 47 HD2 ARG 47 17.052 -9.314 6.729 397 HD3 ARG 47 HD1 ARG 47 17.143 -8.646 8.357 398 HE ARG 47 HE ARG 47 17.944 -11.230 8.663 399 HH11 ARG 47 HH11 ARG 47 18.960 -8.589 6.613 400 HH12 ARG 47 HH12 ARG 47 20.614 -9.105 6.542 401 HH21 ARG 47 HH21 ARG 47 20.136 -11.924 8.560 402 HH22 ARG 47 HH22 ARG 47 21.277 -11.005 7.630 403 H GLN 48 HN GLN 48 12.177 -7.479 8.645 404 HA GLN 48 HA GLN 48 10.002 -7.664 6.746 405 HB2 GLN 48 HB2 GLN 48 9.643 -6.760 9.027 406 HB3 GLN 48 HB1 GLN 48 10.691 -5.406 8.632 407 HG2 GLN 48 HG2 GLN 48 9.149 -4.841 6.780 408 HG3 GLN 48 HG1 GLN 48 8.066 -6.102 7.359 409 HE21 GLN 48 HE21 GLN 48 9.404 -2.966 7.975 410 HE22 GLN 48 HE22 GLN 48 8.306 -2.516 9.235 411 H VAL 49 HN VAL 49 10.100 -6.838 4.805 412 HA VAL 49 HA VAL 49 12.215 -4.902 4.089 413 HB VAL 49 HB VAL 49 11.324 -6.613 1.933 414 HG11 VAL 49 HG11 VAL 49 13.750 -6.798 1.498 415 HG12 VAL 49 HG12 VAL 49 14.038 -5.867 2.968 416 HG13 VAL 49 HG13 VAL 49 13.168 -5.137 1.619 417 HG21 VAL 49 HG21 VAL 49 11.200 -8.287 3.646 418 HG22 VAL 49 HG22 VAL 49 12.842 -7.902 4.170 419 HG23 VAL 49 HG23 VAL 49 12.567 -8.603 2.576 420 H CYS 50 HN CYS 50 11.626 -4.255 1.666 421 HA CYS 50 HA CYS 50 8.746 -3.920 1.397 422 HB2 CYS 50 HB2 CYS 50 10.853 -1.811 0.913 423 HB3 CYS 50 HB1 CYS 50 9.168 -1.672 0.472 424 H ILE 51 HN ILE 51 8.065 -4.674 -0.466 425 HA ILE 51 HA ILE 51 9.944 -5.715 -2.385 426 HB ILE 51 HB ILE 51 7.027 -5.658 -3.003 427 HG12 ILE 51 HG12 ILE 51 8.213 -7.384 -0.808 428 HG13 ILE 51 HG11 ILE 51 7.004 -6.123 -0.590 429 HG21 ILE 51 HG21 ILE 51 8.991 -6.818 -4.273 430 HG22 ILE 51 HG22 ILE 51 7.454 -7.656 -4.075 431 HG23 ILE 51 HG23 ILE 51 8.814 -8.053 -3.024 432 HD11 ILE 51 HD11 ILE 51 5.433 -7.435 -1.968 433 HD12 ILE 51 HD12 ILE 51 5.961 -8.296 -0.526 434 HD13 ILE 51 HD13 ILE 51 6.645 -8.706 -2.095 435 H ASP 52 HN ASP 52 10.218 -5.044 -4.502 436 HA ASP 52 HA ASP 52 9.810 -2.251 -4.986 437 HB2 ASP 52 HB2 ASP 52 11.769 -3.716 -5.790 438 HB3 ASP 52 HB1 ASP 52 10.677 -4.272 -7.049 439 HA PRO 53 HA PRO 53 5.720 -2.625 -6.692 440 HB2 PRO 53 HB2 PRO 53 5.626 -0.170 -7.862 441 HB3 PRO 53 HB1 PRO 53 5.396 -0.436 -6.132 442 HG2 PRO 53 HG2 PRO 53 7.867 0.404 -7.591 443 HG3 PRO 53 HG1 PRO 53 7.179 1.058 -6.101 444 HD2 PRO 53 HD2 PRO 53 9.229 -0.635 -6.051 445 HD3 PRO 53 HD1 PRO 53 7.946 -0.709 -4.835 446 H LYS 54 HN LYS 54 8.601 -2.191 -8.476 447 HA LYS 54 HA LYS 54 7.272 -2.200 -11.057 448 HB2 LYS 54 HB2 LYS 54 10.171 -2.069 -10.302 449 HB3 LYS 54 HB1 LYS 54 9.591 -2.103 -11.965 450 HG2 LYS 54 HG2 LYS 54 8.290 -0.075 -11.547 451 HG3 LYS 54 HG1 LYS 54 8.904 -0.047 -9.899 452 HD2 LYS 54 HD2 LYS 54 10.593 0.105 -12.373 453 HD3 LYS 54 HD1 LYS 54 10.113 1.495 -11.398 454 HE2 LYS 54 HE2 LYS 54 11.799 -0.835 -10.533 455 HE3 LYS 54 HE1 LYS 54 12.365 0.807 -10.825 456 HZ1 LYS 54 HZ1 LYS 54 10.678 -0.204 -8.613 457 HZ2 LYS 54 HZ2 LYS 54 10.727 1.446 -9.002 458 HZ3 LYS 54 HZ3 LYS 54 12.141 0.649 -8.526 459 H LEU 55 HN LEU 55 8.270 -4.470 -8.838 460 HA LEU 55 HA LEU 55 9.226 -6.579 -10.399 461 HB2 LEU 55 HB2 LEU 55 7.880 -6.232 -7.779 462 HB3 LEU 55 HB1 LEU 55 7.954 -7.863 -8.426 463 HG LEU 55 HG LEU 55 10.392 -6.118 -8.113 464 HD11 LEU 55 HD11 LEU 55 9.166 -8.038 -6.150 465 HD12 LEU 55 HD12 LEU 55 9.494 -6.316 -5.929 466 HD13 LEU 55 HD13 LEU 55 10.831 -7.460 -6.060 467 HD21 LEU 55 HD21 LEU 55 10.017 -9.090 -8.415 468 HD22 LEU 55 HD22 LEU 55 11.561 -8.261 -8.200 469 HD23 LEU 55 HD23 LEU 55 10.600 -7.977 -9.652 470 H LYS 56 HN LYS 56 8.241 -8.135 -11.584 471 HA LYS 56 HA LYS 56 5.874 -7.354 -12.910 472 HB2 LYS 56 HB2 LYS 56 7.433 -9.937 -12.999 473 HB3 LYS 56 HB1 LYS 56 6.042 -9.617 -14.019 474 HG2 LYS 56 HG2 LYS 56 7.826 -9.123 -15.396 475 HG3 LYS 56 HG1 LYS 56 7.357 -7.537 -14.784 476 HD2 LYS 56 HD2 LYS 56 9.150 -7.595 -13.160 477 HD3 LYS 56 HD1 LYS 56 9.577 -9.236 -13.647 478 HE2 LYS 56 HE2 LYS 56 10.064 -8.382 -15.919 479 HE3 LYS 56 HE1 LYS 56 9.746 -6.748 -15.344 480 HZ1 LYS 56 HZ1 LYS 56 11.567 -6.983 -13.782 481 HZ2 LYS 56 HZ2 LYS 56 12.107 -7.247 -15.362 482 HZ3 LYS 56 HZ3 LYS 56 11.864 -8.558 -14.320 483 H TRP 57 HN TRP 57 6.491 -9.547 -10.263 484 HA TRP 57 HA TRP 57 3.796 -10.596 -10.394 485 HB2 TRP 57 HB2 TRP 57 4.398 -12.040 -8.641 486 HB3 TRP 57 HB1 TRP 57 5.831 -11.925 -9.635 487 HD1 TRP 57 HD1 TRP 57 7.981 -10.892 -8.524 488 HE1 TRP 57 HE1 TRP 57 8.612 -10.372 -6.073 489 HE3 TRP 57 HE3 TRP 57 3.336 -11.138 -6.453 490 HZ2 TRP 57 HZ2 TRP 57 7.284 -10.115 -3.593 491 HZ3 TRP 57 HZ3 TRP 57 3.088 -10.737 -4.050 492 HH2 TRP 57 HH2 TRP 57 5.022 -10.241 -2.639 493 H ILE 58 HN ILE 58 5.520 -8.060 -8.877 494 HA ILE 58 HA ILE 58 3.648 -7.561 -6.765 495 HB ILE 58 HB ILE 58 5.976 -6.068 -7.918 496 HG12 ILE 58 HG12 ILE 58 6.387 -7.886 -6.332 497 HG13 ILE 58 HG11 ILE 58 6.845 -6.330 -5.644 498 HG21 ILE 58 HG21 ILE 58 4.458 -4.308 -7.506 499 HG22 ILE 58 HG22 ILE 58 5.585 -4.352 -6.143 500 HG23 ILE 58 HG23 ILE 58 3.960 -5.011 -5.966 501 HD11 ILE 58 HD11 ILE 58 4.736 -6.276 -4.408 502 HD12 ILE 58 HD12 ILE 58 5.703 -7.691 -4.007 503 HD13 ILE 58 HD13 ILE 58 4.320 -7.851 -5.075 504 H GLN 59 HN GLN 59 4.189 -6.272 -10.015 505 HA GLN 59 HA GLN 59 2.295 -4.242 -10.097 506 HB2 GLN 59 HB2 GLN 59 3.196 -6.259 -12.104 507 HB3 GLN 59 HB1 GLN 59 2.032 -5.020 -12.539 508 HG2 GLN 59 HG2 GLN 59 4.737 -4.440 -11.404 509 HG3 GLN 59 HG1 GLN 59 4.435 -4.588 -13.133 510 HE21 GLN 59 HE21 GLN 59 4.087 -2.611 -10.337 511 HE22 GLN 59 HE22 GLN 59 3.436 -1.226 -11.144 512 H GLU 60 HN GLU 60 1.917 -7.670 -10.194 513 HA GLU 60 HA GLU 60 -0.863 -7.649 -10.886 514 HB2 GLU 60 HB2 GLU 60 0.799 -9.842 -9.619 515 HB3 GLU 60 HB1 GLU 60 -0.774 -10.038 -10.370 516 HG2 GLU 60 HG2 GLU 60 1.757 -9.193 -11.745 517 HG3 GLU 60 HG1 GLU 60 1.008 -10.784 -11.842 518 H TYR 61 HN TYR 61 1.004 -7.767 -7.898 519 HA TYR 61 HA TYR 61 -1.292 -8.213 -6.223 520 HB2 TYR 61 HB2 TYR 61 0.985 -8.860 -5.484 521 HB3 TYR 61 HB1 TYR 61 1.471 -7.175 -5.517 522 HD1 TYR 61 HD1 TYR 61 0.008 -9.766 -3.571 523 HD2 TYR 61 HD2 TYR 61 0.294 -5.557 -3.985 524 HE1 TYR 61 HE1 TYR 61 -0.747 -9.492 -1.265 525 HE2 TYR 61 HE2 TYR 61 -0.484 -5.271 -1.666 526 HH TYR 61 HH TYR 61 -0.648 -7.855 0.545 527 H LEU 62 HN LEU 62 0.567 -5.571 -7.439 528 HA LEU 62 HA LEU 62 -0.354 -3.396 -6.046 529 HB2 LEU 62 HB2 LEU 62 1.034 -3.950 -8.438 530 HB3 LEU 62 HB1 LEU 62 -0.183 -2.739 -8.809 531 HG LEU 62 HG LEU 62 0.730 -1.402 -6.857 532 HD11 LEU 62 HD11 LEU 62 1.925 -2.989 -5.628 533 HD12 LEU 62 HD12 LEU 62 3.163 -1.978 -6.385 534 HD13 LEU 62 HD13 LEU 62 2.779 -3.571 -7.057 535 HD21 LEU 62 HD21 LEU 62 2.533 -1.943 -9.211 536 HD22 LEU 62 HD22 LEU 62 2.618 -0.532 -8.157 537 HD23 LEU 62 HD23 LEU 62 1.193 -0.797 -9.161 538 H GLU 63 HN GLU 63 -1.804 -5.076 -8.767 539 HA GLU 63 HA GLU 63 -3.844 -3.394 -9.436 540 HB2 GLU 63 HB2 GLU 63 -4.238 -6.335 -9.094 541 HB3 GLU 63 HB1 GLU 63 -4.985 -5.290 -10.277 542 HG2 GLU 63 HG2 GLU 63 -2.803 -5.041 -11.380 543 HG3 GLU 63 HG1 GLU 63 -2.117 -6.121 -10.185 544 H LYS 64 HN LYS 64 -3.729 -5.773 -6.853 545 HA LYS 64 HA LYS 64 -6.343 -5.288 -5.839 546 HB2 LYS 64 HB2 LYS 64 -3.934 -6.698 -4.699 547 HB3 LYS 64 HB1 LYS 64 -5.512 -6.670 -3.917 548 HG2 LYS 64 HG2 LYS 64 -5.557 -8.697 -5.022 549 HG3 LYS 64 HG1 LYS 64 -6.358 -7.628 -6.168 550 HD2 LYS 64 HD2 LYS 64 -4.226 -7.367 -7.376 551 HD3 LYS 64 HD1 LYS 64 -3.486 -8.524 -6.270 552 HE2 LYS 64 HE2 LYS 64 -5.062 -10.238 -6.991 553 HE3 LYS 64 HE1 LYS 64 -5.842 -9.083 -8.069 554 HZ1 LYS 64 HZ1 LYS 64 -3.005 -9.931 -8.278 555 HZ2 LYS 64 HZ2 LYS 64 -3.835 -8.930 -9.363 556 HZ3 LYS 64 HZ3 LYS 64 -4.266 -10.561 -9.212 557 H ALA 65 HN ALA 65 -3.069 -4.390 -4.893 558 HA ALA 65 HA ALA 65 -3.689 -3.052 -2.512 559 HB1 ALA 65 HB1 ALA 65 -1.419 -2.567 -4.427 560 HB2 ALA 65 HB2 ALA 65 -1.440 -3.764 -3.134 561 HB3 ALA 65 HB3 ALA 65 -1.477 -2.041 -2.742 562 H LEU 66 HN LEU 66 -4.173 -2.162 -5.755 563 HA LEU 66 HA LEU 66 -4.299 0.704 -5.125 564 HB2 LEU 66 HB2 LEU 66 -3.856 -0.857 -7.607 565 HB3 LEU 66 HB1 LEU 66 -4.645 0.696 -7.757 566 HG LEU 66 HG LEU 66 -2.248 0.838 -8.166 567 HD11 LEU 66 HD11 LEU 66 -1.738 2.688 -6.659 568 HD12 LEU 66 HD12 LEU 66 -3.071 2.209 -5.611 569 HD13 LEU 66 HD13 LEU 66 -3.398 2.785 -7.244 570 HD21 LEU 66 HD21 LEU 66 -1.518 -0.985 -6.771 571 HD22 LEU 66 HD22 LEU 66 -2.005 -0.103 -5.324 572 HD23 LEU 66 HD23 LEU 66 -0.668 0.496 -6.315 573 H ASN 67 HN ASN 67 -6.192 -1.978 -5.654 574 HA ASN 67 HA ASN 67 -8.409 -1.043 -7.027 575 HB2 ASN 67 HB2 ASN 67 -9.372 -3.021 -6.518 576 HB3 ASN 67 HB1 ASN 67 -7.792 -3.423 -5.900 577 HD21 ASN 67 HD21 ASN 67 -7.457 -3.417 -3.654 578 HD22 ASN 67 HD22 ASN 67 -8.796 -3.536 -2.557 579 H LYS 68 HN LYS 68 -7.638 -0.743 -3.648 580 HA LYS 68 HA LYS 68 -9.998 0.957 -3.283 581 HB2 LYS 68 HB2 LYS 68 -8.403 -0.699 -1.374 582 HB3 LYS 68 HB1 LYS 68 -9.300 0.699 -0.787 583 HG2 LYS 68 HG2 LYS 68 -11.344 -0.277 -1.835 584 HG3 LYS 68 HG1 LYS 68 -10.401 -1.726 -2.187 585 HD2 LYS 68 HD2 LYS 68 -10.060 -2.161 0.129 586 HD3 LYS 68 HD1 LYS 68 -10.705 -0.583 0.580 587 HE2 LYS 68 HE2 LYS 68 -12.241 -2.833 -0.703 588 HE3 LYS 68 HE1 LYS 68 -12.315 -2.355 0.991 589 HZ1 LYS 68 HZ1 LYS 68 -13.068 -0.123 0.184 590 HZ2 LYS 68 HZ2 LYS 68 -14.164 -1.384 -0.092 591 HZ3 LYS 68 HZ3 LYS 68 -13.219 -0.796 -1.365 592 H GLY 69 HN GLY 69 -9.821 3.023 -2.803 593 HA2 GLY 69 HA2 GLY 69 -8.793 4.931 -1.866 594 HA3 GLY 69 HA1 GLY 69 -7.256 4.073 -1.889 595 H ARG 70 HN ARG 70 -5.921 5.140 -3.159 596 HA ARG 70 HA ARG 70 -4.973 6.079 -4.978 597 HB2 ARG 70 HB2 ARG 70 -5.790 3.903 -5.951 598 HB3 ARG 70 HB1 ARG 70 -7.182 4.776 -6.568 599 HG2 ARG 70 HG2 ARG 70 -5.733 6.170 -7.931 600 HG3 ARG 70 HG1 ARG 70 -4.311 5.355 -7.272 601 HD2 ARG 70 HD2 ARG 70 -5.228 3.208 -8.157 602 HD3 ARG 70 HD1 ARG 70 -6.496 4.136 -8.949 603 HE ARG 70 HE ARG 70 -4.155 5.273 -9.810 604 HH11 ARG 70 HH11 ARG 70 -5.548 2.060 -9.860 605 HH12 ARG 70 HH12 ARG 70 -4.750 1.594 -11.328 606 HH21 ARG 70 HH21 ARG 70 -3.114 4.659 -11.769 607 HH22 ARG 70 HH22 ARG 70 -3.377 3.070 -12.415 608 H ARG 71 HN ARG 71 -8.205 6.242 -6.435 609 HA ARG 71 HA ARG 71 -8.195 9.143 -5.951 610 HB2 ARG 71 HB2 ARG 71 -8.693 7.752 -8.577 611 HB3 ARG 71 HB1 ARG 71 -9.104 9.431 -8.279 612 HG2 ARG 71 HG2 ARG 71 -6.783 9.976 -7.910 613 HG3 ARG 71 HG1 ARG 71 -6.332 8.279 -8.079 614 HD2 ARG 71 HD2 ARG 71 -7.556 10.023 -10.214 615 HD3 ARG 71 HD1 ARG 71 -5.873 9.503 -10.131 616 HE ARG 71 HE ARG 71 -8.002 7.490 -10.303 617 HH11 ARG 71 HH11 ARG 71 -5.288 9.138 -11.781 618 HH12 ARG 71 HH12 ARG 71 -5.062 7.929 -13.005 619 HH21 ARG 71 HH21 ARG 71 -7.702 5.898 -11.900 620 HH22 ARG 71 HH22 ARG 71 -6.433 6.082 -13.070 621 H GLU 72 HN GLU 72 -9.803 6.361 -5.417 622 HA GLU 72 HA GLU 72 -12.442 7.633 -5.718 623 HB2 GLU 72 HB2 GLU 72 -11.776 4.690 -5.583 624 HB3 GLU 72 HB1 GLU 72 -13.398 5.362 -5.703 625 HG2 GLU 72 HG2 GLU 72 -12.751 6.402 -7.855 626 HG3 GLU 72 HG1 GLU 72 -11.201 5.575 -7.744 627 H GLU 73 HN GLU 73 -11.054 5.075 -3.636 628 HA GLU 73 HA GLU 73 -12.674 6.015 -1.426 629 HB2 GLU 73 HB2 GLU 73 -12.268 3.580 -1.895 630 HB3 GLU 73 HB1 GLU 73 -10.594 3.820 -1.428 631 HG2 GLU 73 HG2 GLU 73 -11.307 4.467 0.815 632 HG3 GLU 73 HG1 GLU 73 -12.991 4.236 0.347 633 H LYS 74 HN LYS 74 -11.455 8.136 -1.715 634 HA LYS 74 HA LYS 74 -8.795 8.211 -0.559 635 HB2 LYS 74 HB2 LYS 74 -10.630 10.421 -1.502 636 HB3 LYS 74 HB1 LYS 74 -8.979 10.659 -0.950 637 HG2 LYS 74 HG2 LYS 74 -8.096 9.462 -2.798 638 HG3 LYS 74 HG1 LYS 74 -9.697 8.893 -3.273 639 HD2 LYS 74 HD2 LYS 74 -8.838 11.786 -3.260 640 HD3 LYS 74 HD1 LYS 74 -8.848 10.750 -4.688 641 HE2 LYS 74 HE2 LYS 74 -11.282 10.382 -4.329 642 HE3 LYS 74 HE1 LYS 74 -11.224 11.552 -3.011 643 HZ1 LYS 74 HZ1 LYS 74 -10.543 13.244 -4.570 644 HZ2 LYS 74 HZ2 LYS 74 -11.987 12.537 -5.087 645 HZ3 LYS 74 HZ3 LYS 74 -10.531 12.126 -5.837 646 H VAL 75 HN VAL 75 -9.958 7.148 1.391 647 HA VAL 75 HA VAL 75 -10.191 9.189 3.410 648 HB VAL 75 HB VAL 75 -12.500 9.114 2.626 649 HG11 VAL 75 HG11 VAL 75 -12.408 6.171 3.272 650 HG12 VAL 75 HG12 VAL 75 -12.561 6.889 1.669 651 HG13 VAL 75 HG13 VAL 75 -13.860 7.078 2.847 652 HG21 VAL 75 HG21 VAL 75 -12.094 9.489 5.005 653 HG22 VAL 75 HG22 VAL 75 -12.199 7.754 5.296 654 HG23 VAL 75 HG23 VAL 75 -13.616 8.640 4.738 655 H GLY 76 HN GLY 76 -9.322 8.503 5.249 656 HA2 GLY 76 HA2 GLY 76 -9.220 5.588 5.749 657 HA3 GLY 76 HA1 GLY 76 -7.866 6.657 6.105 658 H LYS 77 HN LYS 77 -11.297 7.202 6.589 659 HA LYS 77 HA LYS 77 -12.585 7.624 8.388 660 HB2 LYS 77 HB2 LYS 77 -10.351 6.337 9.963 661 HB3 LYS 77 HB1 LYS 77 -11.916 6.791 10.625 662 HG2 LYS 77 HG2 LYS 77 -13.011 5.236 9.079 663 HG3 LYS 77 HG1 LYS 77 -11.430 4.767 8.452 664 HD2 LYS 77 HD2 LYS 77 -10.789 4.010 10.710 665 HD3 LYS 77 HD1 LYS 77 -12.406 4.420 11.285 666 HE2 LYS 77 HE2 LYS 77 -12.240 2.040 10.826 667 HE3 LYS 77 HE1 LYS 77 -13.367 2.808 9.711 668 HZ1 LYS 77 HZ1 LYS 77 -11.645 2.822 8.027 669 HZ2 LYS 77 HZ2 LYS 77 -11.901 1.249 8.583 670 HZ3 LYS 77 HZ3 LYS 77 -10.546 2.114 9.099 671 H LYS 78 HN LYS 78 -12.687 9.767 8.345 672 HA LYS 78 HA LYS 78 -12.517 11.889 9.102 673 HB2 LYS 78 HB2 LYS 78 -10.965 10.628 11.367 674 HB3 LYS 78 HB1 LYS 78 -11.615 12.260 11.364 675 HG2 LYS 78 HG2 LYS 78 -13.257 9.744 11.167 676 HG3 LYS 78 HG1 LYS 78 -13.009 10.689 12.635 677 HD2 LYS 78 HD2 LYS 78 -14.131 12.586 11.667 678 HD3 LYS 78 HD1 LYS 78 -14.244 11.772 10.106 679 HE2 LYS 78 HE2 LYS 78 -16.372 11.697 11.292 680 HE3 LYS 78 HE1 LYS 78 -15.703 10.081 11.081 681 HZ1 LYS 78 HZ1 LYS 78 -16.589 10.379 13.296 682 HZ2 LYS 78 HZ2 LYS 78 -15.567 11.702 13.564 683 HZ3 LYS 78 HZ3 LYS 78 -14.915 10.156 13.366 684 H GLU 79 HN GLU 79 -11.259 12.392 7.251 685 HA GLU 79 HA GLU 79 -8.419 12.247 7.261 686 HB2 GLU 79 HB2 GLU 79 -10.350 13.734 5.480 687 HB3 GLU 79 HB1 GLU 79 -8.610 13.712 5.221 688 HG2 GLU 79 HG2 GLU 79 -10.506 11.383 5.126 689 HG3 GLU 79 HG1 GLU 79 -9.581 12.080 3.795 690 H LYS 80 HN LYS 80 -6.955 13.608 7.951 691 HA LYS 80 HA LYS 80 -5.910 15.433 8.779 692 HB2 LYS 80 HB2 LYS 80 -8.256 16.962 7.638 693 HB3 LYS 80 HB1 LYS 80 -6.745 17.669 8.191 694 HG2 LYS 80 HG2 LYS 80 -6.997 15.710 5.920 695 HG3 LYS 80 HG1 LYS 80 -6.879 17.460 5.741 696 HD2 LYS 80 HD2 LYS 80 -4.686 17.430 6.803 697 HD3 LYS 80 HD1 LYS 80 -4.807 15.685 7.028 698 HE2 LYS 80 HE2 LYS 80 -3.426 16.304 5.081 699 HE3 LYS 80 HE1 LYS 80 -4.830 15.334 4.643 700 HZ1 LYS 80 HZ1 LYS 80 -5.960 17.311 3.911 701 HZ2 LYS 80 HZ2 LYS 80 -4.463 17.210 3.130 702 HZ3 LYS 80 HZ3 LYS 80 -4.676 18.291 4.413 703 H ILE 81 HN ILE 81 -7.992 13.934 10.270 704 HA ILE 81 HA ILE 81 -8.531 15.971 12.335 705 HB ILE 81 HB ILE 81 -10.148 13.487 11.734 706 HG12 ILE 81 HG12 ILE 81 -10.859 16.414 11.429 707 HG13 ILE 81 HG11 ILE 81 -10.452 15.328 10.104 708 HG21 ILE 81 HG21 ILE 81 -11.694 14.316 13.453 709 HG22 ILE 81 HG22 ILE 81 -10.575 15.630 13.817 710 HG23 ILE 81 HG23 ILE 81 -10.101 13.959 14.122 711 HD11 ILE 81 HD11 ILE 81 -12.420 13.999 10.556 712 HD12 ILE 81 HD12 ILE 81 -12.862 15.690 10.325 713 HD13 ILE 81 HD13 ILE 81 -12.807 15.007 11.948 714 H GLY 82 HN GLY 82 -7.627 12.631 11.652 715 HA2 GLY 82 HA2 GLY 82 -7.014 12.093 14.433 716 HA3 GLY 82 HA1 GLY 82 -6.790 10.993 13.081 717 H LYS 83 HN LYS 83 -5.538 14.153 14.119 718 HA LYS 83 HA LYS 83 -2.829 13.097 13.893 719 HB2 LYS 83 HB2 LYS 83 -2.090 15.105 12.629 720 HB3 LYS 83 HB1 LYS 83 -3.175 14.065 11.718 721 HG2 LYS 83 HG2 LYS 83 -5.021 15.593 12.137 722 HG3 LYS 83 HG1 LYS 83 -3.965 16.621 13.109 723 HD2 LYS 83 HD2 LYS 83 -2.542 16.988 11.131 724 HD3 LYS 83 HD1 LYS 83 -3.650 16.008 10.169 725 HE2 LYS 83 HE2 LYS 83 -4.112 18.351 9.812 726 HE3 LYS 83 HE1 LYS 83 -5.456 17.606 10.671 727 HZ1 LYS 83 HZ1 LYS 83 -3.298 19.195 11.950 728 HZ2 LYS 83 HZ2 LYS 83 -4.660 18.558 12.718 729 HZ3 LYS 83 HZ3 LYS 83 -4.835 19.785 11.569 730 H LYS 84 HN LYS 84 -3.862 13.388 16.270 731 HA LYS 84 HA LYS 84 -3.455 16.026 17.349 732 HB2 LYS 84 HB2 LYS 84 -5.096 14.523 18.366 733 HB3 LYS 84 HB1 LYS 84 -3.828 13.362 18.737 734 HG2 LYS 84 HG2 LYS 84 -2.787 14.956 20.251 735 HG3 LYS 84 HG1 LYS 84 -4.020 16.150 19.855 736 HD2 LYS 84 HD2 LYS 84 -4.587 13.463 21.102 737 HD3 LYS 84 HD1 LYS 84 -4.408 14.964 22.009 738 HE2 LYS 84 HE2 LYS 84 -6.471 14.441 19.872 739 HE3 LYS 84 HE1 LYS 84 -6.765 14.397 21.608 740 HZ1 LYS 84 HZ1 LYS 84 -5.871 16.783 20.077 741 HZ2 LYS 84 HZ2 LYS 84 -6.198 16.735 21.735 742 HZ3 LYS 84 HZ3 LYS 84 -7.447 16.499 20.622 743 H LYS 85 HN LYS 85 -1.557 16.878 17.838 744 HA LYS 85 HA LYS 85 0.860 15.341 17.759 745 HB2 LYS 85 HB2 LYS 85 0.467 18.187 18.705 746 HB3 LYS 85 HB1 LYS 85 1.987 17.437 18.239 747 HG2 LYS 85 HG2 LYS 85 1.116 17.176 15.945 748 HG3 LYS 85 HG1 LYS 85 -0.350 18.025 16.435 749 HD2 LYS 85 HD2 LYS 85 1.093 19.605 15.365 750 HD3 LYS 85 HD1 LYS 85 1.083 19.963 17.091 751 HE2 LYS 85 HE2 LYS 85 3.343 20.101 16.223 752 HE3 LYS 85 HE1 LYS 85 3.205 18.746 17.341 753 HZ1 LYS 85 HZ1 LYS 85 3.162 18.573 14.376 754 HZ2 LYS 85 HZ2 LYS 85 2.992 17.264 15.432 755 HZ3 LYS 85 HZ3 LYS 85 4.443 18.124 15.381 756 H ARG 86 HN ARG 86 -1.312 16.470 20.189 757 HA ARG 86 HA ARG 86 0.440 15.876 22.411 758 HB2 ARG 86 HB2 ARG 86 -1.399 17.663 22.349 759 HB3 ARG 86 HB1 ARG 86 -2.543 16.341 22.503 760 HG2 ARG 86 HG2 ARG 86 -2.145 17.366 24.651 761 HG3 ARG 86 HG1 ARG 86 -1.521 15.715 24.640 762 HD2 ARG 86 HD2 ARG 86 -0.006 17.339 25.738 763 HD3 ARG 86 HD1 ARG 86 0.729 16.509 24.370 764 HE ARG 86 HE ARG 86 -0.238 18.802 23.281 765 HH11 ARG 86 HH11 ARG 86 1.866 18.118 25.998 766 HH12 ARG 86 HH12 ARG 86 2.751 19.603 25.844 767 HH21 ARG 86 HH21 ARG 86 0.957 20.739 23.059 768 HH22 ARG 86 HH22 ARG 86 2.250 21.080 24.168 769 H GLN 87 HN GLN 87 0.320 13.738 20.769 770 HA GLN 87 HA GLN 87 -1.740 11.874 21.523 771 HB2 GLN 87 HB2 GLN 87 -0.306 10.291 20.115 772 HB3 GLN 87 HB1 GLN 87 -1.028 11.667 19.293 773 HG2 GLN 87 HG2 GLN 87 1.117 12.867 19.474 774 HG3 GLN 87 HG1 GLN 87 1.826 11.439 20.225 775 HE21 GLN 87 HE21 GLN 87 2.445 12.865 17.699 776 HE22 GLN 87 HE22 GLN 87 2.367 11.651 16.470 777 H LYS 88 HN LYS 88 1.575 12.508 22.402 778 HA LYS 88 HA LYS 88 1.293 10.752 24.687 779 HB2 LYS 88 HB2 LYS 88 2.271 9.344 22.821 780 HB3 LYS 88 HB1 LYS 88 3.666 10.413 22.845 781 HG2 LYS 88 HG2 LYS 88 3.985 9.821 25.250 782 HG3 LYS 88 HG1 LYS 88 2.705 8.622 25.064 783 HD2 LYS 88 HD2 LYS 88 4.848 7.542 24.828 784 HD3 LYS 88 HD1 LYS 88 4.027 7.549 23.267 785 HE2 LYS 88 HE2 LYS 88 5.376 9.379 22.498 786 HE3 LYS 88 HE1 LYS 88 6.094 9.580 24.095 787 HZ1 LYS 88 HZ1 LYS 88 7.142 7.435 23.878 788 HZ2 LYS 88 HZ2 LYS 88 7.557 8.404 22.555 789 HZ3 LYS 88 HZ3 LYS 88 6.404 7.182 22.379 790 H LYS 89 HN LYS 89 1.196 13.050 25.372 791 HA LYS 89 HA LYS 89 2.034 14.899 26.349 792 HB2 LYS 89 HB2 LYS 89 3.366 13.351 27.682 793 HB3 LYS 89 HB1 LYS 89 4.597 13.298 26.431 794 HG2 LYS 89 HG2 LYS 89 5.049 15.683 26.792 795 HG3 LYS 89 HG1 LYS 89 3.837 15.703 28.074 796 HD2 LYS 89 HD2 LYS 89 5.126 14.059 29.332 797 HD3 LYS 89 HD1 LYS 89 6.328 14.001 28.041 798 HE2 LYS 89 HE2 LYS 89 7.113 15.421 29.836 799 HE3 LYS 89 HE1 LYS 89 6.796 16.388 28.397 800 HZ1 LYS 89 HZ1 LYS 89 4.969 16.115 30.722 801 HZ2 LYS 89 HZ2 LYS 89 4.685 17.058 29.348 802 HZ3 LYS 89 HZ3 LYS 89 5.953 17.452 30.396 803 H ARG 90 HN ARG 90 5.159 14.215 24.884 804 HA ARG 90 HA ARG 90 4.532 15.914 22.604 805 HB2 ARG 90 HB2 ARG 90 6.797 16.470 24.527 806 HB3 ARG 90 HB1 ARG 90 6.737 17.125 22.897 807 HG2 ARG 90 HG2 ARG 90 4.471 18.096 23.561 808 HG3 ARG 90 HG1 ARG 90 4.940 17.721 25.219 809 HD2 ARG 90 HD2 ARG 90 6.481 19.460 23.297 810 HD3 ARG 90 HD1 ARG 90 5.475 20.035 24.622 811 HE ARG 90 HE ARG 90 7.453 18.254 25.591 812 HH11 ARG 90 HH11 ARG 90 7.066 21.499 24.339 813 HH12 ARG 90 HH12 ARG 90 8.406 22.144 25.228 814 HH21 ARG 90 HH21 ARG 90 9.227 19.100 26.765 815 HH22 ARG 90 HH22 ARG 90 9.631 20.783 26.614 816 H LYS 91 HN LYS 91 4.815 14.390 21.100 817 HA LYS 91 HA LYS 91 6.706 12.316 21.159 818 HB2 LYS 91 HB2 LYS 91 4.670 12.411 19.693 819 HB3 LYS 91 HB1 LYS 91 5.502 13.599 18.698 820 HG2 LYS 91 HG2 LYS 91 7.250 11.944 18.213 821 HG3 LYS 91 HG1 LYS 91 6.365 10.755 19.170 822 HD2 LYS 91 HD2 LYS 91 4.451 10.970 17.651 823 HD3 LYS 91 HD1 LYS 91 5.357 12.139 16.688 824 HE2 LYS 91 HE2 LYS 91 6.128 9.263 17.168 825 HE3 LYS 91 HE1 LYS 91 5.433 9.913 15.685 826 HZ1 LYS 91 HZ1 LYS 91 8.055 10.684 16.850 827 HZ2 LYS 91 HZ2 LYS 91 7.387 11.314 15.432 828 HZ3 LYS 91 HZ3 LYS 91 7.826 9.685 15.504 829 H ALA 92 HN ALA 92 6.861 15.612 20.112 830 HA ALA 92 HA ALA 92 9.757 15.308 19.733 831 HB1 ALA 92 HB1 ALA 92 8.768 15.724 17.560 832 HB2 ALA 92 HB2 ALA 92 9.659 17.150 18.090 833 HB3 ALA 92 HB3 ALA 92 7.900 17.121 18.193 834 H ALA 93 HN ALA 93 10.904 16.517 21.109 835 HA ALA 93 HA ALA 93 9.597 18.279 22.948 836 HB1 ALA 93 HB1 ALA 93 11.823 18.617 23.893 837 HB2 ALA 93 HB2 ALA 93 12.544 17.782 22.517 838 HB3 ALA 93 HB3 ALA 93 11.501 16.902 23.635 839 H GLN 94 HN GLN 94 8.689 19.838 21.548 840 HA GLN 94 HA GLN 94 10.604 21.845 20.633 841 HB2 GLN 94 HB2 GLN 94 9.246 22.149 18.549 842 HB3 GLN 94 HB1 GLN 94 10.125 20.631 18.632 843 HG2 GLN 94 HG2 GLN 94 8.161 19.784 17.948 844 HG3 GLN 94 HG1 GLN 94 7.781 19.842 19.666 845 HE21 GLN 94 HE21 GLN 94 5.586 20.031 19.297 846 HE22 GLN 94 HE22 GLN 94 4.864 21.474 18.677 847 H LYS 95 HN LYS 95 9.757 23.943 20.415 848 HA LYS 95 HA LYS 95 8.600 25.756 21.041 849 HB2 LYS 95 HB2 LYS 95 6.344 23.777 21.185 850 HB3 LYS 95 HB1 LYS 95 6.124 25.467 21.620 851 HG2 LYS 95 HG2 LYS 95 6.875 26.128 19.382 852 HG3 LYS 95 HG1 LYS 95 7.050 24.427 18.951 853 HD2 LYS 95 HD2 LYS 95 4.681 24.066 19.254 854 HD3 LYS 95 HD1 LYS 95 4.471 25.722 19.829 855 HE2 LYS 95 HE2 LYS 95 3.779 25.463 17.485 856 HE3 LYS 95 HE1 LYS 95 5.128 26.586 17.657 857 HZ1 LYS 95 HZ1 LYS 95 5.414 25.050 15.791 858 HZ2 LYS 95 HZ2 LYS 95 5.380 23.737 16.855 859 HZ3 LYS 95 HZ3 LYS 95 6.635 24.866 16.944 860 H ARG 96 HN ARG 96 8.060 26.945 22.855 861 HA ARG 96 HA ARG 96 8.004 25.585 25.427 862 HB2 ARG 96 HB2 ARG 96 9.866 26.838 26.349 863 HB3 ARG 96 HB1 ARG 96 10.410 25.921 24.958 864 HG2 ARG 96 HG2 ARG 96 9.666 28.825 24.762 865 HG3 ARG 96 HG1 ARG 96 11.286 28.291 25.215 866 HD2 ARG 96 HD2 ARG 96 11.438 27.038 23.103 867 HD3 ARG 96 HD1 ARG 96 9.839 27.624 22.653 868 HE ARG 96 HE ARG 96 11.714 29.723 23.259 869 HH11 ARG 96 HH11 ARG 96 10.490 27.598 20.758 870 HH12 ARG 96 HH12 ARG 96 11.004 28.622 19.458 871 HH21 ARG 96 HH21 ARG 96 12.387 31.075 21.550 872 HH22 ARG 96 HH22 ARG 96 12.102 30.594 19.908 873 H LYS 97 HN LYS 97 7.972 27.433 27.194 874 HA LYS 97 HA LYS 97 5.674 29.042 26.526 875 HB2 LYS 97 HB2 LYS 97 7.225 28.864 29.115 876 HB3 LYS 97 HB1 LYS 97 5.643 29.599 28.904 877 HG2 LYS 97 HG2 LYS 97 4.715 27.407 28.307 878 HG3 LYS 97 HG1 LYS 97 6.303 26.679 28.561 879 HD2 LYS 97 HD2 LYS 97 4.723 28.159 30.664 880 HD3 LYS 97 HD1 LYS 97 4.779 26.406 30.496 881 HE2 LYS 97 HE2 LYS 97 7.172 28.173 30.995 882 HE3 LYS 97 HE1 LYS 97 6.308 27.276 32.238 883 HZ1 LYS 97 HZ1 LYS 97 6.886 25.220 31.097 884 HZ2 LYS 97 HZ2 LYS 97 8.273 26.088 31.522 885 HZ3 LYS 97 HZ3 LYS 97 7.737 26.088 29.921 886 H ASN 98 HN ASN 98 6.646 30.475 25.005 887 HA ASN 98 HA ASN 98 8.253 32.584 26.283 888 HB2 ASN 98 HB2 ASN 98 9.686 31.272 24.780 889 HB3 ASN 98 HB1 ASN 98 8.558 31.546 23.457 890 HD21 ASN 98 HD21 ASN 98 9.483 33.928 25.863 891 HD22 ASN 98 HD22 ASN 98 10.308 34.979 24.769 Start of MODEL 19 1 H1 LYS 1 HT1 LYS 1 7.157 22.772 4.660 2 H2 LYS 1 HT2 LYS 1 6.360 22.910 6.141 3 H3 LYS 1 HT3 LYS 1 5.750 23.701 4.780 4 HA LYS 1 HA LYS 1 4.452 21.746 5.274 5 HB2 LYS 1 HB2 LYS 1 6.163 21.527 2.789 6 HB3 LYS 1 HB1 LYS 1 4.689 20.614 3.060 7 HG2 LYS 1 HG2 LYS 1 4.876 23.613 2.901 8 HG3 LYS 1 HG1 LYS 1 4.339 22.547 1.602 9 HD2 LYS 1 HD2 LYS 1 2.513 21.749 3.088 10 HD3 LYS 1 HD1 LYS 1 3.018 22.945 4.284 11 HE2 LYS 1 HE2 LYS 1 2.088 23.542 1.479 12 HE3 LYS 1 HE1 LYS 1 1.127 23.738 2.941 13 HZ1 LYS 1 HZ1 LYS 1 2.708 25.387 3.718 14 HZ2 LYS 1 HZ2 LYS 1 2.080 25.831 2.210 15 HZ3 LYS 1 HZ3 LYS 1 3.638 25.193 2.319 16 HA PRO 2 HA PRO 2 7.255 18.592 6.953 17 HB2 PRO 2 HB2 PRO 2 5.581 17.647 8.816 18 HB3 PRO 2 HB1 PRO 2 6.430 19.180 9.043 19 HG2 PRO 2 HG2 PRO 2 3.618 18.688 8.164 20 HG3 PRO 2 HG1 PRO 2 4.229 19.882 9.325 21 HD2 PRO 2 HD2 PRO 2 3.624 20.458 6.713 22 HD3 PRO 2 HD1 PRO 2 4.819 21.356 7.670 23 H VAL 3 HN VAL 3 7.459 16.652 6.055 24 HA VAL 3 HA VAL 3 7.044 14.654 5.069 25 HB VAL 3 HB VAL 3 4.219 15.063 6.059 26 HG11 VAL 3 HG11 VAL 3 5.573 12.562 5.055 27 HG12 VAL 3 HG12 VAL 3 4.267 13.437 4.254 28 HG13 VAL 3 HG13 VAL 3 3.974 12.632 5.796 29 HG21 VAL 3 HG21 VAL 3 4.865 13.555 7.880 30 HG22 VAL 3 HG22 VAL 3 5.845 15.020 7.869 31 HG23 VAL 3 HG23 VAL 3 6.512 13.508 7.251 32 H SER 4 HN SER 4 6.404 13.852 3.062 33 HA SER 4 HA SER 4 5.754 13.883 0.898 34 HB2 SER 4 HB2 SER 4 3.697 15.913 1.802 35 HB3 SER 4 HB1 SER 4 3.680 15.034 0.273 36 HG SER 4 HG SER 4 3.564 13.087 1.527 37 H LEU 5 HN LEU 5 7.658 15.946 2.077 38 HA LEU 5 HA LEU 5 7.736 17.632 -0.318 39 HB2 LEU 5 HB2 LEU 5 6.933 18.622 2.105 40 HB3 LEU 5 HB1 LEU 5 8.649 18.961 2.132 41 HG LEU 5 HG LEU 5 7.486 20.893 1.312 42 HD11 LEU 5 HD11 LEU 5 8.866 19.462 -0.949 43 HD12 LEU 5 HD12 LEU 5 9.643 20.443 0.294 44 HD13 LEU 5 HD13 LEU 5 8.547 21.194 -0.866 45 HD21 LEU 5 HD21 LEU 5 5.448 19.799 0.554 46 HD22 LEU 5 HD22 LEU 5 6.325 19.079 -0.797 47 HD23 LEU 5 HD23 LEU 5 6.120 20.829 -0.711 48 H SER 6 HN SER 6 9.807 17.859 2.546 49 HA SER 6 HA SER 6 12.071 17.098 0.853 50 HB2 SER 6 HB2 SER 6 12.084 18.468 3.552 51 HB3 SER 6 HB1 SER 6 13.451 18.278 2.459 52 HG SER 6 HG SER 6 11.424 19.436 1.150 53 H TYR 7 HN TYR 7 10.029 15.575 2.746 54 HA TYR 7 HA TYR 7 12.035 13.962 4.158 55 HB2 TYR 7 HB2 TYR 7 9.060 14.249 4.630 56 HB3 TYR 7 HB1 TYR 7 10.102 13.136 5.507 57 HD1 TYR 7 HD1 TYR 7 8.975 16.556 5.193 58 HD2 TYR 7 HD2 TYR 7 11.878 14.036 7.008 59 HE1 TYR 7 HE1 TYR 7 9.494 18.330 6.811 60 HE2 TYR 7 HE2 TYR 7 12.407 15.804 8.632 61 HH TYR 7 HH TYR 7 12.225 18.306 8.752 62 H ARG 8 HN ARG 8 12.243 11.838 3.736 63 HA ARG 8 HA ARG 8 11.207 10.909 1.226 64 HB2 ARG 8 HB2 ARG 8 12.579 8.937 1.606 65 HB3 ARG 8 HB1 ARG 8 13.505 10.390 1.952 66 HG2 ARG 8 HG2 ARG 8 13.300 10.047 4.301 67 HG3 ARG 8 HG1 ARG 8 12.146 8.732 4.063 68 HD2 ARG 8 HD2 ARG 8 13.901 7.443 2.915 69 HD3 ARG 8 HD1 ARG 8 15.043 8.746 3.230 70 HE ARG 8 HE ARG 8 14.974 8.218 5.536 71 HH11 ARG 8 HH11 ARG 8 13.083 6.016 3.573 72 HH12 ARG 8 HH12 ARG 8 13.095 4.751 4.758 73 HH21 ARG 8 HH21 ARG 8 15.003 6.537 7.090 74 HH22 ARG 8 HH22 ARG 8 14.193 5.043 6.750 75 H CYS 9 HN CYS 9 10.254 8.713 1.026 76 HA CYS 9 HA CYS 9 7.871 8.534 2.536 77 HB2 CYS 9 HB2 CYS 9 9.129 6.581 0.606 78 HB3 CYS 9 HB1 CYS 9 7.468 6.546 1.163 79 HA PRO 10 HA PRO 10 8.409 6.207 6.146 80 HB2 PRO 10 HB2 PRO 10 6.848 4.077 4.771 81 HB3 PRO 10 HB1 PRO 10 6.664 4.726 6.401 82 HG2 PRO 10 HG2 PRO 10 5.078 5.498 4.387 83 HG3 PRO 10 HG1 PRO 10 5.567 6.584 5.692 84 HD2 PRO 10 HD2 PRO 10 6.364 6.603 2.874 85 HD3 PRO 10 HD1 PRO 10 6.480 7.890 4.081 86 H CYS 11 HN CYS 11 8.605 3.992 3.351 87 HA CYS 11 HA CYS 11 10.356 2.272 4.908 88 HB2 CYS 11 HB2 CYS 11 8.445 1.437 3.410 89 HB3 CYS 11 HB1 CYS 11 9.536 1.765 2.076 90 H ARG 12 HN ARG 12 12.339 1.463 4.110 91 HA ARG 12 HA ARG 12 14.062 3.334 2.841 92 HB2 ARG 12 HB2 ARG 12 14.465 0.384 3.368 93 HB3 ARG 12 HB1 ARG 12 15.706 1.478 2.823 94 HG2 ARG 12 HG2 ARG 12 16.199 1.502 5.015 95 HG3 ARG 12 HG1 ARG 12 14.978 2.779 5.018 96 HD2 ARG 12 HD2 ARG 12 13.285 1.046 5.494 97 HD3 ARG 12 HD1 ARG 12 14.581 -0.126 5.680 98 HE ARG 12 HE ARG 12 14.965 2.159 7.344 99 HH11 ARG 12 HH11 ARG 12 13.205 -0.862 7.096 100 HH12 ARG 12 HH12 ARG 12 13.060 -1.062 8.813 101 HH21 ARG 12 HH21 ARG 12 14.768 1.889 9.612 102 HH22 ARG 12 HH22 ARG 12 13.929 0.504 10.237 103 H PHE 13 HN PHE 13 15.515 2.019 0.954 104 HA PHE 13 HA PHE 13 13.687 2.019 -1.244 105 HB2 PHE 13 HB2 PHE 13 15.637 1.668 -2.655 106 HB3 PHE 13 HB1 PHE 13 15.983 2.922 -1.468 107 HD1 PHE 13 HD1 PHE 13 17.005 -0.193 -2.851 108 HD2 PHE 13 HD2 PHE 13 17.272 2.250 0.616 109 HE1 PHE 13 HE1 PHE 13 18.968 -1.446 -2.121 110 HE2 PHE 13 HE2 PHE 13 19.232 1.006 1.349 111 HZ PHE 13 HZ PHE 13 20.105 -0.857 -0.015 112 H PHE 14 HN PHE 14 13.040 0.278 -2.472 113 HA PHE 14 HA PHE 14 12.759 -2.043 -0.774 114 HB2 PHE 14 HB2 PHE 14 11.256 -2.268 -3.200 115 HB3 PHE 14 HB1 PHE 14 10.684 -2.093 -1.554 116 HD1 PHE 14 HD1 PHE 14 10.067 0.050 -0.654 117 HD2 PHE 14 HD2 PHE 14 11.471 -0.330 -4.657 118 HE1 PHE 14 HE1 PHE 14 9.246 2.303 -1.153 119 HE2 PHE 14 HE2 PHE 14 10.649 1.932 -5.163 120 HZ PHE 14 HZ PHE 14 9.532 3.255 -3.410 121 H GLU 15 HN GLU 15 12.873 -4.184 -1.539 122 HA GLU 15 HA GLU 15 15.215 -4.572 -3.206 123 HB2 GLU 15 HB2 GLU 15 13.610 -6.441 -1.470 124 HB3 GLU 15 HB1 GLU 15 14.979 -6.959 -2.436 125 HG2 GLU 15 HG2 GLU 15 15.049 -4.934 -0.216 126 HG3 GLU 15 HG1 GLU 15 15.603 -6.604 -0.117 127 H SER 16 HN SER 16 15.106 -5.106 -5.256 128 HA SER 16 HA SER 16 12.541 -5.928 -6.383 129 HB2 SER 16 HB2 SER 16 13.812 -5.538 -8.575 130 HB3 SER 16 HB1 SER 16 13.524 -4.116 -7.571 131 HG SER 16 HG SER 16 15.599 -3.873 -7.410 132 H HIS 17 HN HIS 17 14.032 -7.745 -4.770 133 HA HIS 17 HA HIS 17 14.378 -9.889 -6.743 134 HB2 HIS 17 HB2 HIS 17 16.166 -9.265 -4.397 135 HB3 HIS 17 HB1 HIS 17 16.109 -10.864 -5.125 136 HD1 HIS 17 HD1 HIS 17 17.546 -11.242 -7.128 137 HD2 HIS 17 HD2 HIS 17 17.116 -7.210 -6.232 138 HE1 HIS 17 HE1 HIS 17 19.163 -10.041 -8.630 139 HE2 HIS 17 HE2 HIS 17 19.030 -7.628 -7.917 140 H ILE 18 HN ILE 18 12.759 -8.713 -4.101 141 HA ILE 18 HA ILE 18 12.338 -11.082 -2.595 142 HB ILE 18 HB ILE 18 10.724 -8.547 -2.791 143 HG12 ILE 18 HG12 ILE 18 12.594 -9.545 -0.651 144 HG13 ILE 18 HG11 ILE 18 12.996 -8.324 -1.847 145 HG21 ILE 18 HG21 ILE 18 10.414 -10.793 -0.813 146 HG22 ILE 18 HG22 ILE 18 9.281 -10.384 -2.102 147 HG23 ILE 18 HG23 ILE 18 9.554 -9.250 -0.776 148 HD11 ILE 18 HD11 ILE 18 11.283 -6.855 -0.924 149 HD12 ILE 18 HD12 ILE 18 12.463 -7.318 0.308 150 HD13 ILE 18 HD13 ILE 18 10.871 -8.086 0.271 151 H ALA 19 HN ALA 19 10.864 -12.654 -2.836 152 HA ALA 19 HA ALA 19 9.300 -12.600 -5.330 153 HB1 ALA 19 HB1 ALA 19 11.275 -14.107 -5.349 154 HB2 ALA 19 HB2 ALA 19 9.741 -14.939 -5.599 155 HB3 ALA 19 HB3 ALA 19 10.538 -15.015 -4.029 156 H ARG 20 HN ARG 20 7.361 -13.817 -5.376 157 HA ARG 20 HA ARG 20 5.646 -13.459 -3.209 158 HB2 ARG 20 HB2 ARG 20 5.107 -13.759 -5.691 159 HB3 ARG 20 HB1 ARG 20 5.271 -15.487 -5.398 160 HG2 ARG 20 HG2 ARG 20 3.464 -15.412 -3.791 161 HG3 ARG 20 HG1 ARG 20 3.312 -13.666 -4.019 162 HD2 ARG 20 HD2 ARG 20 2.857 -14.080 -6.420 163 HD3 ARG 20 HD1 ARG 20 2.865 -15.809 -6.086 164 HE ARG 20 HE ARG 20 1.030 -14.638 -4.353 165 HH11 ARG 20 HH11 ARG 20 1.442 -15.171 -7.788 166 HH12 ARG 20 HH12 ARG 20 -0.259 -15.121 -8.128 167 HH21 ARG 20 HH21 ARG 20 -1.215 -14.592 -4.803 168 HH22 ARG 20 HH22 ARG 20 -1.764 -14.793 -6.436 169 H ALA 21 HN ALA 21 7.494 -16.248 -4.291 170 HA ALA 21 HA ALA 21 6.315 -17.989 -2.318 171 HB1 ALA 21 HB1 ALA 21 8.628 -18.475 -4.179 172 HB2 ALA 21 HB2 ALA 21 6.941 -18.867 -4.513 173 HB3 ALA 21 HB3 ALA 21 7.800 -19.696 -3.215 174 H ASN 22 HN ASN 22 8.644 -15.659 -2.262 175 HA ASN 22 HA ASN 22 10.206 -17.002 -0.201 176 HB2 ASN 22 HB2 ASN 22 10.688 -14.627 -1.983 177 HB3 ASN 22 HB1 ASN 22 11.630 -14.852 -0.523 178 HD21 ASN 22 HD21 ASN 22 13.516 -15.058 -1.719 179 HD22 ASN 22 HD22 ASN 22 13.881 -16.493 -2.610 180 H VAL 23 HN VAL 23 7.679 -14.832 -0.605 181 HA VAL 23 HA VAL 23 8.394 -13.319 1.785 182 HB VAL 23 HB VAL 23 7.888 -11.978 -0.180 183 HG11 VAL 23 HG11 VAL 23 6.333 -13.367 -1.370 184 HG12 VAL 23 HG12 VAL 23 5.537 -11.837 -0.986 185 HG13 VAL 23 HG13 VAL 23 5.179 -13.281 -0.035 186 HG21 VAL 23 HG21 VAL 23 5.801 -11.744 1.951 187 HG22 VAL 23 HG22 VAL 23 6.301 -10.472 0.835 188 HG23 VAL 23 HG23 VAL 23 7.444 -11.108 2.028 189 H LYS 24 HN LYS 24 7.088 -13.023 3.426 190 HA LYS 24 HA LYS 24 4.859 -14.869 3.829 191 HB2 LYS 24 HB2 LYS 24 6.396 -13.218 5.846 192 HB3 LYS 24 HB1 LYS 24 5.113 -14.357 6.213 193 HG2 LYS 24 HG2 LYS 24 6.728 -15.961 4.853 194 HG3 LYS 24 HG1 LYS 24 7.911 -14.828 5.514 195 HD2 LYS 24 HD2 LYS 24 5.860 -15.797 7.390 196 HD3 LYS 24 HD1 LYS 24 7.010 -16.998 6.829 197 HE2 LYS 24 HE2 LYS 24 8.856 -15.588 7.555 198 HE3 LYS 24 HE1 LYS 24 7.705 -14.364 8.106 199 HZ1 LYS 24 HZ1 LYS 24 8.502 -15.775 9.918 200 HZ2 LYS 24 HZ2 LYS 24 7.878 -17.138 9.145 201 HZ3 LYS 24 HZ3 LYS 24 6.833 -15.935 9.703 202 H HIS 25 HN HIS 25 3.767 -13.345 5.944 203 HA HIS 25 HA HIS 25 1.653 -12.033 5.012 204 HB2 HIS 25 HB2 HIS 25 3.056 -10.520 7.151 205 HB3 HIS 25 HB1 HIS 25 1.381 -11.044 7.079 206 HD1 HIS 25 HD1 HIS 25 3.021 -11.275 9.636 207 HD2 HIS 25 HD2 HIS 25 2.678 -14.379 6.887 208 HE1 HIS 25 HE1 HIS 25 3.497 -13.376 10.921 209 HE2 HIS 25 HE2 HIS 25 3.074 -15.246 9.291 210 H LEU 26 HN LEU 26 1.554 -10.608 3.373 211 HA LEU 26 HA LEU 26 3.596 -8.516 3.203 212 HB2 LEU 26 HB2 LEU 26 3.441 -9.866 1.227 213 HB3 LEU 26 HB1 LEU 26 1.706 -9.639 1.137 214 HG LEU 26 HG LEU 26 1.961 -7.351 0.463 215 HD11 LEU 26 HD11 LEU 26 4.928 -7.690 0.814 216 HD12 LEU 26 HD12 LEU 26 3.886 -6.862 1.954 217 HD13 LEU 26 HD13 LEU 26 4.074 -6.230 0.326 218 HD21 LEU 26 HD21 LEU 26 2.550 -9.354 -1.143 219 HD22 LEU 26 HD22 LEU 26 4.166 -8.622 -1.100 220 HD23 LEU 26 HD23 LEU 26 2.775 -7.682 -1.654 221 H LYS 27 HN LYS 27 3.126 -6.451 3.407 222 HA LYS 27 HA LYS 27 0.329 -5.624 3.756 223 HB2 LYS 27 HB2 LYS 27 1.081 -5.902 5.985 224 HB3 LYS 27 HB1 LYS 27 2.659 -5.238 5.608 225 HG2 LYS 27 HG2 LYS 27 1.457 -3.656 6.922 226 HG3 LYS 27 HG1 LYS 27 1.625 -3.034 5.279 227 HD2 LYS 27 HD2 LYS 27 -0.605 -2.586 6.047 228 HD3 LYS 27 HD1 LYS 27 -0.676 -3.831 4.802 229 HE2 LYS 27 HE2 LYS 27 -0.902 -5.550 6.499 230 HE3 LYS 27 HE1 LYS 27 -0.742 -4.340 7.772 231 HZ1 LYS 27 HZ1 LYS 27 -3.055 -4.955 7.352 232 HZ2 LYS 27 HZ2 LYS 27 -2.923 -4.408 5.760 233 HZ3 LYS 27 HZ3 LYS 27 -2.779 -3.316 7.044 234 H ILE 28 HN ILE 28 -0.099 -3.517 3.108 235 HA ILE 28 HA ILE 28 2.107 -2.206 1.677 236 HB ILE 28 HB ILE 28 -0.854 -1.858 1.216 237 HG12 ILE 28 HG12 ILE 28 -0.209 -4.111 0.657 238 HG13 ILE 28 HG11 ILE 28 -0.439 -3.214 -0.830 239 HG21 ILE 28 HG21 ILE 28 -0.152 -0.772 -0.869 240 HG22 ILE 28 HG22 ILE 28 1.535 -0.944 -0.380 241 HG23 ILE 28 HG23 ILE 28 0.444 0.080 0.556 242 HD11 ILE 28 HD11 ILE 28 1.952 -2.977 -1.081 243 HD12 ILE 28 HD12 ILE 28 1.487 -4.676 -0.946 244 HD13 ILE 28 HD13 ILE 28 2.199 -3.842 0.436 245 H LEU 29 HN LEU 29 2.774 -0.295 2.335 246 HA LEU 29 HA LEU 29 1.652 0.852 4.719 247 HB2 LEU 29 HB2 LEU 29 4.140 0.863 3.878 248 HB3 LEU 29 HB1 LEU 29 3.651 2.310 3.001 249 HG LEU 29 HG LEU 29 4.722 2.915 5.089 250 HD11 LEU 29 HD11 LEU 29 1.742 3.407 5.180 251 HD12 LEU 29 HD12 LEU 29 2.966 4.406 4.388 252 HD13 LEU 29 HD13 LEU 29 2.948 4.267 6.146 253 HD21 LEU 29 HD21 LEU 29 4.285 0.865 6.334 254 HD22 LEU 29 HD22 LEU 29 2.583 1.305 6.468 255 HD23 LEU 29 HD23 LEU 29 3.813 2.293 7.254 256 H ASN 30 HN ASN 30 -0.092 2.059 4.720 257 HA ASN 30 HA ASN 30 -0.992 3.533 2.444 258 HB2 ASN 30 HB2 ASN 30 -1.806 3.488 5.338 259 HB3 ASN 30 HB1 ASN 30 -2.541 4.571 4.173 260 HD21 ASN 30 HD21 ASN 30 -2.198 1.297 5.230 261 HD22 ASN 30 HD22 ASN 30 -3.460 0.625 4.264 262 H THR 31 HN THR 31 0.578 4.916 1.812 263 HA THR 31 HA THR 31 2.107 6.446 3.619 264 HB THR 31 HB THR 31 2.864 7.417 1.357 265 HG1 THR 31 HG1 THR 31 0.899 6.281 0.369 266 HG21 THR 31 HG21 THR 31 4.251 5.950 2.648 267 HG22 THR 31 HG22 THR 31 4.270 5.390 0.978 268 HG23 THR 31 HG23 THR 31 3.287 4.552 2.177 269 HA PRO 32 HA PRO 32 0.528 10.570 3.613 270 HB2 PRO 32 HB2 PRO 32 2.657 11.964 2.655 271 HB3 PRO 32 HB1 PRO 32 2.537 11.334 4.304 272 HG2 PRO 32 HG2 PRO 32 3.779 10.098 1.905 273 HG3 PRO 32 HG1 PRO 32 4.499 10.311 3.510 274 HD2 PRO 32 HD2 PRO 32 3.521 7.978 2.851 275 HD3 PRO 32 HD1 PRO 32 3.092 8.627 4.418 276 H ASN 33 HN ASN 33 0.589 8.926 0.878 277 HA ASN 33 HA ASN 33 0.102 9.237 -1.304 278 HB2 ASN 33 HB2 ASN 33 -0.671 11.174 -2.174 279 HB3 ASN 33 HB1 ASN 33 -0.715 11.676 -0.498 280 HD21 ASN 33 HD21 ASN 33 0.917 13.125 0.254 281 HD22 ASN 33 HD22 ASN 33 1.777 14.132 -0.868 282 H CYS 34 HN CYS 34 2.330 8.371 -0.237 283 HA CYS 34 HA CYS 34 4.345 8.971 -2.269 284 HB2 CYS 34 HB2 CYS 34 4.268 7.309 0.229 285 HB3 CYS 34 HB1 CYS 34 5.428 6.915 -1.012 286 H ALA 35 HN ALA 35 5.183 6.796 -3.327 287 HA ALA 35 HA ALA 35 3.042 5.333 -4.459 288 HB1 ALA 35 HB1 ALA 35 5.224 5.393 -5.554 289 HB2 ALA 35 HB2 ALA 35 4.737 3.730 -5.218 290 HB3 ALA 35 HB3 ALA 35 5.941 4.523 -4.197 291 H LEU 36 HN LEU 36 2.315 3.247 -3.964 292 HA LEU 36 HA LEU 36 1.956 2.724 -1.245 293 HB2 LEU 36 HB2 LEU 36 1.461 1.165 -3.752 294 HB3 LEU 36 HB1 LEU 36 1.213 0.423 -2.188 295 HG LEU 36 HG LEU 36 -0.468 2.110 -1.624 296 HD11 LEU 36 HD11 LEU 36 0.450 3.981 -2.924 297 HD12 LEU 36 HD12 LEU 36 -1.259 3.709 -3.266 298 HD13 LEU 36 HD13 LEU 36 -0.035 3.168 -4.413 299 HD21 LEU 36 HD21 LEU 36 -1.181 0.065 -2.714 300 HD22 LEU 36 HD22 LEU 36 -0.911 0.798 -4.295 301 HD23 LEU 36 HD23 LEU 36 -2.177 1.424 -3.239 302 H GLN 37 HN GLN 37 3.432 2.074 0.130 303 HA GLN 37 HA GLN 37 5.867 0.803 -0.706 304 HB2 GLN 37 HB2 GLN 37 4.879 1.129 2.119 305 HB3 GLN 37 HB1 GLN 37 6.539 0.959 1.581 306 HG2 GLN 37 HG2 GLN 37 4.831 3.312 0.837 307 HG3 GLN 37 HG1 GLN 37 5.799 3.255 2.311 308 HE21 GLN 37 HE21 GLN 37 5.900 4.944 -0.054 309 HE22 GLN 37 HE22 GLN 37 7.512 4.822 -0.641 310 H ILE 38 HN ILE 38 6.015 -1.319 -1.060 311 HA ILE 38 HA ILE 38 4.005 -3.107 0.029 312 HB ILE 38 HB ILE 38 6.327 -4.107 -1.555 313 HG12 ILE 38 HG12 ILE 38 5.591 -2.041 -2.748 314 HG13 ILE 38 HG11 ILE 38 5.345 -3.510 -3.681 315 HG21 ILE 38 HG21 ILE 38 4.172 -5.301 -2.579 316 HG22 ILE 38 HG22 ILE 38 3.534 -4.886 -0.982 317 HG23 ILE 38 HG23 ILE 38 5.003 -5.873 -1.132 318 HD11 ILE 38 HD11 ILE 38 3.249 -1.925 -2.220 319 HD12 ILE 38 HD12 ILE 38 2.962 -3.460 -3.041 320 HD13 ILE 38 HD13 ILE 38 3.477 -2.048 -3.966 321 H VAL 39 HN VAL 39 4.453 -3.485 2.201 322 HA VAL 39 HA VAL 39 7.256 -3.948 2.906 323 HB VAL 39 HB VAL 39 5.699 -2.266 4.155 324 HG11 VAL 39 HG11 VAL 39 4.624 -3.151 6.144 325 HG12 VAL 39 HG12 VAL 39 4.965 -4.793 5.600 326 HG13 VAL 39 HG13 VAL 39 3.877 -3.764 4.669 327 HG21 VAL 39 HG21 VAL 39 6.994 -2.588 6.200 328 HG22 VAL 39 HG22 VAL 39 7.995 -2.736 4.755 329 HG23 VAL 39 HG23 VAL 39 7.494 -4.183 5.633 330 H ALA 40 HN ALA 40 8.003 -5.915 3.337 331 HA ALA 40 HA ALA 40 6.022 -8.089 3.526 332 HB1 ALA 40 HB1 ALA 40 6.813 -7.751 1.205 333 HB2 ALA 40 HB2 ALA 40 7.214 -9.337 1.857 334 HB3 ALA 40 HB3 ALA 40 8.453 -8.088 1.751 335 H ARG 41 HN ARG 41 6.599 -9.816 4.794 336 HA ARG 41 HA ARG 41 9.212 -9.650 6.111 337 HB2 ARG 41 HB2 ARG 41 6.692 -11.164 6.769 338 HB3 ARG 41 HB1 ARG 41 8.217 -11.415 7.616 339 HG2 ARG 41 HG2 ARG 41 7.424 -8.617 7.398 340 HG3 ARG 41 HG1 ARG 41 6.325 -9.611 8.327 341 HD2 ARG 41 HD2 ARG 41 8.164 -10.377 9.722 342 HD3 ARG 41 HD1 ARG 41 9.282 -9.400 8.771 343 HE ARG 41 HE ARG 41 7.256 -7.728 9.724 344 HH11 ARG 41 HH11 ARG 41 9.933 -9.622 10.945 345 HH12 ARG 41 HH12 ARG 41 10.180 -8.610 12.334 346 HH21 ARG 41 HH21 ARG 41 7.585 -6.381 11.526 347 HH22 ARG 41 HH22 ARG 41 8.834 -6.761 12.668 348 H LEU 42 HN LEU 42 10.783 -11.044 5.612 349 HA LEU 42 HA LEU 42 10.405 -12.791 3.397 350 HB2 LEU 42 HB2 LEU 42 12.671 -12.220 5.247 351 HB3 LEU 42 HB1 LEU 42 12.769 -13.591 4.161 352 HG LEU 42 HG LEU 42 12.327 -10.742 3.284 353 HD11 LEU 42 HD11 LEU 42 14.651 -10.824 2.539 354 HD12 LEU 42 HD12 LEU 42 14.819 -12.440 3.225 355 HD13 LEU 42 HD13 LEU 42 14.536 -11.056 4.287 356 HD21 LEU 42 HD21 LEU 42 12.916 -13.260 1.724 357 HD22 LEU 42 HD22 LEU 42 12.856 -11.632 1.051 358 HD23 LEU 42 HD23 LEU 42 11.399 -12.361 1.724 359 H LYS 43 HN LYS 43 10.566 -15.054 3.300 360 HA LYS 43 HA LYS 43 8.872 -16.341 5.075 361 HB2 LYS 43 HB2 LYS 43 9.610 -16.917 2.660 362 HB3 LYS 43 HB1 LYS 43 10.867 -17.843 3.457 363 HG2 LYS 43 HG2 LYS 43 9.197 -19.157 4.624 364 HG3 LYS 43 HG1 LYS 43 7.915 -18.214 3.859 365 HD2 LYS 43 HD2 LYS 43 8.813 -18.945 1.641 366 HD3 LYS 43 HD1 LYS 43 9.910 -20.022 2.510 367 HE2 LYS 43 HE2 LYS 43 6.898 -20.087 2.601 368 HE3 LYS 43 HE1 LYS 43 7.944 -21.239 1.775 369 HZ1 LYS 43 HZ1 LYS 43 7.173 -22.084 3.907 370 HZ2 LYS 43 HZ2 LYS 43 7.881 -20.776 4.709 371 HZ3 LYS 43 HZ3 LYS 43 8.854 -21.901 3.905 372 H ASN 44 HN ASN 44 12.319 -17.127 4.662 373 HA ASN 44 HA ASN 44 12.340 -18.396 7.260 374 HB2 ASN 44 HB2 ASN 44 14.400 -18.124 5.098 375 HB3 ASN 44 HB1 ASN 44 14.778 -18.824 6.664 376 HD21 ASN 44 HD21 ASN 44 14.730 -19.974 3.935 377 HD22 ASN 44 HD22 ASN 44 13.693 -21.353 4.038 378 H ASN 45 HN ASN 45 13.701 -15.548 5.723 379 HA ASN 45 HA ASN 45 15.520 -14.915 7.780 380 HB2 ASN 45 HB2 ASN 45 15.527 -14.080 5.376 381 HB3 ASN 45 HB1 ASN 45 14.316 -12.928 5.886 382 HD21 ASN 45 HD21 ASN 45 17.039 -12.543 4.858 383 HD22 ASN 45 HD22 ASN 45 17.856 -11.590 6.049 384 H ASN 46 HN ASN 46 12.133 -14.139 7.295 385 HA ASN 46 HA ASN 46 10.557 -13.338 8.718 386 HB2 ASN 46 HB2 ASN 46 11.647 -14.715 10.442 387 HB3 ASN 46 HB1 ASN 46 12.754 -13.400 10.793 388 HD21 ASN 46 HD21 ASN 46 9.531 -14.601 11.158 389 HD22 ASN 46 HD22 ASN 46 9.007 -13.443 12.327 390 H ARG 47 HN ARG 47 13.077 -11.597 7.582 391 HA ARG 47 HA ARG 47 12.803 -9.289 9.256 392 HB2 ARG 47 HB2 ARG 47 14.499 -8.295 7.905 393 HB3 ARG 47 HB1 ARG 47 14.953 -9.967 8.166 394 HG2 ARG 47 HG2 ARG 47 14.569 -10.583 6.022 395 HG3 ARG 47 HG1 ARG 47 13.489 -9.226 5.715 396 HD2 ARG 47 HD2 ARG 47 15.372 -7.694 5.893 397 HD3 ARG 47 HD1 ARG 47 16.449 -9.056 6.190 398 HE ARG 47 HE ARG 47 14.943 -8.847 3.670 399 HH11 ARG 47 HH11 ARG 47 17.999 -9.060 5.377 400 HH12 ARG 47 HH12 ARG 47 18.932 -9.254 3.928 401 HH21 ARG 47 HH21 ARG 47 16.190 -9.063 1.760 402 HH22 ARG 47 HH22 ARG 47 17.911 -9.243 1.882 403 H GLN 48 HN GLN 48 11.760 -7.499 8.842 404 HA GLN 48 HA GLN 48 9.721 -7.481 6.829 405 HB2 GLN 48 HB2 GLN 48 9.308 -6.619 9.077 406 HB3 GLN 48 HB1 GLN 48 10.543 -5.398 8.848 407 HG2 GLN 48 HG2 GLN 48 9.258 -4.312 7.171 408 HG3 GLN 48 HG1 GLN 48 8.059 -5.607 7.194 409 HE21 GLN 48 HE21 GLN 48 7.974 -2.669 7.792 410 HE22 GLN 48 HE22 GLN 48 7.193 -2.563 9.329 411 H VAL 49 HN VAL 49 9.982 -6.699 4.902 412 HA VAL 49 HA VAL 49 12.203 -4.867 4.234 413 HB VAL 49 HB VAL 49 11.311 -6.644 2.111 414 HG11 VAL 49 HG11 VAL 49 13.166 -5.248 1.683 415 HG12 VAL 49 HG12 VAL 49 13.770 -6.903 1.754 416 HG13 VAL 49 HG13 VAL 49 14.006 -5.817 3.123 417 HG21 VAL 49 HG21 VAL 49 11.158 -8.233 3.894 418 HG22 VAL 49 HG22 VAL 49 12.797 -7.835 4.417 419 HG23 VAL 49 HG23 VAL 49 12.534 -8.609 2.855 420 H CYS 50 HN CYS 50 11.740 -4.233 1.784 421 HA CYS 50 HA CYS 50 8.875 -3.957 1.363 422 HB2 CYS 50 HB2 CYS 50 10.950 -1.802 1.185 423 HB3 CYS 50 HB1 CYS 50 9.538 -1.752 0.152 424 H ILE 51 HN ILE 51 8.196 -4.500 -0.571 425 HA ILE 51 HA ILE 51 10.111 -5.677 -2.421 426 HB ILE 51 HB ILE 51 7.192 -5.633 -3.030 427 HG12 ILE 51 HG12 ILE 51 8.380 -7.372 -0.850 428 HG13 ILE 51 HG11 ILE 51 7.216 -6.075 -0.602 429 HG21 ILE 51 HG21 ILE 51 8.927 -8.051 -3.044 430 HG22 ILE 51 HG22 ILE 51 9.187 -6.814 -4.271 431 HG23 ILE 51 HG23 ILE 51 7.612 -7.599 -4.132 432 HD11 ILE 51 HD11 ILE 51 6.083 -8.188 -0.532 433 HD12 ILE 51 HD12 ILE 51 6.761 -8.652 -2.086 434 HD13 ILE 51 HD13 ILE 51 5.595 -7.337 -1.994 435 H ASP 52 HN ASP 52 10.444 -4.979 -4.500 436 HA ASP 52 HA ASP 52 9.970 -2.251 -5.100 437 HB2 ASP 52 HB2 ASP 52 11.862 -3.672 -5.994 438 HB3 ASP 52 HB1 ASP 52 10.694 -4.423 -7.070 439 HA PRO 53 HA PRO 53 5.748 -2.617 -6.350 440 HB2 PRO 53 HB2 PRO 53 5.530 -0.195 -7.565 441 HB3 PRO 53 HB1 PRO 53 5.510 -0.420 -5.814 442 HG2 PRO 53 HG2 PRO 53 7.774 0.398 -7.590 443 HG3 PRO 53 HG1 PRO 53 7.289 1.061 -6.017 444 HD2 PRO 53 HD2 PRO 53 9.328 -0.659 -6.246 445 HD3 PRO 53 HD1 PRO 53 8.244 -0.689 -4.846 446 H LYS 54 HN LYS 54 8.380 -2.350 -8.502 447 HA LYS 54 HA LYS 54 6.684 -2.417 -10.879 448 HB2 LYS 54 HB2 LYS 54 9.635 -2.039 -10.538 449 HB3 LYS 54 HB1 LYS 54 8.845 -2.186 -12.105 450 HG2 LYS 54 HG2 LYS 54 7.513 -0.227 -11.659 451 HG3 LYS 54 HG1 LYS 54 8.199 -0.110 -10.039 452 HD2 LYS 54 HD2 LYS 54 9.776 0.039 -12.580 453 HD3 LYS 54 HD1 LYS 54 9.239 1.450 -11.664 454 HE2 LYS 54 HE2 LYS 54 10.498 0.587 -9.717 455 HE3 LYS 54 HE1 LYS 54 11.075 -0.736 -10.720 456 HZ1 LYS 54 HZ1 LYS 54 12.127 0.898 -12.177 457 HZ2 LYS 54 HZ2 LYS 54 12.721 0.997 -10.598 458 HZ3 LYS 54 HZ3 LYS 54 11.618 2.145 -11.156 459 H LEU 55 HN LEU 55 8.146 -4.571 -8.796 460 HA LEU 55 HA LEU 55 9.097 -6.616 -10.399 461 HB2 LEU 55 HB2 LEU 55 7.864 -6.369 -7.717 462 HB3 LEU 55 HB1 LEU 55 7.990 -7.989 -8.381 463 HG LEU 55 HG LEU 55 10.347 -6.123 -8.190 464 HD11 LEU 55 HD11 LEU 55 10.968 -7.453 -6.171 465 HD12 LEU 55 HD12 LEU 55 9.324 -8.098 -6.166 466 HD13 LEU 55 HD13 LEU 55 9.597 -6.366 -5.962 467 HD21 LEU 55 HD21 LEU 55 10.093 -9.104 -8.510 468 HD22 LEU 55 HD22 LEU 55 11.610 -8.218 -8.341 469 HD23 LEU 55 HD23 LEU 55 10.581 -7.950 -9.749 470 H LYS 56 HN LYS 56 8.188 -8.252 -11.514 471 HA LYS 56 HA LYS 56 5.795 -7.636 -12.840 472 HB2 LYS 56 HB2 LYS 56 7.617 -10.013 -12.861 473 HB3 LYS 56 HB1 LYS 56 6.081 -10.081 -13.708 474 HG2 LYS 56 HG2 LYS 56 7.793 -9.477 -15.261 475 HG3 LYS 56 HG1 LYS 56 6.749 -8.080 -14.999 476 HD2 LYS 56 HD2 LYS 56 8.403 -7.156 -13.434 477 HD3 LYS 56 HD1 LYS 56 9.450 -8.545 -13.735 478 HE2 LYS 56 HE2 LYS 56 9.606 -7.935 -16.087 479 HE3 LYS 56 HE1 LYS 56 8.527 -6.567 -15.817 480 HZ1 LYS 56 HZ1 LYS 56 10.176 -5.639 -14.299 481 HZ2 LYS 56 HZ2 LYS 56 10.810 -5.848 -15.850 482 HZ3 LYS 56 HZ3 LYS 56 11.217 -6.932 -14.620 483 H TRP 57 HN TRP 57 6.459 -9.786 -10.145 484 HA TRP 57 HA TRP 57 3.756 -10.833 -10.224 485 HB2 TRP 57 HB2 TRP 57 4.365 -12.225 -8.406 486 HB3 TRP 57 HB1 TRP 57 5.765 -12.184 -9.458 487 HD1 TRP 57 HD1 TRP 57 7.972 -11.103 -8.488 488 HE1 TRP 57 HE1 TRP 57 8.711 -10.476 -6.096 489 HE3 TRP 57 HE3 TRP 57 3.420 -11.258 -6.199 490 HZ2 TRP 57 HZ2 TRP 57 7.494 -10.108 -3.573 491 HZ3 TRP 57 HZ3 TRP 57 3.282 -10.745 -3.803 492 HH2 TRP 57 HH2 TRP 57 5.277 -10.190 -2.512 493 H ILE 58 HN ILE 58 5.503 -8.267 -8.770 494 HA ILE 58 HA ILE 58 3.673 -7.709 -6.645 495 HB ILE 58 HB ILE 58 5.919 -6.201 -7.936 496 HG12 ILE 58 HG12 ILE 58 6.429 -7.968 -6.309 497 HG13 ILE 58 HG11 ILE 58 6.902 -6.381 -5.711 498 HG21 ILE 58 HG21 ILE 58 5.567 -4.408 -6.281 499 HG22 ILE 58 HG22 ILE 58 4.013 -5.132 -5.872 500 HG23 ILE 58 HG23 ILE 58 4.292 -4.504 -7.501 501 HD11 ILE 58 HD11 ILE 58 4.387 -7.839 -4.961 502 HD12 ILE 58 HD12 ILE 58 4.933 -6.293 -4.318 503 HD13 ILE 58 HD13 ILE 58 5.848 -7.761 -3.991 504 H GLN 59 HN GLN 59 4.121 -6.486 -9.930 505 HA GLN 59 HA GLN 59 2.176 -4.509 -10.034 506 HB2 GLN 59 HB2 GLN 59 3.019 -6.561 -12.043 507 HB3 GLN 59 HB1 GLN 59 1.949 -5.234 -12.450 508 HG2 GLN 59 HG2 GLN 59 4.674 -4.791 -11.291 509 HG3 GLN 59 HG1 GLN 59 4.420 -5.005 -13.021 510 HE21 GLN 59 HE21 GLN 59 4.011 -2.907 -10.305 511 HE22 GLN 59 HE22 GLN 59 3.491 -1.519 -11.199 512 H GLU 60 HN GLU 60 1.882 -7.938 -9.993 513 HA GLU 60 HA GLU 60 -0.893 -8.093 -10.666 514 HB2 GLU 60 HB2 GLU 60 0.888 -10.073 -9.225 515 HB3 GLU 60 HB1 GLU 60 -0.699 -10.427 -9.883 516 HG2 GLU 60 HG2 GLU 60 1.641 -9.529 -11.539 517 HG3 GLU 60 HG1 GLU 60 1.227 -11.217 -11.253 518 H TYR 61 HN TYR 61 0.983 -7.937 -7.702 519 HA TYR 61 HA TYR 61 -1.278 -8.356 -5.974 520 HB2 TYR 61 HB2 TYR 61 0.970 -8.953 -5.194 521 HB3 TYR 61 HB1 TYR 61 1.505 -7.295 -5.396 522 HD1 TYR 61 HD1 TYR 61 0.038 -9.651 -3.164 523 HD2 TYR 61 HD2 TYR 61 0.425 -5.505 -3.971 524 HE1 TYR 61 HE1 TYR 61 -0.590 -9.141 -0.859 525 HE2 TYR 61 HE2 TYR 61 -0.224 -4.990 -1.659 526 HH TYR 61 HH TYR 61 -0.315 -7.326 0.787 527 H LEU 62 HN LEU 62 0.496 -5.746 -7.362 528 HA LEU 62 HA LEU 62 -0.404 -3.547 -5.981 529 HB2 LEU 62 HB2 LEU 62 0.936 -4.129 -8.401 530 HB3 LEU 62 HB1 LEU 62 -0.291 -2.918 -8.747 531 HG LEU 62 HG LEU 62 0.651 -1.530 -6.888 532 HD11 LEU 62 HD11 LEU 62 2.636 -3.767 -6.891 533 HD12 LEU 62 HD12 LEU 62 1.777 -3.040 -5.527 534 HD13 LEU 62 HD13 LEU 62 3.069 -2.144 -6.333 535 HD21 LEU 62 HD21 LEU 62 2.539 -2.222 -9.134 536 HD22 LEU 62 HD22 LEU 62 2.572 -0.746 -8.170 537 HD23 LEU 62 HD23 LEU 62 1.198 -1.080 -9.223 538 H GLU 63 HN GLU 63 -1.884 -5.289 -8.647 539 HA GLU 63 HA GLU 63 -4.050 -3.708 -9.218 540 HB2 GLU 63 HB2 GLU 63 -3.906 -6.693 -8.929 541 HB3 GLU 63 HB1 GLU 63 -5.236 -5.842 -9.680 542 HG2 GLU 63 HG2 GLU 63 -3.738 -4.941 -11.340 543 HG3 GLU 63 HG1 GLU 63 -2.389 -5.781 -10.593 544 H LYS 64 HN LYS 64 -3.732 -6.070 -6.650 545 HA LYS 64 HA LYS 64 -6.306 -5.607 -5.503 546 HB2 LYS 64 HB2 LYS 64 -3.848 -6.926 -4.372 547 HB3 LYS 64 HB1 LYS 64 -5.414 -6.910 -3.574 548 HG2 LYS 64 HG2 LYS 64 -5.478 -8.959 -4.582 549 HG3 LYS 64 HG1 LYS 64 -6.228 -7.959 -5.824 550 HD2 LYS 64 HD2 LYS 64 -4.096 -7.790 -6.989 551 HD3 LYS 64 HD1 LYS 64 -3.337 -8.791 -5.749 552 HE2 LYS 64 HE2 LYS 64 -4.905 -10.616 -6.320 553 HE3 LYS 64 HE1 LYS 64 -5.558 -9.616 -7.616 554 HZ1 LYS 64 HZ1 LYS 64 -3.977 -11.077 -8.565 555 HZ2 LYS 64 HZ2 LYS 64 -2.814 -10.717 -7.392 556 HZ3 LYS 64 HZ3 LYS 64 -3.253 -9.549 -8.536 557 H ALA 65 HN ALA 65 -3.019 -4.628 -4.781 558 HA ALA 65 HA ALA 65 -3.472 -3.264 -2.391 559 HB1 ALA 65 HB1 ALA 65 -1.386 -2.646 -4.469 560 HB2 ALA 65 HB2 ALA 65 -1.263 -3.940 -3.279 561 HB3 ALA 65 HB3 ALA 65 -1.314 -2.257 -2.750 562 H LEU 66 HN LEU 66 -3.969 -2.346 -5.686 563 HA LEU 66 HA LEU 66 -4.343 0.464 -5.010 564 HB2 LEU 66 HB2 LEU 66 -4.260 -1.103 -7.526 565 HB3 LEU 66 HB1 LEU 66 -5.210 0.369 -7.540 566 HG LEU 66 HG LEU 66 -2.968 0.751 -8.387 567 HD11 LEU 66 HD11 LEU 66 -4.108 2.572 -7.214 568 HD12 LEU 66 HD12 LEU 66 -2.359 2.651 -6.999 569 HD13 LEU 66 HD13 LEU 66 -3.381 2.046 -5.697 570 HD21 LEU 66 HD21 LEU 66 -1.040 0.609 -6.819 571 HD22 LEU 66 HD22 LEU 66 -1.748 -0.953 -7.247 572 HD23 LEU 66 HD23 LEU 66 -2.105 -0.227 -5.682 573 H ASN 67 HN ASN 67 -6.163 -2.384 -5.510 574 HA ASN 67 HA ASN 67 -8.727 -1.204 -5.645 575 HB2 ASN 67 HB2 ASN 67 -7.680 -3.892 -5.199 576 HB3 ASN 67 HB1 ASN 67 -9.252 -3.580 -4.509 577 HD21 ASN 67 HD21 ASN 67 -7.395 -3.739 -7.439 578 HD22 ASN 67 HD22 ASN 67 -8.759 -3.850 -8.507 579 H LYS 68 HN LYS 68 -6.679 -2.232 -3.035 580 HA LYS 68 HA LYS 68 -8.443 -1.770 -0.887 581 HB2 LYS 68 HB2 LYS 68 -5.460 -1.320 -0.862 582 HB3 LYS 68 HB1 LYS 68 -6.489 -1.665 0.520 583 HG2 LYS 68 HG2 LYS 68 -5.911 -3.565 -1.743 584 HG3 LYS 68 HG1 LYS 68 -5.191 -3.618 -0.134 585 HD2 LYS 68 HD2 LYS 68 -7.450 -3.926 0.825 586 HD3 LYS 68 HD1 LYS 68 -8.108 -3.960 -0.811 587 HE2 LYS 68 HE2 LYS 68 -6.826 -5.922 -1.338 588 HE3 LYS 68 HE1 LYS 68 -6.032 -5.869 0.236 589 HZ1 LYS 68 HZ1 LYS 68 -8.919 -6.342 -0.265 590 HZ2 LYS 68 HZ2 LYS 68 -8.213 -6.209 1.268 591 HZ3 LYS 68 HZ3 LYS 68 -7.788 -7.492 0.250 592 H GLY 69 HN GLY 69 -6.241 0.289 -2.673 593 HA2 GLY 69 HA2 GLY 69 -6.801 2.604 -1.066 594 HA3 GLY 69 HA1 GLY 69 -5.837 2.563 -2.534 595 H ARG 70 HN ARG 70 -8.549 0.971 -3.268 596 HA ARG 70 HA ARG 70 -10.409 1.349 -4.482 597 HB2 ARG 70 HB2 ARG 70 -10.826 2.837 -2.345 598 HB3 ARG 70 HB1 ARG 70 -10.627 4.160 -3.480 599 HG2 ARG 70 HG2 ARG 70 -12.671 1.954 -3.675 600 HG3 ARG 70 HG1 ARG 70 -12.975 3.609 -3.159 601 HD2 ARG 70 HD2 ARG 70 -12.167 4.351 -5.422 602 HD3 ARG 70 HD1 ARG 70 -12.154 2.653 -5.896 603 HE ARG 70 HE ARG 70 -14.653 3.655 -4.815 604 HH11 ARG 70 HH11 ARG 70 -12.792 2.884 -7.685 605 HH12 ARG 70 HH12 ARG 70 -14.179 2.902 -8.732 606 HH21 ARG 70 HH21 ARG 70 -16.463 3.678 -6.189 607 HH22 ARG 70 HH22 ARG 70 -16.265 3.348 -7.882 608 H ARG 71 HN ARG 71 -8.998 1.282 -6.340 609 HA ARG 71 HA ARG 71 -8.386 3.775 -7.652 610 HB2 ARG 71 HB2 ARG 71 -7.704 2.404 -9.549 611 HB3 ARG 71 HB1 ARG 71 -7.013 1.764 -8.067 612 HG2 ARG 71 HG2 ARG 71 -8.749 0.034 -8.015 613 HG3 ARG 71 HG1 ARG 71 -9.411 0.669 -9.523 614 HD2 ARG 71 HD2 ARG 71 -7.194 0.254 -10.585 615 HD3 ARG 71 HD1 ARG 71 -6.679 -0.528 -9.091 616 HE ARG 71 HE ARG 71 -9.086 -1.684 -10.030 617 HH11 ARG 71 HH11 ARG 71 -5.650 -1.588 -10.667 618 HH12 ARG 71 HH12 ARG 71 -5.623 -3.134 -11.454 619 HH21 ARG 71 HH21 ARG 71 -9.053 -3.731 -11.047 620 HH22 ARG 71 HH22 ARG 71 -7.557 -4.358 -11.664 621 H GLU 72 HN GLU 72 -9.433 4.455 -9.661 622 HA GLU 72 HA GLU 72 -12.287 3.779 -9.534 623 HB2 GLU 72 HB2 GLU 72 -12.577 6.085 -10.606 624 HB3 GLU 72 HB1 GLU 72 -12.121 6.016 -8.910 625 HG2 GLU 72 HG2 GLU 72 -9.819 6.489 -9.476 626 HG3 GLU 72 HG1 GLU 72 -10.216 6.468 -11.194 627 H GLU 73 HN GLU 73 -11.696 1.979 -10.956 628 HA GLU 73 HA GLU 73 -11.949 0.934 -12.944 629 HB2 GLU 73 HB2 GLU 73 -14.068 2.176 -12.859 630 HB3 GLU 73 HB1 GLU 73 -13.313 3.515 -13.710 631 HG2 GLU 73 HG2 GLU 73 -12.982 2.124 -15.662 632 HG3 GLU 73 HG1 GLU 73 -13.651 0.736 -14.806 633 H LYS 74 HN LYS 74 -9.856 0.702 -13.644 634 HA LYS 74 HA LYS 74 -8.614 2.853 -15.140 635 HB2 LYS 74 HB2 LYS 74 -7.631 0.078 -14.468 636 HB3 LYS 74 HB1 LYS 74 -6.689 1.297 -15.313 637 HG2 LYS 74 HG2 LYS 74 -6.876 2.766 -13.339 638 HG3 LYS 74 HG1 LYS 74 -7.736 1.477 -12.495 639 HD2 LYS 74 HD2 LYS 74 -5.425 1.426 -11.835 640 HD3 LYS 74 HD1 LYS 74 -5.755 0.012 -12.836 641 HE2 LYS 74 HE2 LYS 74 -4.810 1.214 -14.778 642 HE3 LYS 74 HE1 LYS 74 -4.415 2.566 -13.721 643 HZ1 LYS 74 HZ1 LYS 74 -2.513 1.128 -14.087 644 HZ2 LYS 74 HZ2 LYS 74 -3.356 -0.193 -13.457 645 HZ3 LYS 74 HZ3 LYS 74 -2.963 1.114 -12.459 646 H VAL 75 HN VAL 75 -10.587 2.580 -16.652 647 HA VAL 75 HA VAL 75 -9.981 0.613 -18.733 648 HB VAL 75 HB VAL 75 -12.343 0.819 -18.117 649 HG11 VAL 75 HG11 VAL 75 -12.113 3.667 -19.063 650 HG12 VAL 75 HG12 VAL 75 -12.429 3.126 -17.414 651 HG13 VAL 75 HG13 VAL 75 -13.620 2.838 -18.680 652 HG21 VAL 75 HG21 VAL 75 -13.281 1.163 -20.370 653 HG22 VAL 75 HG22 VAL 75 -11.844 0.142 -20.378 654 HG23 VAL 75 HG23 VAL 75 -11.732 1.826 -20.890 655 H GLY 76 HN GLY 76 -10.205 4.090 -18.196 656 HA2 GLY 76 HA2 GLY 76 -8.235 4.491 -20.320 657 HA3 GLY 76 HA1 GLY 76 -9.754 5.376 -20.437 658 H LYS 77 HN LYS 77 -8.216 4.574 -17.426 659 HA LYS 77 HA LYS 77 -8.436 7.245 -16.494 660 HB2 LYS 77 HB2 LYS 77 -8.664 5.253 -15.039 661 HB3 LYS 77 HB1 LYS 77 -6.962 4.899 -15.282 662 HG2 LYS 77 HG2 LYS 77 -7.171 5.920 -13.160 663 HG3 LYS 77 HG1 LYS 77 -6.441 7.112 -14.232 664 HD2 LYS 77 HD2 LYS 77 -9.399 7.128 -13.965 665 HD3 LYS 77 HD1 LYS 77 -8.451 7.706 -12.597 666 HE2 LYS 77 HE2 LYS 77 -7.374 9.359 -13.974 667 HE3 LYS 77 HE1 LYS 77 -8.144 8.717 -15.421 668 HZ1 LYS 77 HZ1 LYS 77 -9.293 10.675 -14.671 669 HZ2 LYS 77 HZ2 LYS 77 -9.517 10.011 -13.132 670 HZ3 LYS 77 HZ3 LYS 77 -10.300 9.331 -14.470 671 H LYS 78 HN LYS 78 -7.142 8.798 -17.230 672 HA LYS 78 HA LYS 78 -4.402 8.178 -17.985 673 HB2 LYS 78 HB2 LYS 78 -6.144 10.609 -18.349 674 HB3 LYS 78 HB1 LYS 78 -4.437 10.597 -18.765 675 HG2 LYS 78 HG2 LYS 78 -4.828 8.777 -20.340 676 HG3 LYS 78 HG1 LYS 78 -6.542 8.784 -19.922 677 HD2 LYS 78 HD2 LYS 78 -6.841 10.955 -20.839 678 HD3 LYS 78 HD1 LYS 78 -5.101 11.195 -21.001 679 HE2 LYS 78 HE2 LYS 78 -6.729 9.143 -22.496 680 HE3 LYS 78 HE1 LYS 78 -6.182 10.686 -23.153 681 HZ1 LYS 78 HZ1 LYS 78 -4.408 8.516 -22.174 682 HZ2 LYS 78 HZ2 LYS 78 -3.901 9.983 -22.847 683 HZ3 LYS 78 HZ3 LYS 78 -4.730 8.857 -23.799 684 H GLU 79 HN GLU 79 -2.667 8.725 -16.888 685 HA GLU 79 HA GLU 79 -2.818 9.741 -14.236 686 HB2 GLU 79 HB2 GLU 79 -0.496 9.240 -16.099 687 HB3 GLU 79 HB1 GLU 79 -0.296 9.797 -14.448 688 HG2 GLU 79 HG2 GLU 79 -1.331 7.770 -13.613 689 HG3 GLU 79 HG1 GLU 79 -1.606 7.216 -15.264 690 H LYS 80 HN LYS 80 -2.322 11.142 -17.365 691 HA LYS 80 HA LYS 80 -1.881 13.229 -18.119 692 HB2 LYS 80 HB2 LYS 80 -3.096 14.011 -15.463 693 HB3 LYS 80 HB1 LYS 80 -2.773 15.129 -16.782 694 HG2 LYS 80 HG2 LYS 80 -4.292 13.784 -18.214 695 HG3 LYS 80 HG1 LYS 80 -4.693 12.813 -16.795 696 HD2 LYS 80 HD2 LYS 80 -5.503 14.832 -15.658 697 HD3 LYS 80 HD1 LYS 80 -5.118 15.787 -17.092 698 HE2 LYS 80 HE2 LYS 80 -6.683 14.394 -18.397 699 HE3 LYS 80 HE1 LYS 80 -7.107 13.527 -16.923 700 HZ1 LYS 80 HZ1 LYS 80 -7.887 15.631 -15.982 701 HZ2 LYS 80 HZ2 LYS 80 -8.729 15.223 -17.388 702 HZ3 LYS 80 HZ3 LYS 80 -7.537 16.420 -17.438 703 H ILE 81 HN ILE 81 0.347 12.778 -18.060 704 HA ILE 81 HA ILE 81 2.025 13.163 -15.839 705 HB ILE 81 HB ILE 81 2.879 13.475 -18.718 706 HG12 ILE 81 HG12 ILE 81 2.551 10.903 -17.153 707 HG13 ILE 81 HG11 ILE 81 1.484 11.439 -18.444 708 HG21 ILE 81 HG21 ILE 81 4.575 14.020 -17.062 709 HG22 ILE 81 HG22 ILE 81 4.988 12.517 -17.889 710 HG23 ILE 81 HG23 ILE 81 4.315 12.471 -16.259 711 HD11 ILE 81 HD11 ILE 81 3.328 11.308 -20.030 712 HD12 ILE 81 HD12 ILE 81 3.052 9.761 -19.230 713 HD13 ILE 81 HD13 ILE 81 4.404 10.780 -18.736 714 H GLY 82 HN GLY 82 0.578 15.384 -18.041 715 HA2 GLY 82 HA2 GLY 82 2.309 17.584 -17.765 716 HA3 GLY 82 HA1 GLY 82 0.596 17.676 -18.140 717 H LYS 83 HN LYS 83 -0.134 16.265 -15.667 718 HA LYS 83 HA LYS 83 0.236 18.482 -13.775 719 HB2 LYS 83 HB2 LYS 83 -1.789 16.232 -13.759 720 HB3 LYS 83 HB1 LYS 83 -1.720 17.556 -12.605 721 HG2 LYS 83 HG2 LYS 83 -2.276 19.150 -14.312 722 HG3 LYS 83 HG1 LYS 83 -2.169 17.906 -15.558 723 HD2 LYS 83 HD2 LYS 83 -4.486 18.319 -15.034 724 HD3 LYS 83 HD1 LYS 83 -4.038 16.708 -14.476 725 HE2 LYS 83 HE2 LYS 83 -3.685 17.689 -12.204 726 HE3 LYS 83 HE1 LYS 83 -4.352 19.201 -12.814 727 HZ1 LYS 83 HZ1 LYS 83 -6.398 17.978 -13.366 728 HZ2 LYS 83 HZ2 LYS 83 -6.055 17.950 -11.712 729 HZ3 LYS 83 HZ3 LYS 83 -5.746 16.587 -12.658 730 H LYS 84 HN LYS 84 0.230 14.956 -14.006 731 HA LYS 84 HA LYS 84 1.514 14.644 -11.433 732 HB2 LYS 84 HB2 LYS 84 -0.168 13.021 -12.267 733 HB3 LYS 84 HB1 LYS 84 0.911 12.600 -13.585 734 HG2 LYS 84 HG2 LYS 84 2.497 11.648 -12.064 735 HG3 LYS 84 HG1 LYS 84 1.580 12.232 -10.672 736 HD2 LYS 84 HD2 LYS 84 -0.240 10.762 -11.166 737 HD3 LYS 84 HD1 LYS 84 0.473 10.310 -12.713 738 HE2 LYS 84 HE2 LYS 84 1.834 9.789 -10.084 739 HE3 LYS 84 HE1 LYS 84 0.713 8.642 -10.817 740 HZ1 LYS 84 HZ1 LYS 84 2.127 8.444 -12.716 741 HZ2 LYS 84 HZ2 LYS 84 3.072 8.200 -11.328 742 HZ3 LYS 84 HZ3 LYS 84 3.154 9.673 -12.155 743 H LYS 85 HN LYS 85 3.171 16.193 -12.428 744 HA LYS 85 HA LYS 85 5.229 14.829 -13.989 745 HB2 LYS 85 HB2 LYS 85 6.306 17.101 -13.990 746 HB3 LYS 85 HB1 LYS 85 4.718 17.048 -14.743 747 HG2 LYS 85 HG2 LYS 85 3.710 17.995 -12.749 748 HG3 LYS 85 HG1 LYS 85 5.274 17.986 -11.933 749 HD2 LYS 85 HD2 LYS 85 4.630 19.541 -14.438 750 HD3 LYS 85 HD1 LYS 85 4.659 20.213 -12.807 751 HE2 LYS 85 HE2 LYS 85 7.041 19.511 -12.632 752 HE3 LYS 85 HE1 LYS 85 6.974 19.018 -14.323 753 HZ1 LYS 85 HZ1 LYS 85 7.905 21.204 -14.146 754 HZ2 LYS 85 HZ2 LYS 85 6.572 21.761 -13.273 755 HZ3 LYS 85 HZ3 LYS 85 6.393 21.318 -14.891 756 H ARG 86 HN ARG 86 4.841 13.765 -11.489 757 HA ARG 86 HA ARG 86 6.658 14.974 -9.590 758 HB2 ARG 86 HB2 ARG 86 5.058 12.412 -9.455 759 HB3 ARG 86 HB1 ARG 86 5.992 13.091 -8.128 760 HG2 ARG 86 HG2 ARG 86 4.576 15.036 -8.068 761 HG3 ARG 86 HG1 ARG 86 3.688 14.472 -9.484 762 HD2 ARG 86 HD2 ARG 86 2.427 14.004 -7.476 763 HD3 ARG 86 HD1 ARG 86 2.958 12.498 -8.220 764 HE ARG 86 HE ARG 86 4.896 12.956 -6.415 765 HH11 ARG 86 HH11 ARG 86 1.407 12.947 -6.193 766 HH12 ARG 86 HH12 ARG 86 1.385 12.502 -4.514 767 HH21 ARG 86 HH21 ARG 86 4.865 12.316 -4.202 768 HH22 ARG 86 HH22 ARG 86 3.339 12.093 -3.405 769 H GLN 87 HN GLN 87 8.353 14.678 -11.357 770 HA GLN 87 HA GLN 87 9.503 12.094 -11.707 771 HB2 GLN 87 HB2 GLN 87 10.678 14.848 -12.127 772 HB3 GLN 87 HB1 GLN 87 11.437 13.347 -12.637 773 HG2 GLN 87 HG2 GLN 87 9.582 12.904 -14.145 774 HG3 GLN 87 HG1 GLN 87 8.785 14.384 -13.613 775 HE21 GLN 87 HE21 GLN 87 9.681 13.603 -16.276 776 HE22 GLN 87 HE22 GLN 87 10.789 14.829 -16.793 777 H LYS 88 HN LYS 88 11.261 11.185 -10.693 778 HA LYS 88 HA LYS 88 11.856 12.254 -8.048 779 HB2 LYS 88 HB2 LYS 88 12.407 9.594 -9.366 780 HB3 LYS 88 HB1 LYS 88 13.129 10.037 -7.826 781 HG2 LYS 88 HG2 LYS 88 11.191 8.687 -7.421 782 HG3 LYS 88 HG1 LYS 88 10.856 10.334 -6.889 783 HD2 LYS 88 HD2 LYS 88 9.696 10.725 -9.062 784 HD3 LYS 88 HD1 LYS 88 9.921 9.016 -9.437 785 HE2 LYS 88 HE2 LYS 88 8.596 8.384 -7.520 786 HE3 LYS 88 HE1 LYS 88 8.450 10.067 -7.024 787 HZ1 LYS 88 HZ1 LYS 88 7.358 8.892 -9.524 788 HZ2 LYS 88 HZ2 LYS 88 7.237 10.517 -9.073 789 HZ3 LYS 88 HZ3 LYS 88 6.459 9.326 -8.156 790 H LYS 89 HN LYS 89 12.835 13.931 -9.793 791 HA LYS 89 HA LYS 89 15.544 13.233 -10.566 792 HB2 LYS 89 HB2 LYS 89 13.909 14.557 -12.012 793 HB3 LYS 89 HB1 LYS 89 14.167 15.896 -10.906 794 HG2 LYS 89 HG2 LYS 89 15.552 16.179 -12.846 795 HG3 LYS 89 HG1 LYS 89 16.570 15.848 -11.447 796 HD2 LYS 89 HD2 LYS 89 17.330 14.618 -13.425 797 HD3 LYS 89 HD1 LYS 89 16.802 13.525 -12.148 798 HE2 LYS 89 HE2 LYS 89 15.994 12.753 -14.298 799 HE3 LYS 89 HE1 LYS 89 14.644 13.253 -13.288 800 HZ1 LYS 89 HZ1 LYS 89 14.374 14.046 -15.543 801 HZ2 LYS 89 HZ2 LYS 89 15.861 14.845 -15.478 802 HZ3 LYS 89 HZ3 LYS 89 14.587 15.358 -14.496 803 H ARG 90 HN ARG 90 15.721 12.993 -8.055 804 HA ARG 90 HA ARG 90 16.374 15.509 -6.744 805 HB2 ARG 90 HB2 ARG 90 15.151 13.744 -5.507 806 HB3 ARG 90 HB1 ARG 90 16.523 12.666 -5.715 807 HG2 ARG 90 HG2 ARG 90 17.912 14.123 -4.369 808 HG3 ARG 90 HG1 ARG 90 16.586 15.278 -4.218 809 HD2 ARG 90 HD2 ARG 90 16.549 12.432 -3.224 810 HD3 ARG 90 HD1 ARG 90 16.822 13.856 -2.221 811 HE ARG 90 HE ARG 90 14.493 14.517 -3.169 812 HH11 ARG 90 HH11 ARG 90 15.520 11.291 -2.251 813 HH12 ARG 90 HH12 ARG 90 13.917 10.767 -1.837 814 HH21 ARG 90 HH21 ARG 90 12.397 13.832 -2.634 815 HH22 ARG 90 HH22 ARG 90 12.135 12.210 -2.071 816 H LYS 91 HN LYS 91 18.318 16.349 -7.109 817 HA LYS 91 HA LYS 91 20.588 14.519 -7.458 818 HB2 LYS 91 HB2 LYS 91 21.496 15.889 -9.222 819 HB3 LYS 91 HB1 LYS 91 19.857 15.440 -9.652 820 HG2 LYS 91 HG2 LYS 91 20.530 18.090 -8.404 821 HG3 LYS 91 HG1 LYS 91 20.576 17.817 -10.144 822 HD2 LYS 91 HD2 LYS 91 18.203 17.165 -10.087 823 HD3 LYS 91 HD1 LYS 91 18.172 17.481 -8.351 824 HE2 LYS 91 HE2 LYS 91 18.746 19.821 -8.765 825 HE3 LYS 91 HE1 LYS 91 18.785 19.508 -10.498 826 HZ1 LYS 91 HZ1 LYS 91 16.697 20.505 -9.845 827 HZ2 LYS 91 HZ2 LYS 91 16.404 19.257 -8.744 828 HZ3 LYS 91 HZ3 LYS 91 16.433 18.932 -10.399 829 H ALA 92 HN ALA 92 22.633 16.301 -7.634 830 HA ALA 92 HA ALA 92 23.101 17.129 -5.008 831 HB1 ALA 92 HB1 ALA 92 25.049 18.284 -5.880 832 HB2 ALA 92 HB2 ALA 92 24.402 18.181 -7.518 833 HB3 ALA 92 HB3 ALA 92 24.874 16.712 -6.663 834 H ALA 93 HN ALA 93 23.267 19.232 -4.103 835 HA ALA 93 HA ALA 93 22.403 21.233 -3.495 836 HB1 ALA 93 HB1 ALA 93 22.041 22.920 -5.226 837 HB2 ALA 93 HB2 ALA 93 22.121 21.670 -6.468 838 HB3 ALA 93 HB3 ALA 93 23.547 22.042 -5.498 839 H GLN 94 HN GLN 94 20.700 19.249 -3.147 840 HA GLN 94 HA GLN 94 18.183 19.798 -4.499 841 HB2 GLN 94 HB2 GLN 94 17.380 17.773 -3.462 842 HB3 GLN 94 HB1 GLN 94 18.967 17.469 -4.149 843 HG2 GLN 94 HG2 GLN 94 19.832 17.983 -1.770 844 HG3 GLN 94 HG1 GLN 94 18.164 17.702 -1.281 845 HE21 GLN 94 HE21 GLN 94 19.861 16.057 -3.883 846 HE22 GLN 94 HE22 GLN 94 19.857 14.494 -3.140 847 H LYS 95 HN LYS 95 19.777 20.831 -1.735 848 HA LYS 95 HA LYS 95 17.370 21.330 -0.189 849 HB2 LYS 95 HB2 LYS 95 20.293 21.839 0.267 850 HB3 LYS 95 HB1 LYS 95 19.097 22.683 1.236 851 HG2 LYS 95 HG2 LYS 95 19.772 20.798 2.480 852 HG3 LYS 95 HG1 LYS 95 18.161 20.439 1.863 853 HD2 LYS 95 HD2 LYS 95 19.453 18.474 1.580 854 HD3 LYS 95 HD1 LYS 95 19.284 19.199 -0.019 855 HE2 LYS 95 HE2 LYS 95 21.562 18.425 0.339 856 HE3 LYS 95 HE1 LYS 95 21.519 20.180 0.192 857 HZ1 LYS 95 HZ1 LYS 95 21.731 20.392 2.553 858 HZ2 LYS 95 HZ2 LYS 95 22.958 19.370 2.004 859 HZ3 LYS 95 HZ3 LYS 95 21.603 18.720 2.776 860 H ARG 96 HN ARG 96 19.844 23.187 -1.894 861 HA ARG 96 HA ARG 96 17.974 25.455 -2.007 862 HB2 ARG 96 HB2 ARG 96 20.995 25.413 -2.128 863 HB3 ARG 96 HB1 ARG 96 20.021 26.839 -2.447 864 HG2 ARG 96 HG2 ARG 96 19.147 26.773 -0.182 865 HG3 ARG 96 HG1 ARG 96 20.078 25.309 0.143 866 HD2 ARG 96 HD2 ARG 96 22.147 26.518 -0.221 867 HD3 ARG 96 HD1 ARG 96 21.247 27.975 -0.635 868 HE ARG 96 HE ARG 96 20.334 27.459 1.825 869 HH11 ARG 96 HH11 ARG 96 23.591 27.485 0.563 870 HH12 ARG 96 HH12 ARG 96 24.298 28.055 2.040 871 HH21 ARG 96 HH21 ARG 96 21.257 28.198 3.780 872 HH22 ARG 96 HH22 ARG 96 22.967 28.476 3.868 873 H LYS 97 HN LYS 97 16.906 24.627 -3.821 874 HA LYS 97 HA LYS 97 18.421 23.998 -6.200 875 HB2 LYS 97 HB2 LYS 97 15.447 24.093 -5.683 876 HB3 LYS 97 HB1 LYS 97 16.171 23.595 -7.204 877 HG2 LYS 97 HG2 LYS 97 17.304 21.752 -6.066 878 HG3 LYS 97 HG1 LYS 97 16.573 22.249 -4.540 879 HD2 LYS 97 HD2 LYS 97 14.852 21.646 -6.913 880 HD3 LYS 97 HD1 LYS 97 15.493 20.333 -5.928 881 HE2 LYS 97 HE2 LYS 97 13.288 20.891 -5.153 882 HE3 LYS 97 HE1 LYS 97 14.462 21.378 -3.937 883 HZ1 LYS 97 HZ1 LYS 97 13.271 23.231 -5.921 884 HZ2 LYS 97 HZ2 LYS 97 14.232 23.642 -4.593 885 HZ3 LYS 97 HZ3 LYS 97 12.680 23.021 -4.352 886 H ASN 98 HN ASN 98 19.249 26.343 -5.882 887 HA ASN 98 HA ASN 98 17.541 28.314 -7.150 888 HB2 ASN 98 HB2 ASN 98 19.454 29.860 -6.827 889 HB3 ASN 98 HB1 ASN 98 18.943 29.098 -5.328 890 HD21 ASN 98 HD21 ASN 98 21.478 29.500 -7.606 891 HD22 ASN 98 HD22 ASN 98 22.682 28.600 -6.753 Start of MODEL 20 1 H1 LYS 1 HT1 LYS 1 1.751 21.352 -11.290 2 H2 LYS 1 HT2 LYS 1 3.062 21.255 -10.229 3 H3 LYS 1 HT3 LYS 1 1.557 20.650 -9.764 4 HA LYS 1 HA LYS 1 1.654 18.942 -11.401 5 HB2 LYS 1 HB2 LYS 1 3.642 18.620 -12.778 6 HB3 LYS 1 HB1 LYS 1 2.938 20.199 -13.088 7 HG2 LYS 1 HG2 LYS 1 4.643 21.255 -11.719 8 HG3 LYS 1 HG1 LYS 1 5.329 19.675 -11.336 9 HD2 LYS 1 HD2 LYS 1 5.766 19.322 -13.743 10 HD3 LYS 1 HD1 LYS 1 5.160 20.948 -14.067 11 HE2 LYS 1 HE2 LYS 1 6.926 21.894 -12.682 12 HE3 LYS 1 HE1 LYS 1 7.514 20.277 -12.303 13 HZ1 LYS 1 HZ1 LYS 1 7.464 21.516 -15.001 14 HZ2 LYS 1 HZ2 LYS 1 8.003 19.955 -14.655 15 HZ3 LYS 1 HZ3 LYS 1 8.836 21.290 -14.039 16 HA PRO 2 HA PRO 2 3.271 16.574 -8.049 17 HB2 PRO 2 HB2 PRO 2 3.864 14.533 -10.135 18 HB3 PRO 2 HB1 PRO 2 2.940 14.378 -8.641 19 HG2 PRO 2 HG2 PRO 2 1.685 14.489 -10.963 20 HG3 PRO 2 HG1 PRO 2 1.042 15.347 -9.549 21 HD2 PRO 2 HD2 PRO 2 2.548 16.421 -11.894 22 HD3 PRO 2 HD1 PRO 2 1.157 17.116 -11.039 23 H VAL 3 HN VAL 3 5.193 16.699 -7.102 24 HA VAL 3 HA VAL 3 7.591 16.689 -8.807 25 HB VAL 3 HB VAL 3 7.193 18.900 -7.869 26 HG11 VAL 3 HG11 VAL 3 7.260 19.308 -5.459 27 HG12 VAL 3 HG12 VAL 3 7.329 17.570 -5.172 28 HG13 VAL 3 HG13 VAL 3 5.896 18.283 -5.909 29 HG21 VAL 3 HG21 VAL 3 9.343 19.250 -6.748 30 HG22 VAL 3 HG22 VAL 3 9.499 18.204 -8.160 31 HG23 VAL 3 HG23 VAL 3 9.509 17.506 -6.540 32 H SER 4 HN SER 4 9.259 15.405 -8.272 33 HA SER 4 HA SER 4 8.959 13.665 -5.926 34 HB2 SER 4 HB2 SER 4 10.686 13.307 -8.394 35 HB3 SER 4 HB1 SER 4 10.480 12.132 -7.096 36 HG SER 4 HG SER 4 8.083 12.511 -7.749 37 H LEU 5 HN LEU 5 11.517 12.840 -5.535 38 HA LEU 5 HA LEU 5 13.541 13.301 -4.657 39 HB2 LEU 5 HB2 LEU 5 13.133 15.889 -6.095 40 HB3 LEU 5 HB1 LEU 5 14.620 15.492 -5.254 41 HG LEU 5 HG LEU 5 13.461 14.069 -7.657 42 HD11 LEU 5 HD11 LEU 5 14.493 16.209 -8.182 43 HD12 LEU 5 HD12 LEU 5 15.470 14.873 -8.787 44 HD13 LEU 5 HD13 LEU 5 15.956 15.728 -7.324 45 HD21 LEU 5 HD21 LEU 5 14.517 12.442 -6.223 46 HD22 LEU 5 HD22 LEU 5 15.940 13.469 -6.048 47 HD23 LEU 5 HD23 LEU 5 15.554 12.755 -7.614 48 H SER 6 HN SER 6 11.566 16.279 -4.393 49 HA SER 6 HA SER 6 12.564 16.873 -1.791 50 HB2 SER 6 HB2 SER 6 10.570 18.520 -1.828 51 HB3 SER 6 HB1 SER 6 11.861 18.759 -3.004 52 HG SER 6 HG SER 6 9.452 18.671 -3.649 53 H TYR 7 HN TYR 7 10.294 14.781 -2.983 54 HA TYR 7 HA TYR 7 9.025 14.435 -0.360 55 HB2 TYR 7 HB2 TYR 7 8.244 13.528 -3.113 56 HB3 TYR 7 HB1 TYR 7 7.560 12.780 -1.682 57 HD1 TYR 7 HD1 TYR 7 5.729 13.770 -0.574 58 HD2 TYR 7 HD2 TYR 7 7.931 16.029 -3.429 59 HE1 TYR 7 HE1 TYR 7 4.045 15.560 -0.451 60 HE2 TYR 7 HE2 TYR 7 6.254 17.821 -3.315 61 HH TYR 7 HH TYR 7 3.866 17.944 -0.880 62 H ARG 8 HN ARG 8 9.580 12.782 0.856 63 HA ARG 8 HA ARG 8 10.905 10.501 -0.416 64 HB2 ARG 8 HB2 ARG 8 12.374 10.241 1.528 65 HB3 ARG 8 HB1 ARG 8 12.627 11.781 0.727 66 HG2 ARG 8 HG2 ARG 8 11.384 12.922 2.463 67 HG3 ARG 8 HG1 ARG 8 11.030 11.379 3.249 68 HD2 ARG 8 HD2 ARG 8 13.746 12.621 2.840 69 HD3 ARG 8 HD1 ARG 8 12.887 12.445 4.371 70 HE ARG 8 HE ARG 8 13.043 9.934 3.785 71 HH11 ARG 8 HH11 ARG 8 15.501 12.342 3.138 72 HH12 ARG 8 HH12 ARG 8 16.798 11.191 3.108 73 HH21 ARG 8 HH21 ARG 8 14.737 8.421 3.751 74 HH22 ARG 8 HH22 ARG 8 16.368 8.955 3.477 75 H CYS 9 HN CYS 9 9.910 8.677 -0.077 76 HA CYS 9 HA CYS 9 7.495 8.700 1.437 77 HB2 CYS 9 HB2 CYS 9 8.789 6.468 -0.130 78 HB3 CYS 9 HB1 CYS 9 7.106 6.578 0.352 79 HA PRO 10 HA PRO 10 8.433 6.836 5.166 80 HB2 PRO 10 HB2 PRO 10 6.902 4.354 4.813 81 HB3 PRO 10 HB1 PRO 10 6.615 5.700 5.914 82 HG2 PRO 10 HG2 PRO 10 5.030 5.264 3.804 83 HG3 PRO 10 HG1 PRO 10 5.423 6.905 4.355 84 HD2 PRO 10 HD2 PRO 10 6.595 5.338 2.087 85 HD3 PRO 10 HD1 PRO 10 6.102 7.031 2.136 86 H CYS 11 HN CYS 11 8.360 4.094 2.903 87 HA CYS 11 HA CYS 11 10.602 2.893 4.332 88 HB2 CYS 11 HB2 CYS 11 8.646 1.527 3.376 89 HB3 CYS 11 HB1 CYS 11 9.405 1.785 1.814 90 H ARG 12 HN ARG 12 12.629 2.587 3.511 91 HA ARG 12 HA ARG 12 13.614 4.322 1.564 92 HB2 ARG 12 HB2 ARG 12 15.681 2.920 1.641 93 HB3 ARG 12 HB1 ARG 12 15.152 3.617 3.166 94 HG2 ARG 12 HG2 ARG 12 15.720 1.448 3.696 95 HG3 ARG 12 HG1 ARG 12 13.968 1.424 3.567 96 HD2 ARG 12 HD2 ARG 12 14.153 0.570 1.296 97 HD3 ARG 12 HD1 ARG 12 15.909 0.552 1.445 98 HE ARG 12 HE ARG 12 14.516 -0.998 3.454 99 HH11 ARG 12 HH11 ARG 12 15.932 -1.011 0.263 100 HH12 ARG 12 HH12 ARG 12 16.301 -2.712 0.275 101 HH21 ARG 12 HH21 ARG 12 14.947 -3.246 3.488 102 HH22 ARG 12 HH22 ARG 12 15.727 -3.984 2.127 103 H PHE 13 HN PHE 13 15.186 2.947 -0.206 104 HA PHE 13 HA PHE 13 13.115 2.305 -2.097 105 HB2 PHE 13 HB2 PHE 13 16.113 2.144 -2.485 106 HB3 PHE 13 HB1 PHE 13 14.883 2.278 -3.740 107 HD1 PHE 13 HD1 PHE 13 13.897 4.397 -4.292 108 HD2 PHE 13 HD2 PHE 13 16.635 4.061 -1.052 109 HE1 PHE 13 HE1 PHE 13 14.060 6.841 -4.176 110 HE2 PHE 13 HE2 PHE 13 16.799 6.493 -0.928 111 HZ PHE 13 HZ PHE 13 15.514 7.903 -2.493 112 H PHE 14 HN PHE 14 12.770 0.326 -3.063 113 HA PHE 14 HA PHE 14 12.939 -1.655 -0.970 114 HB2 PHE 14 HB2 PHE 14 11.333 -2.279 -3.329 115 HB3 PHE 14 HB1 PHE 14 10.889 -2.267 -1.633 116 HD1 PHE 14 HD1 PHE 14 10.126 -0.182 -0.554 117 HD2 PHE 14 HD2 PHE 14 10.965 -0.367 -4.722 118 HE1 PHE 14 HE1 PHE 14 8.890 1.912 -0.892 119 HE2 PHE 14 HE2 PHE 14 9.733 1.732 -5.063 120 HZ PHE 14 HZ PHE 14 8.693 2.870 -3.149 121 H GLU 15 HN GLU 15 12.880 -4.022 -1.712 122 HA GLU 15 HA GLU 15 15.369 -4.438 -3.185 123 HB2 GLU 15 HB2 GLU 15 13.734 -6.356 -1.525 124 HB3 GLU 15 HB1 GLU 15 15.318 -6.684 -2.205 125 HG2 GLU 15 HG2 GLU 15 14.746 -4.543 -0.176 126 HG3 GLU 15 HG1 GLU 15 15.340 -6.157 0.207 127 H SER 16 HN SER 16 15.136 -4.769 -5.282 128 HA SER 16 HA SER 16 12.647 -5.744 -6.383 129 HB2 SER 16 HB2 SER 16 15.177 -5.103 -7.897 130 HB3 SER 16 HB1 SER 16 13.518 -5.077 -8.494 131 HG SER 16 HG SER 16 13.187 -3.178 -7.574 132 H HIS 17 HN HIS 17 14.069 -7.664 -4.811 133 HA HIS 17 HA HIS 17 14.479 -9.705 -6.881 134 HB2 HIS 17 HB2 HIS 17 16.293 -10.717 -5.646 135 HB3 HIS 17 HB1 HIS 17 16.681 -9.044 -5.993 136 HD1 HIS 17 HD1 HIS 17 17.296 -7.590 -4.047 137 HD2 HIS 17 HD2 HIS 17 15.626 -11.207 -2.868 138 HE1 HIS 17 HE1 HIS 17 17.600 -7.695 -1.556 139 HE2 HIS 17 HE2 HIS 17 16.766 -9.978 -0.900 140 H ILE 18 HN ILE 18 12.833 -8.699 -4.216 141 HA ILE 18 HA ILE 18 12.424 -11.101 -2.790 142 HB ILE 18 HB ILE 18 10.606 -8.706 -3.014 143 HG12 ILE 18 HG12 ILE 18 12.751 -9.370 -1.004 144 HG13 ILE 18 HG11 ILE 18 12.852 -8.125 -2.240 145 HG21 ILE 18 HG21 ILE 18 9.430 -10.655 -2.137 146 HG22 ILE 18 HG22 ILE 18 9.673 -9.446 -0.875 147 HG23 ILE 18 HG23 ILE 18 10.695 -10.882 -0.929 148 HD11 ILE 18 HD11 ILE 18 12.361 -7.056 -0.188 149 HD12 ILE 18 HD12 ILE 18 11.064 -8.191 0.174 150 HD13 ILE 18 HD13 ILE 18 10.879 -7.032 -1.144 151 H ALA 19 HN ALA 19 10.946 -12.706 -3.008 152 HA ALA 19 HA ALA 19 9.347 -12.704 -5.485 153 HB1 ALA 19 HB1 ALA 19 9.698 -15.069 -5.649 154 HB2 ALA 19 HB2 ALA 19 10.499 -15.107 -4.080 155 HB3 ALA 19 HB3 ALA 19 11.267 -14.291 -5.443 156 H ARG 20 HN ARG 20 7.368 -13.948 -5.433 157 HA ARG 20 HA ARG 20 5.719 -13.366 -3.233 158 HB2 ARG 20 HB2 ARG 20 5.048 -13.701 -5.663 159 HB3 ARG 20 HB1 ARG 20 5.196 -15.430 -5.364 160 HG2 ARG 20 HG2 ARG 20 3.472 -15.301 -3.663 161 HG3 ARG 20 HG1 ARG 20 3.321 -13.561 -3.931 162 HD2 ARG 20 HD2 ARG 20 2.766 -14.046 -6.305 163 HD3 ARG 20 HD1 ARG 20 2.758 -15.761 -5.907 164 HE ARG 20 HE ARG 20 1.019 -14.362 -4.175 165 HH11 ARG 20 HH11 ARG 20 1.271 -15.497 -7.474 166 HH12 ARG 20 HH12 ARG 20 -0.446 -15.588 -7.708 167 HH21 ARG 20 HH21 ARG 20 -1.246 -14.496 -4.481 168 HH22 ARG 20 HH22 ARG 20 -1.873 -15.022 -6.013 169 H ALA 21 HN ALA 21 7.421 -16.252 -4.276 170 HA ALA 21 HA ALA 21 6.228 -17.939 -2.288 171 HB1 ALA 21 HB1 ALA 21 7.010 -18.863 -4.411 172 HB2 ALA 21 HB2 ALA 21 7.824 -19.623 -3.043 173 HB3 ALA 21 HB3 ALA 21 8.660 -18.400 -3.999 174 H ASN 22 HN ASN 22 8.751 -15.707 -2.375 175 HA ASN 22 HA ASN 22 10.168 -16.939 -0.176 176 HB2 ASN 22 HB2 ASN 22 10.724 -14.665 -2.057 177 HB3 ASN 22 HB1 ASN 22 11.649 -14.836 -0.575 178 HD21 ASN 22 HD21 ASN 22 13.548 -15.176 -1.707 179 HD22 ASN 22 HD22 ASN 22 13.873 -16.653 -2.540 180 H VAL 23 HN VAL 23 7.627 -14.834 -0.585 181 HA VAL 23 HA VAL 23 8.358 -13.281 1.782 182 HB VAL 23 HB VAL 23 7.865 -11.901 -0.143 183 HG11 VAL 23 HG11 VAL 23 5.182 -13.268 -0.108 184 HG12 VAL 23 HG12 VAL 23 6.373 -13.287 -1.417 185 HG13 VAL 23 HG13 VAL 23 5.527 -11.790 -1.009 186 HG21 VAL 23 HG21 VAL 23 6.263 -10.436 0.851 187 HG22 VAL 23 HG22 VAL 23 7.311 -11.136 2.096 188 HG23 VAL 23 HG23 VAL 23 5.670 -11.741 1.877 189 H LYS 24 HN LYS 24 7.095 -13.050 3.447 190 HA LYS 24 HA LYS 24 4.842 -14.861 3.804 191 HB2 LYS 24 HB2 LYS 24 6.393 -13.268 5.853 192 HB3 LYS 24 HB1 LYS 24 5.101 -14.403 6.198 193 HG2 LYS 24 HG2 LYS 24 6.619 -16.092 4.950 194 HG3 LYS 24 HG1 LYS 24 7.882 -14.924 5.319 195 HD2 LYS 24 HD2 LYS 24 6.022 -15.854 7.466 196 HD3 LYS 24 HD1 LYS 24 7.404 -16.834 7.002 197 HE2 LYS 24 HE2 LYS 24 8.899 -14.978 7.470 198 HE3 LYS 24 HE1 LYS 24 7.522 -13.965 7.902 199 HZ1 LYS 24 HZ1 LYS 24 8.561 -14.830 9.873 200 HZ2 LYS 24 HZ2 LYS 24 8.416 -16.421 9.314 201 HZ3 LYS 24 HZ3 LYS 24 7.031 -15.531 9.705 202 H HIS 25 HN HIS 25 3.772 -13.351 5.958 203 HA HIS 25 HA HIS 25 1.658 -12.041 5.020 204 HB2 HIS 25 HB2 HIS 25 3.006 -10.548 7.203 205 HB3 HIS 25 HB1 HIS 25 1.344 -11.095 7.093 206 HD1 HIS 25 HD1 HIS 25 2.724 -11.348 9.707 207 HD2 HIS 25 HD2 HIS 25 2.921 -14.395 6.877 208 HE1 HIS 25 HE1 HIS 25 3.258 -13.434 10.987 209 HE2 HIS 25 HE2 HIS 25 3.435 -15.249 9.254 210 H LEU 26 HN LEU 26 1.416 -10.468 3.546 211 HA LEU 26 HA LEU 26 3.529 -8.441 3.339 212 HB2 LEU 26 HB2 LEU 26 3.433 -9.839 1.391 213 HB3 LEU 26 HB1 LEU 26 1.705 -9.586 1.229 214 HG LEU 26 HG LEU 26 2.033 -7.306 0.540 215 HD11 LEU 26 HD11 LEU 26 3.887 -6.793 2.065 216 HD12 LEU 26 HD12 LEU 26 4.221 -6.285 0.420 217 HD13 LEU 26 HD13 LEU 26 4.964 -7.746 1.060 218 HD21 LEU 26 HD21 LEU 26 2.875 -7.700 -1.552 219 HD22 LEU 26 HD22 LEU 26 2.652 -9.367 -1.014 220 HD23 LEU 26 HD23 LEU 26 4.257 -8.618 -0.946 221 H LYS 27 HN LYS 27 3.081 -6.382 3.520 222 HA LYS 27 HA LYS 27 0.276 -5.497 3.743 223 HB2 LYS 27 HB2 LYS 27 1.000 -5.643 5.984 224 HB3 LYS 27 HB1 LYS 27 2.602 -5.050 5.583 225 HG2 LYS 27 HG2 LYS 27 1.479 -3.340 6.777 226 HG3 LYS 27 HG1 LYS 27 1.603 -2.842 5.088 227 HD2 LYS 27 HD2 LYS 27 -0.594 -2.289 5.857 228 HD3 LYS 27 HD1 LYS 27 -0.741 -3.665 4.764 229 HE2 LYS 27 HE2 LYS 27 -0.980 -5.179 6.605 230 HE3 LYS 27 HE1 LYS 27 -0.618 -3.901 7.762 231 HZ1 LYS 27 HZ1 LYS 27 -2.647 -2.762 7.006 232 HZ2 LYS 27 HZ2 LYS 27 -2.964 -4.264 7.705 233 HZ3 LYS 27 HZ3 LYS 27 -3.017 -4.088 6.024 234 H ILE 28 HN ILE 28 -0.136 -3.395 3.007 235 HA ILE 28 HA ILE 28 2.105 -2.096 1.614 236 HB ILE 28 HB ILE 28 -0.830 -1.795 0.983 237 HG12 ILE 28 HG12 ILE 28 -0.201 -4.080 0.531 238 HG13 ILE 28 HG11 ILE 28 -0.315 -3.223 -0.991 239 HG21 ILE 28 HG21 ILE 28 1.652 -0.965 -0.518 240 HG22 ILE 28 HG22 ILE 28 0.500 0.103 0.286 241 HG23 ILE 28 HG23 ILE 28 0.002 -0.831 -1.125 242 HD11 ILE 28 HD11 ILE 28 1.580 -4.694 -0.990 243 HD12 ILE 28 HD12 ILE 28 2.211 -3.907 0.459 244 HD13 ILE 28 HD13 ILE 28 2.107 -3.010 -1.057 245 H LEU 29 HN LEU 29 2.613 -0.042 2.105 246 HA LEU 29 HA LEU 29 1.315 1.225 4.358 247 HB2 LEU 29 HB2 LEU 29 3.864 1.213 3.631 248 HB3 LEU 29 HB1 LEU 29 3.381 2.615 2.678 249 HG LEU 29 HG LEU 29 4.353 3.351 4.749 250 HD11 LEU 29 HD11 LEU 29 1.349 3.695 4.735 251 HD12 LEU 29 HD12 LEU 29 2.560 4.746 3.993 252 HD13 LEU 29 HD13 LEU 29 2.461 4.624 5.748 253 HD21 LEU 29 HD21 LEU 29 2.286 1.653 6.145 254 HD22 LEU 29 HD22 LEU 29 3.421 2.752 6.928 255 HD23 LEU 29 HD23 LEU 29 4.018 1.334 6.066 256 H ASN 30 HN ASN 30 -0.309 2.602 4.214 257 HA ASN 30 HA ASN 30 -1.283 3.645 1.737 258 HB2 ASN 30 HB2 ASN 30 -2.397 3.236 4.147 259 HB3 ASN 30 HB1 ASN 30 -1.972 4.933 4.306 260 HD21 ASN 30 HD21 ASN 30 -2.941 6.466 2.987 261 HD22 ASN 30 HD22 ASN 30 -4.404 6.127 2.122 262 H THR 31 HN THR 31 0.330 4.882 0.793 263 HA THR 31 HA THR 31 1.749 6.826 2.357 264 HB THR 31 HB THR 31 2.640 7.238 -0.107 265 HG1 THR 31 HG1 THR 31 1.953 4.500 -0.234 266 HG21 THR 31 HG21 THR 31 3.311 4.860 1.610 267 HG22 THR 31 HG22 THR 31 3.947 6.493 1.808 268 HG23 THR 31 HG23 THR 31 4.350 5.558 0.368 269 HA PRO 32 HA PRO 32 0.203 10.887 1.173 270 HB2 PRO 32 HB2 PRO 32 2.803 11.099 -0.231 271 HB3 PRO 32 HB1 PRO 32 2.032 12.215 0.897 272 HG2 PRO 32 HG2 PRO 32 4.044 10.619 1.656 273 HG3 PRO 32 HG1 PRO 32 2.719 11.046 2.747 274 HD2 PRO 32 HD2 PRO 32 3.301 8.493 1.404 275 HD3 PRO 32 HD1 PRO 32 2.400 8.811 2.893 276 H ASN 33 HN ASN 33 0.369 8.447 -0.960 277 HA ASN 33 HA ASN 33 -0.041 8.104 -3.159 278 HB2 ASN 33 HB2 ASN 33 0.174 11.101 -3.534 279 HB3 ASN 33 HB1 ASN 33 -0.178 9.946 -4.812 280 HD21 ASN 33 HD21 ASN 33 -1.364 11.560 -2.004 281 HD22 ASN 33 HD22 ASN 33 -3.024 11.132 -2.193 282 H CYS 34 HN CYS 34 2.154 7.572 -2.013 283 HA CYS 34 HA CYS 34 4.325 8.192 -3.865 284 HB2 CYS 34 HB2 CYS 34 4.070 6.786 -1.226 285 HB3 CYS 34 HB1 CYS 34 5.419 6.393 -2.253 286 H ALA 35 HN ALA 35 5.471 6.112 -4.655 287 HA ALA 35 HA ALA 35 3.782 4.149 -5.720 288 HB1 ALA 35 HB1 ALA 35 5.780 2.729 -5.877 289 HB2 ALA 35 HB2 ALA 35 6.655 3.840 -4.822 290 HB3 ALA 35 HB3 ALA 35 6.126 4.372 -6.418 291 H LEU 36 HN LEU 36 2.705 2.532 -4.765 292 HA LEU 36 HA LEU 36 2.146 2.447 -2.096 293 HB2 LEU 36 HB2 LEU 36 1.992 0.423 -4.299 294 HB3 LEU 36 HB1 LEU 36 1.560 -0.026 -2.674 295 HG LEU 36 HG LEU 36 -0.459 0.517 -3.824 296 HD11 LEU 36 HD11 LEU 36 -0.285 1.339 -1.508 297 HD12 LEU 36 HD12 LEU 36 -1.361 2.317 -2.504 298 HD13 LEU 36 HD13 LEU 36 0.259 2.900 -2.125 299 HD21 LEU 36 HD21 LEU 36 0.832 3.138 -4.569 300 HD22 LEU 36 HD22 LEU 36 -0.831 2.665 -4.921 301 HD23 LEU 36 HD23 LEU 36 0.512 1.791 -5.661 302 H GLN 37 HN GLN 37 3.353 1.978 -0.395 303 HA GLN 37 HA GLN 37 5.927 0.736 -0.688 304 HB2 GLN 37 HB2 GLN 37 4.479 1.367 1.873 305 HB3 GLN 37 HB1 GLN 37 6.207 1.168 1.652 306 HG2 GLN 37 HG2 GLN 37 4.643 3.355 0.321 307 HG3 GLN 37 HG1 GLN 37 5.357 3.522 1.928 308 HE21 GLN 37 HE21 GLN 37 5.845 4.798 -0.687 309 HE22 GLN 37 HE22 GLN 37 7.535 4.633 -0.950 310 H ILE 38 HN ILE 38 6.164 -1.358 -0.768 311 HA ILE 38 HA ILE 38 4.002 -3.043 0.222 312 HB ILE 38 HB ILE 38 6.214 -3.773 -1.695 313 HG12 ILE 38 HG12 ILE 38 3.420 -3.042 -2.508 314 HG13 ILE 38 HG11 ILE 38 4.608 -1.774 -2.249 315 HG21 ILE 38 HG21 ILE 38 5.225 -5.750 -0.926 316 HG22 ILE 38 HG22 ILE 38 4.351 -5.398 -2.422 317 HG23 ILE 38 HG23 ILE 38 3.611 -5.018 -0.862 318 HD11 ILE 38 HD11 ILE 38 6.026 -2.752 -3.955 319 HD12 ILE 38 HD12 ILE 38 4.420 -2.367 -4.576 320 HD13 ILE 38 HD13 ILE 38 4.844 -4.040 -4.199 321 H VAL 39 HN VAL 39 4.442 -3.476 2.319 322 HA VAL 39 HA VAL 39 7.217 -4.039 3.042 323 HB VAL 39 HB VAL 39 5.808 -2.238 4.246 324 HG11 VAL 39 HG11 VAL 39 4.573 -2.983 6.196 325 HG12 VAL 39 HG12 VAL 39 4.779 -4.660 5.690 326 HG13 VAL 39 HG13 VAL 39 3.832 -3.550 4.699 327 HG21 VAL 39 HG21 VAL 39 6.990 -2.682 6.353 328 HG22 VAL 39 HG22 VAL 39 8.020 -2.902 4.939 329 HG23 VAL 39 HG23 VAL 39 7.366 -4.307 5.781 330 H ALA 40 HN ALA 40 7.854 -5.979 3.477 331 HA ALA 40 HA ALA 40 5.841 -8.106 3.761 332 HB1 ALA 40 HB1 ALA 40 8.377 -8.318 2.162 333 HB2 ALA 40 HB2 ALA 40 6.853 -7.791 1.459 334 HB3 ALA 40 HB3 ALA 40 6.989 -9.403 2.151 335 H ARG 41 HN ARG 41 6.569 -10.004 4.846 336 HA ARG 41 HA ARG 41 9.154 -9.731 6.237 337 HB2 ARG 41 HB2 ARG 41 6.608 -11.140 6.969 338 HB3 ARG 41 HB1 ARG 41 8.143 -11.616 7.690 339 HG2 ARG 41 HG2 ARG 41 7.491 -8.737 7.720 340 HG3 ARG 41 HG1 ARG 41 6.558 -9.780 8.771 341 HD2 ARG 41 HD2 ARG 41 8.599 -10.632 9.780 342 HD3 ARG 41 HD1 ARG 41 9.554 -9.627 8.696 343 HE ARG 41 HE ARG 41 7.755 -8.004 10.121 344 HH11 ARG 41 HH11 ARG 41 10.616 -9.945 10.694 345 HH12 ARG 41 HH12 ARG 41 11.188 -8.935 11.984 346 HH21 ARG 41 HH21 ARG 41 8.517 -6.678 11.812 347 HH22 ARG 41 HH22 ARG 41 10.009 -7.071 12.607 348 H LEU 42 HN LEU 42 10.739 -11.095 5.634 349 HA LEU 42 HA LEU 42 10.268 -12.761 3.374 350 HB2 LEU 42 HB2 LEU 42 12.675 -12.316 5.113 351 HB3 LEU 42 HB1 LEU 42 12.687 -13.495 3.815 352 HG LEU 42 HG LEU 42 12.055 -10.580 3.385 353 HD11 LEU 42 HD11 LEU 42 14.681 -12.010 2.984 354 HD12 LEU 42 HD12 LEU 42 14.336 -10.859 4.274 355 HD13 LEU 42 HD13 LEU 42 14.334 -10.325 2.593 356 HD21 LEU 42 HD21 LEU 42 12.568 -11.126 1.044 357 HD22 LEU 42 HD22 LEU 42 11.209 -12.069 1.657 358 HD23 LEU 42 HD23 LEU 42 12.800 -12.815 1.496 359 H LYS 43 HN LYS 43 10.418 -14.971 3.128 360 HA LYS 43 HA LYS 43 9.016 -16.471 4.993 361 HB2 LYS 43 HB2 LYS 43 9.253 -16.929 2.555 362 HB3 LYS 43 HB1 LYS 43 10.868 -17.524 2.886 363 HG2 LYS 43 HG2 LYS 43 9.960 -19.290 4.281 364 HG3 LYS 43 HG1 LYS 43 8.324 -18.685 3.992 365 HD2 LYS 43 HD2 LYS 43 8.610 -20.473 2.481 366 HD3 LYS 43 HD1 LYS 43 8.813 -19.004 1.517 367 HE2 LYS 43 HE2 LYS 43 10.550 -20.452 0.851 368 HE3 LYS 43 HE1 LYS 43 11.294 -19.253 1.908 369 HZ1 LYS 43 HZ1 LYS 43 11.986 -21.599 2.308 370 HZ2 LYS 43 HZ2 LYS 43 10.421 -21.915 2.864 371 HZ3 LYS 43 HZ3 LYS 43 11.395 -20.792 3.672 372 H ASN 44 HN ASN 44 12.442 -16.879 4.137 373 HA ASN 44 HA ASN 44 12.845 -18.587 6.420 374 HB2 ASN 44 HB2 ASN 44 14.768 -17.572 4.345 375 HB3 ASN 44 HB1 ASN 44 15.192 -18.716 5.606 376 HD21 ASN 44 HD21 ASN 44 15.336 -19.065 2.752 377 HD22 ASN 44 HD22 ASN 44 14.309 -20.400 2.358 378 H ASN 45 HN ASN 45 13.833 -15.375 5.381 379 HA ASN 45 HA ASN 45 15.692 -15.054 7.526 380 HB2 ASN 45 HB2 ASN 45 15.862 -13.966 5.253 381 HB3 ASN 45 HB1 ASN 45 14.596 -12.877 5.778 382 HD21 ASN 45 HD21 ASN 45 16.062 -11.161 5.466 383 HD22 ASN 45 HD22 ASN 45 17.273 -10.807 6.649 384 H ASN 46 HN ASN 46 12.357 -14.308 7.013 385 HA ASN 46 HA ASN 46 10.709 -13.600 8.385 386 HB2 ASN 46 HB2 ASN 46 11.860 -15.190 9.973 387 HB3 ASN 46 HB1 ASN 46 12.686 -13.797 10.650 388 HD21 ASN 46 HD21 ASN 46 11.757 -14.108 12.665 389 HD22 ASN 46 HD22 ASN 46 10.092 -13.768 12.976 390 H ARG 47 HN ARG 47 13.137 -11.726 7.495 391 HA ARG 47 HA ARG 47 12.707 -9.571 9.375 392 HB2 ARG 47 HB2 ARG 47 14.564 -8.578 8.526 393 HB3 ARG 47 HB1 ARG 47 14.892 -10.203 7.956 394 HG2 ARG 47 HG2 ARG 47 14.022 -9.661 5.775 395 HG3 ARG 47 HG1 ARG 47 13.551 -8.057 6.332 396 HD2 ARG 47 HD2 ARG 47 16.364 -9.124 6.208 397 HD3 ARG 47 HD1 ARG 47 15.623 -8.037 5.038 398 HE ARG 47 HE ARG 47 15.517 -6.993 7.695 399 HH11 ARG 47 HH11 ARG 47 17.577 -7.378 4.896 400 HH12 ARG 47 HH12 ARG 47 18.587 -6.023 5.291 401 HH21 ARG 47 HH21 ARG 47 16.859 -5.220 8.232 402 HH22 ARG 47 HH22 ARG 47 18.175 -4.793 7.185 403 H GLN 48 HN GLN 48 11.779 -7.662 8.916 404 HA GLN 48 HA GLN 48 9.750 -7.637 6.891 405 HB2 GLN 48 HB2 GLN 48 9.462 -6.711 9.198 406 HB3 GLN 48 HB1 GLN 48 10.568 -5.415 8.768 407 HG2 GLN 48 HG2 GLN 48 9.085 -4.577 7.141 408 HG3 GLN 48 HG1 GLN 48 8.057 -6.006 7.245 409 HE21 GLN 48 HE21 GLN 48 6.233 -4.940 7.769 410 HE22 GLN 48 HE22 GLN 48 5.981 -4.123 9.271 411 H VAL 49 HN VAL 49 9.940 -6.710 4.966 412 HA VAL 49 HA VAL 49 12.116 -4.844 4.366 413 HB VAL 49 HB VAL 49 13.019 -7.127 3.985 414 HG11 VAL 49 HG11 VAL 49 10.774 -7.365 1.992 415 HG12 VAL 49 HG12 VAL 49 10.993 -8.314 3.463 416 HG13 VAL 49 HG13 VAL 49 12.131 -8.483 2.127 417 HG21 VAL 49 HG21 VAL 49 12.578 -5.550 1.452 418 HG22 VAL 49 HG22 VAL 49 13.820 -6.779 1.696 419 HG23 VAL 49 HG23 VAL 49 13.861 -5.288 2.635 420 H CYS 50 HN CYS 50 11.774 -3.807 2.210 421 HA CYS 50 HA CYS 50 8.933 -3.841 1.529 422 HB2 CYS 50 HB2 CYS 50 11.041 -1.713 1.124 423 HB3 CYS 50 HB1 CYS 50 9.400 -1.606 0.520 424 H ILE 51 HN ILE 51 8.242 -4.376 -0.412 425 HA ILE 51 HA ILE 51 10.129 -5.584 -2.271 426 HB ILE 51 HB ILE 51 7.193 -5.519 -2.811 427 HG12 ILE 51 HG12 ILE 51 8.464 -7.268 -0.689 428 HG13 ILE 51 HG11 ILE 51 7.262 -6.009 -0.413 429 HG21 ILE 51 HG21 ILE 51 9.115 -6.672 -4.171 430 HG22 ILE 51 HG22 ILE 51 7.562 -7.475 -3.949 431 HG23 ILE 51 HG23 ILE 51 8.937 -7.930 -2.945 432 HD11 ILE 51 HD11 ILE 51 5.668 -7.313 -1.806 433 HD12 ILE 51 HD12 ILE 51 6.182 -8.144 -0.341 434 HD13 ILE 51 HD13 ILE 51 6.868 -8.600 -1.897 435 H ASP 52 HN ASP 52 10.264 -5.064 -4.440 436 HA ASP 52 HA ASP 52 9.887 -2.317 -5.126 437 HB2 ASP 52 HB2 ASP 52 11.801 -3.607 -5.944 438 HB3 ASP 52 HB1 ASP 52 10.721 -4.683 -6.813 439 HA PRO 53 HA PRO 53 5.706 -2.760 -6.550 440 HB2 PRO 53 HB2 PRO 53 5.471 -0.338 -7.721 441 HB3 PRO 53 HB1 PRO 53 5.443 -0.569 -5.972 442 HG2 PRO 53 HG2 PRO 53 7.692 0.311 -7.721 443 HG3 PRO 53 HG1 PRO 53 7.189 0.929 -6.147 444 HD2 PRO 53 HD2 PRO 53 9.263 -0.754 -6.448 445 HD3 PRO 53 HD1 PRO 53 8.232 -0.745 -5.012 446 H LYS 54 HN LYS 54 8.420 -2.363 -8.578 447 HA LYS 54 HA LYS 54 6.844 -2.459 -11.031 448 HB2 LYS 54 HB2 LYS 54 9.838 -2.285 -10.649 449 HB3 LYS 54 HB1 LYS 54 9.004 -2.210 -12.192 450 HG2 LYS 54 HG2 LYS 54 8.178 -0.238 -10.154 451 HG3 LYS 54 HG1 LYS 54 9.792 -0.046 -10.836 452 HD2 LYS 54 HD2 LYS 54 8.409 1.242 -12.226 453 HD3 LYS 54 HD1 LYS 54 8.657 -0.256 -13.116 454 HE2 LYS 54 HE2 LYS 54 6.352 0.398 -13.266 455 HE3 LYS 54 HE1 LYS 54 6.503 -1.072 -12.312 456 HZ1 LYS 54 HZ1 LYS 54 6.201 0.178 -10.313 457 HZ2 LYS 54 HZ2 LYS 54 4.951 0.596 -11.368 458 HZ3 LYS 54 HZ3 LYS 54 6.257 1.647 -11.145 459 H LEU 55 HN LEU 55 8.168 -4.609 -8.843 460 HA LEU 55 HA LEU 55 9.130 -6.699 -10.383 461 HB2 LEU 55 HB2 LEU 55 7.813 -6.397 -7.741 462 HB3 LEU 55 HB1 LEU 55 7.985 -8.025 -8.369 463 HG LEU 55 HG LEU 55 10.313 -6.129 -8.128 464 HD11 LEU 55 HD11 LEU 55 10.861 -7.306 -6.028 465 HD12 LEU 55 HD12 LEU 55 9.282 -8.092 -6.088 466 HD13 LEU 55 HD13 LEU 55 9.391 -6.338 -5.925 467 HD21 LEU 55 HD21 LEU 55 10.106 -9.126 -8.337 468 HD22 LEU 55 HD22 LEU 55 11.605 -8.207 -8.156 469 HD23 LEU 55 HD23 LEU 55 10.620 -8.017 -9.607 470 H LYS 56 HN LYS 56 8.204 -8.356 -11.487 471 HA LYS 56 HA LYS 56 5.804 -7.670 -12.808 472 HB2 LYS 56 HB2 LYS 56 7.397 -10.233 -12.927 473 HB3 LYS 56 HB1 LYS 56 6.130 -9.769 -14.055 474 HG2 LYS 56 HG2 LYS 56 8.719 -8.294 -13.614 475 HG3 LYS 56 HG1 LYS 56 8.343 -9.343 -14.981 476 HD2 LYS 56 HD2 LYS 56 6.569 -7.850 -15.681 477 HD3 LYS 56 HD1 LYS 56 6.825 -6.835 -14.263 478 HE2 LYS 56 HE2 LYS 56 7.852 -5.841 -16.225 479 HE3 LYS 56 HE1 LYS 56 9.079 -6.305 -15.049 480 HZ1 LYS 56 HZ1 LYS 56 9.501 -8.303 -16.353 481 HZ2 LYS 56 HZ2 LYS 56 9.741 -6.910 -17.279 482 HZ3 LYS 56 HZ3 LYS 56 8.338 -7.830 -17.485 483 H TRP 57 HN TRP 57 6.480 -9.809 -10.133 484 HA TRP 57 HA TRP 57 3.800 -10.921 -10.253 485 HB2 TRP 57 HB2 TRP 57 4.395 -12.272 -8.397 486 HB3 TRP 57 HB1 TRP 57 5.801 -12.241 -9.440 487 HD1 TRP 57 HD1 TRP 57 7.991 -11.103 -8.482 488 HE1 TRP 57 HE1 TRP 57 8.715 -10.453 -6.092 489 HE3 TRP 57 HE3 TRP 57 3.437 -11.306 -6.202 490 HZ2 TRP 57 HZ2 TRP 57 7.491 -10.082 -3.573 491 HZ3 TRP 57 HZ3 TRP 57 3.286 -10.779 -3.809 492 HH2 TRP 57 HH2 TRP 57 5.272 -10.186 -2.518 493 H ILE 58 HN ILE 58 5.493 -8.321 -8.815 494 HA ILE 58 HA ILE 58 3.676 -7.785 -6.679 495 HB ILE 58 HB ILE 58 5.933 -6.310 -7.976 496 HG12 ILE 58 HG12 ILE 58 6.382 -8.089 -6.319 497 HG13 ILE 58 HG11 ILE 58 6.937 -6.507 -5.778 498 HG21 ILE 58 HG21 ILE 58 4.015 -5.200 -5.959 499 HG22 ILE 58 HG22 ILE 58 4.386 -4.567 -7.566 500 HG23 ILE 58 HG23 ILE 58 5.609 -4.526 -6.290 501 HD11 ILE 58 HD11 ILE 58 5.104 -6.295 -4.288 502 HD12 ILE 58 HD12 ILE 58 5.813 -7.890 -4.041 503 HD13 ILE 58 HD13 ILE 58 4.324 -7.724 -4.958 504 H GLN 59 HN GLN 59 4.082 -6.588 -9.978 505 HA GLN 59 HA GLN 59 2.187 -4.568 -10.052 506 HB2 GLN 59 HB2 GLN 59 2.971 -6.650 -12.051 507 HB3 GLN 59 HB1 GLN 59 1.844 -5.368 -12.459 508 HG2 GLN 59 HG2 GLN 59 4.615 -4.858 -11.430 509 HG3 GLN 59 HG1 GLN 59 4.247 -5.034 -13.144 510 HE21 GLN 59 HE21 GLN 59 3.989 -3.004 -10.361 511 HE22 GLN 59 HE22 GLN 59 3.362 -1.614 -11.178 512 H GLU 60 HN GLU 60 1.791 -7.991 -9.991 513 HA GLU 60 HA GLU 60 -0.994 -8.010 -10.643 514 HB2 GLU 60 HB2 GLU 60 0.768 -10.111 -9.379 515 HB3 GLU 60 HB1 GLU 60 -0.879 -10.381 -9.925 516 HG2 GLU 60 HG2 GLU 60 1.473 -9.618 -11.635 517 HG3 GLU 60 HG1 GLU 60 0.694 -11.198 -11.564 518 H TYR 61 HN TYR 61 0.910 -7.993 -7.699 519 HA TYR 61 HA TYR 61 -1.346 -8.345 -5.940 520 HB2 TYR 61 HB2 TYR 61 0.904 -9.004 -5.199 521 HB3 TYR 61 HB1 TYR 61 1.476 -7.360 -5.409 522 HD1 TYR 61 HD1 TYR 61 0.056 -9.687 -3.140 523 HD2 TYR 61 HD2 TYR 61 0.409 -5.542 -3.979 524 HE1 TYR 61 HE1 TYR 61 -0.506 -9.168 -0.819 525 HE2 TYR 61 HE2 TYR 61 -0.179 -5.019 -1.650 526 HH TYR 61 HH TYR 61 -0.231 -7.394 0.806 527 H LEU 62 HN LEU 62 0.522 -5.787 -7.320 528 HA LEU 62 HA LEU 62 -0.334 -3.563 -5.956 529 HB2 LEU 62 HB2 LEU 62 1.001 -4.181 -8.371 530 HB3 LEU 62 HB1 LEU 62 -0.182 -2.928 -8.716 531 HG LEU 62 HG LEU 62 0.788 -1.595 -6.827 532 HD11 LEU 62 HD11 LEU 62 2.726 -3.873 -6.877 533 HD12 LEU 62 HD12 LEU 62 1.844 -3.203 -5.500 534 HD13 LEU 62 HD13 LEU 62 3.158 -2.283 -6.238 535 HD21 LEU 62 HD21 LEU 62 1.365 -1.116 -9.143 536 HD22 LEU 62 HD22 LEU 62 2.659 -2.314 -9.077 537 HD23 LEU 62 HD23 LEU 62 2.751 -0.860 -8.082 538 H GLU 63 HN GLU 63 -1.853 -5.275 -8.611 539 HA GLU 63 HA GLU 63 -3.927 -3.622 -9.244 540 HB2 GLU 63 HB2 GLU 63 -3.772 -6.577 -8.985 541 HB3 GLU 63 HB1 GLU 63 -5.198 -5.763 -9.598 542 HG2 GLU 63 HG2 GLU 63 -2.439 -5.511 -10.722 543 HG3 GLU 63 HG1 GLU 63 -3.735 -6.491 -11.354 544 H LYS 64 HN LYS 64 -3.757 -5.930 -6.615 545 HA LYS 64 HA LYS 64 -6.341 -5.378 -5.536 546 HB2 LYS 64 HB2 LYS 64 -3.917 -6.744 -4.377 547 HB3 LYS 64 HB1 LYS 64 -5.477 -6.668 -3.562 548 HG2 LYS 64 HG2 LYS 64 -5.624 -8.728 -4.541 549 HG3 LYS 64 HG1 LYS 64 -6.334 -7.722 -5.803 550 HD2 LYS 64 HD2 LYS 64 -4.144 -7.631 -6.926 551 HD3 LYS 64 HD1 LYS 64 -3.494 -8.717 -5.696 552 HE2 LYS 64 HE2 LYS 64 -5.732 -9.330 -7.623 553 HE3 LYS 64 HE1 LYS 64 -4.087 -9.954 -7.705 554 HZ1 LYS 64 HZ1 LYS 64 -6.042 -10.485 -5.531 555 HZ2 LYS 64 HZ2 LYS 64 -4.456 -11.065 -5.582 556 HZ3 LYS 64 HZ3 LYS 64 -5.578 -11.574 -6.738 557 H ALA 65 HN ALA 65 -3.073 -4.331 -4.904 558 HA ALA 65 HA ALA 65 -3.605 -2.935 -2.498 559 HB1 ALA 65 HB1 ALA 65 -1.388 -3.781 -3.115 560 HB2 ALA 65 HB2 ALA 65 -1.355 -2.053 -2.760 561 HB3 ALA 65 HB3 ALA 65 -1.322 -2.613 -4.433 562 H LEU 66 HN LEU 66 -3.772 -2.145 -5.851 563 HA LEU 66 HA LEU 66 -3.857 0.720 -5.405 564 HB2 LEU 66 HB2 LEU 66 -3.900 -1.054 -7.773 565 HB3 LEU 66 HB1 LEU 66 -4.687 0.505 -7.937 566 HG LEU 66 HG LEU 66 -2.620 1.628 -7.299 567 HD11 LEU 66 HD11 LEU 66 -1.686 -0.066 -5.852 568 HD12 LEU 66 HD12 LEU 66 -0.534 0.329 -7.132 569 HD13 LEU 66 HD13 LEU 66 -1.490 -1.157 -7.222 570 HD21 LEU 66 HD21 LEU 66 -2.269 -0.356 -9.537 571 HD22 LEU 66 HD22 LEU 66 -1.329 1.118 -9.314 572 HD23 LEU 66 HD23 LEU 66 -3.057 1.217 -9.657 573 H ASN 67 HN ASN 67 -6.025 -1.846 -5.449 574 HA ASN 67 HA ASN 67 -8.390 -0.333 -5.964 575 HB2 ASN 67 HB2 ASN 67 -7.835 -3.063 -4.999 576 HB3 ASN 67 HB1 ASN 67 -9.404 -2.380 -4.684 577 HD21 ASN 67 HD21 ASN 67 -7.405 -1.802 -7.499 578 HD22 ASN 67 HD22 ASN 67 -8.480 -2.538 -8.632 579 H LYS 68 HN LYS 68 -6.306 0.014 -3.607 580 HA LYS 68 HA LYS 68 -6.276 1.000 -1.579 581 HB2 LYS 68 HB2 LYS 68 -9.217 1.590 -1.965 582 HB3 LYS 68 HB1 LYS 68 -8.114 2.396 -0.865 583 HG2 LYS 68 HG2 LYS 68 -8.097 3.948 -2.495 584 HG3 LYS 68 HG1 LYS 68 -6.862 2.892 -3.182 585 HD2 LYS 68 HD2 LYS 68 -8.584 1.774 -4.540 586 HD3 LYS 68 HD1 LYS 68 -9.804 2.850 -3.856 587 HE2 LYS 68 HE2 LYS 68 -9.094 3.587 -6.067 588 HE3 LYS 68 HE1 LYS 68 -8.684 4.775 -4.832 589 HZ1 LYS 68 HZ1 LYS 68 -6.415 3.992 -4.861 590 HZ2 LYS 68 HZ2 LYS 68 -6.880 4.420 -6.427 591 HZ3 LYS 68 HZ3 LYS 68 -6.798 2.787 -5.985 592 H GLY 69 HN GLY 69 -9.638 0.269 -1.056 593 HA2 GLY 69 HA2 GLY 69 -8.850 -1.985 0.677 594 HA3 GLY 69 HA1 GLY 69 -10.017 -0.771 1.190 595 H ARG 70 HN ARG 70 -10.208 -1.437 -2.104 596 HA ARG 70 HA ARG 70 -12.797 -2.669 -1.757 597 HB2 ARG 70 HB2 ARG 70 -12.300 -0.902 -3.472 598 HB3 ARG 70 HB1 ARG 70 -11.321 -2.080 -4.329 599 HG2 ARG 70 HG2 ARG 70 -13.251 -3.462 -4.731 600 HG3 ARG 70 HG1 ARG 70 -14.258 -2.393 -3.752 601 HD2 ARG 70 HD2 ARG 70 -14.607 -1.939 -6.104 602 HD3 ARG 70 HD1 ARG 70 -13.821 -0.567 -5.328 603 HE ARG 70 HE ARG 70 -12.070 -2.472 -6.652 604 HH11 ARG 70 HH11 ARG 70 -13.805 0.568 -6.826 605 HH12 ARG 70 HH12 ARG 70 -12.847 1.186 -8.135 606 HH21 ARG 70 HH21 ARG 70 -10.807 -1.659 -8.381 607 HH22 ARG 70 HH22 ARG 70 -11.147 -0.084 -9.024 608 H ARG 71 HN ARG 71 -11.027 -4.347 -0.688 609 HA ARG 71 HA ARG 71 -10.744 -6.523 -2.654 610 HB2 ARG 71 HB2 ARG 71 -9.538 -6.394 0.115 611 HB3 ARG 71 HB1 ARG 71 -9.150 -7.536 -1.163 612 HG2 ARG 71 HG2 ARG 71 -8.178 -5.732 -2.490 613 HG3 ARG 71 HG1 ARG 71 -8.576 -4.579 -1.212 614 HD2 ARG 71 HD2 ARG 71 -7.211 -6.105 0.323 615 HD3 ARG 71 HD1 ARG 71 -6.601 -6.839 -1.158 616 HE ARG 71 HE ARG 71 -6.199 -4.152 -1.495 617 HH11 ARG 71 HH11 ARG 71 -5.242 -6.558 0.858 618 HH12 ARG 71 HH12 ARG 71 -3.798 -5.718 1.322 619 HH21 ARG 71 HH21 ARG 71 -4.300 -3.024 -0.862 620 HH22 ARG 71 HH22 ARG 71 -3.262 -3.708 0.349 621 H GLU 72 HN GLU 72 -12.560 -5.343 -0.091 622 HA GLU 72 HA GLU 72 -14.206 -7.701 -0.005 623 HB2 GLU 72 HB2 GLU 72 -12.521 -8.271 1.673 624 HB3 GLU 72 HB1 GLU 72 -12.786 -6.734 2.486 625 HG2 GLU 72 HG2 GLU 72 -13.868 -8.690 3.575 626 HG3 GLU 72 HG1 GLU 72 -14.969 -7.377 3.162 627 H GLU 73 HN GLU 73 -16.228 -7.045 0.045 628 HA GLU 73 HA GLU 73 -16.840 -4.260 0.429 629 HB2 GLU 73 HB2 GLU 73 -17.862 -5.564 -1.383 630 HB3 GLU 73 HB1 GLU 73 -18.617 -6.622 -0.207 631 HG2 GLU 73 HG2 GLU 73 -20.196 -5.018 -1.130 632 HG3 GLU 73 HG1 GLU 73 -19.984 -4.801 0.604 633 H LYS 74 HN LYS 74 -17.181 -7.230 2.244 634 HA LYS 74 HA LYS 74 -18.620 -5.710 4.317 635 HB2 LYS 74 HB2 LYS 74 -18.581 -8.697 3.865 636 HB3 LYS 74 HB1 LYS 74 -19.406 -7.886 5.187 637 HG2 LYS 74 HG2 LYS 74 -20.020 -7.494 2.264 638 HG3 LYS 74 HG1 LYS 74 -20.924 -8.534 3.366 639 HD2 LYS 74 HD2 LYS 74 -21.434 -6.559 4.759 640 HD3 LYS 74 HD1 LYS 74 -20.591 -5.543 3.590 641 HE2 LYS 74 HE2 LYS 74 -22.981 -7.268 2.964 642 HE3 LYS 74 HE1 LYS 74 -23.052 -5.540 3.298 643 HZ1 LYS 74 HZ1 LYS 74 -23.049 -6.014 0.922 644 HZ2 LYS 74 HZ2 LYS 74 -21.552 -6.787 1.058 645 HZ3 LYS 74 HZ3 LYS 74 -21.681 -5.130 1.372 646 H VAL 75 HN VAL 75 -17.247 -8.782 5.083 647 HA VAL 75 HA VAL 75 -14.902 -7.591 6.349 648 HB VAL 75 HB VAL 75 -15.410 -8.723 8.514 649 HG11 VAL 75 HG11 VAL 75 -15.809 -6.332 8.275 650 HG12 VAL 75 HG12 VAL 75 -17.013 -7.067 9.335 651 HG13 VAL 75 HG13 VAL 75 -17.436 -6.653 7.673 652 HG21 VAL 75 HG21 VAL 75 -17.708 -9.407 8.995 653 HG22 VAL 75 HG22 VAL 75 -17.002 -10.372 7.701 654 HG23 VAL 75 HG23 VAL 75 -18.153 -9.091 7.319 655 H GLY 76 HN GLY 76 -13.731 -9.497 7.603 656 HA2 GLY 76 HA2 GLY 76 -13.876 -11.900 5.888 657 HA3 GLY 76 HA1 GLY 76 -12.346 -11.196 6.394 658 H LYS 77 HN LYS 77 -13.399 -13.897 6.854 659 HA LYS 77 HA LYS 77 -14.097 -13.985 9.665 660 HB2 LYS 77 HB2 LYS 77 -13.530 -16.213 7.705 661 HB3 LYS 77 HB1 LYS 77 -14.117 -16.438 9.346 662 HG2 LYS 77 HG2 LYS 77 -16.131 -15.108 8.737 663 HG3 LYS 77 HG1 LYS 77 -15.555 -15.101 7.068 664 HD2 LYS 77 HD2 LYS 77 -16.174 -17.561 8.703 665 HD3 LYS 77 HD1 LYS 77 -17.214 -16.869 7.459 666 HE2 LYS 77 HE2 LYS 77 -15.546 -17.300 5.768 667 HE3 LYS 77 HE1 LYS 77 -14.409 -17.871 6.987 668 HZ1 LYS 77 HZ1 LYS 77 -17.009 -19.150 6.343 669 HZ2 LYS 77 HZ2 LYS 77 -15.879 -19.710 7.468 670 HZ3 LYS 77 HZ3 LYS 77 -15.496 -19.693 5.821 671 H LYS 78 HN LYS 78 -11.703 -12.748 9.388 672 HA LYS 78 HA LYS 78 -10.002 -14.477 10.963 673 HB2 LYS 78 HB2 LYS 78 -9.232 -14.931 8.664 674 HB3 LYS 78 HB1 LYS 78 -9.003 -13.208 8.403 675 HG2 LYS 78 HG2 LYS 78 -7.298 -13.185 10.173 676 HG3 LYS 78 HG1 LYS 78 -7.503 -14.927 10.367 677 HD2 LYS 78 HD2 LYS 78 -6.768 -15.303 8.095 678 HD3 LYS 78 HD1 LYS 78 -6.675 -13.567 7.807 679 HE2 LYS 78 HE2 LYS 78 -4.462 -14.465 8.212 680 HE3 LYS 78 HE1 LYS 78 -4.929 -13.390 9.526 681 HZ1 LYS 78 HZ1 LYS 78 -3.872 -15.455 10.290 682 HZ2 LYS 78 HZ2 LYS 78 -5.140 -16.346 9.619 683 HZ3 LYS 78 HZ3 LYS 78 -5.442 -15.274 10.892 684 H GLU 79 HN GLU 79 -9.396 -13.273 12.655 685 HA GLU 79 HA GLU 79 -9.636 -10.369 12.364 686 HB2 GLU 79 HB2 GLU 79 -9.725 -12.128 14.814 687 HB3 GLU 79 HB1 GLU 79 -9.779 -10.371 14.860 688 HG2 GLU 79 HG2 GLU 79 -11.832 -10.392 13.544 689 HG3 GLU 79 HG1 GLU 79 -11.779 -12.153 13.491 690 H LYS 80 HN LYS 80 -7.343 -11.295 11.298 691 HA LYS 80 HA LYS 80 -5.270 -10.709 13.273 692 HB2 LYS 80 HB2 LYS 80 -4.918 -12.577 11.655 693 HB3 LYS 80 HB1 LYS 80 -4.968 -11.408 10.344 694 HG2 LYS 80 HG2 LYS 80 -2.679 -12.030 10.934 695 HG3 LYS 80 HG1 LYS 80 -2.984 -10.313 11.204 696 HD2 LYS 80 HD2 LYS 80 -3.295 -10.736 13.592 697 HD3 LYS 80 HD1 LYS 80 -3.024 -12.460 13.327 698 HE2 LYS 80 HE2 LYS 80 -1.021 -10.289 12.726 699 HE3 LYS 80 HE1 LYS 80 -1.037 -11.254 14.200 700 HZ1 LYS 80 HZ1 LYS 80 -0.668 -13.228 12.905 701 HZ2 LYS 80 HZ2 LYS 80 0.528 -12.090 12.534 702 HZ3 LYS 80 HZ3 LYS 80 -0.750 -12.356 11.460 703 H ILE 81 HN ILE 81 -6.244 -9.626 10.027 704 HA ILE 81 HA ILE 81 -5.569 -6.890 10.872 705 HB ILE 81 HB ILE 81 -5.321 -6.311 8.474 706 HG12 ILE 81 HG12 ILE 81 -5.433 -9.301 8.010 707 HG13 ILE 81 HG11 ILE 81 -6.705 -8.168 7.567 708 HG21 ILE 81 HG21 ILE 81 -3.125 -7.353 8.161 709 HG22 ILE 81 HG22 ILE 81 -3.500 -8.513 9.434 710 HG23 ILE 81 HG23 ILE 81 -3.357 -6.798 9.820 711 HD11 ILE 81 HD11 ILE 81 -3.899 -8.187 6.476 712 HD12 ILE 81 HD12 ILE 81 -5.177 -7.058 6.024 713 HD13 ILE 81 HD13 ILE 81 -5.342 -8.773 5.650 714 H GLY 82 HN GLY 82 -6.915 -5.362 9.168 715 HA2 GLY 82 HA2 GLY 82 -9.082 -4.981 8.214 716 HA3 GLY 82 HA1 GLY 82 -9.691 -6.342 9.148 717 H LYS 83 HN LYS 83 -8.456 -5.602 11.605 718 HA LYS 83 HA LYS 83 -10.228 -3.491 12.471 719 HB2 LYS 83 HB2 LYS 83 -9.320 -3.924 14.725 720 HB3 LYS 83 HB1 LYS 83 -9.910 -5.393 13.966 721 HG2 LYS 83 HG2 LYS 83 -7.031 -4.765 13.658 722 HG3 LYS 83 HG1 LYS 83 -7.591 -5.271 15.251 723 HD2 LYS 83 HD2 LYS 83 -8.119 -6.808 12.710 724 HD3 LYS 83 HD1 LYS 83 -6.772 -7.133 13.800 725 HE2 LYS 83 HE2 LYS 83 -9.702 -7.266 14.508 726 HE3 LYS 83 HE1 LYS 83 -8.641 -8.643 14.227 727 HZ1 LYS 83 HZ1 LYS 83 -7.306 -7.943 16.125 728 HZ2 LYS 83 HZ2 LYS 83 -8.908 -8.233 16.579 729 HZ3 LYS 83 HZ3 LYS 83 -8.354 -6.648 16.404 730 H LYS 84 HN LYS 84 -9.287 -1.702 13.852 731 HA LYS 84 HA LYS 84 -8.062 0.212 13.947 732 HB2 LYS 84 HB2 LYS 84 -5.781 -1.621 13.172 733 HB3 LYS 84 HB1 LYS 84 -5.608 0.001 13.825 734 HG2 LYS 84 HG2 LYS 84 -6.608 -0.701 15.915 735 HG3 LYS 84 HG1 LYS 84 -6.882 -2.317 15.262 736 HD2 LYS 84 HD2 LYS 84 -4.482 -2.641 15.023 737 HD3 LYS 84 HD1 LYS 84 -4.187 -1.010 15.628 738 HE2 LYS 84 HE2 LYS 84 -5.218 -1.618 17.760 739 HE3 LYS 84 HE1 LYS 84 -5.517 -3.246 17.154 740 HZ1 LYS 84 HZ1 LYS 84 -3.548 -3.174 18.531 741 HZ2 LYS 84 HZ2 LYS 84 -2.851 -1.999 17.537 742 HZ3 LYS 84 HZ3 LYS 84 -3.127 -3.557 16.939 743 H LYS 85 HN LYS 85 -9.366 -0.518 11.481 744 HA LYS 85 HA LYS 85 -7.590 0.245 9.332 745 HB2 LYS 85 HB2 LYS 85 -9.319 -1.485 8.993 746 HB3 LYS 85 HB1 LYS 85 -10.566 -0.292 9.323 747 HG2 LYS 85 HG2 LYS 85 -9.855 0.980 7.346 748 HG3 LYS 85 HG1 LYS 85 -8.639 -0.253 7.008 749 HD2 LYS 85 HD2 LYS 85 -10.572 -0.657 5.627 750 HD3 LYS 85 HD1 LYS 85 -10.458 -1.933 6.839 751 HE2 LYS 85 HE2 LYS 85 -12.135 -0.748 8.205 752 HE3 LYS 85 HE1 LYS 85 -12.272 0.477 6.946 753 HZ1 LYS 85 HZ1 LYS 85 -14.040 -1.120 6.750 754 HZ2 LYS 85 HZ2 LYS 85 -12.944 -2.404 6.680 755 HZ3 LYS 85 HZ3 LYS 85 -13.008 -1.277 5.419 756 H ARG 86 HN ARG 86 -7.073 2.320 9.170 757 HA ARG 86 HA ARG 86 -8.560 4.490 10.103 758 HB2 ARG 86 HB2 ARG 86 -7.082 5.912 8.863 759 HB3 ARG 86 HB1 ARG 86 -6.134 4.569 9.476 760 HG2 ARG 86 HG2 ARG 86 -7.210 4.684 6.668 761 HG3 ARG 86 HG1 ARG 86 -5.622 5.294 7.128 762 HD2 ARG 86 HD2 ARG 86 -4.956 3.090 7.866 763 HD3 ARG 86 HD1 ARG 86 -6.566 2.460 7.529 764 HE ARG 86 HE ARG 86 -5.653 3.528 5.154 765 HH11 ARG 86 HH11 ARG 86 -4.643 1.034 7.388 766 HH12 ARG 86 HH12 ARG 86 -3.906 0.053 6.165 767 HH21 ARG 86 HH21 ARG 86 -4.669 2.237 3.525 768 HH22 ARG 86 HH22 ARG 86 -3.920 0.732 3.971 769 H GLN 87 HN GLN 87 -10.252 5.591 9.323 770 HA GLN 87 HA GLN 87 -11.416 4.686 6.805 771 HB2 GLN 87 HB2 GLN 87 -12.790 4.899 8.908 772 HB3 GLN 87 HB1 GLN 87 -12.566 6.639 8.805 773 HG2 GLN 87 HG2 GLN 87 -13.665 6.616 6.597 774 HG3 GLN 87 HG1 GLN 87 -13.954 4.887 6.790 775 HE21 GLN 87 HE21 GLN 87 -15.443 4.185 8.330 776 HE22 GLN 87 HE22 GLN 87 -16.621 5.249 9.013 777 H LYS 88 HN LYS 88 -9.681 5.688 5.578 778 HA LYS 88 HA LYS 88 -9.899 8.619 5.427 779 HB2 LYS 88 HB2 LYS 88 -7.621 6.793 4.659 780 HB3 LYS 88 HB1 LYS 88 -7.660 8.514 4.304 781 HG2 LYS 88 HG2 LYS 88 -7.760 9.014 6.687 782 HG3 LYS 88 HG1 LYS 88 -7.747 7.289 7.053 783 HD2 LYS 88 HD2 LYS 88 -5.529 8.215 7.344 784 HD3 LYS 88 HD1 LYS 88 -5.543 7.098 5.979 785 HE2 LYS 88 HE2 LYS 88 -5.612 8.930 4.418 786 HE3 LYS 88 HE1 LYS 88 -5.774 10.093 5.733 787 HZ1 LYS 88 HZ1 LYS 88 -3.509 9.996 4.900 788 HZ2 LYS 88 HZ2 LYS 88 -3.420 8.347 5.254 789 HZ3 LYS 88 HZ3 LYS 88 -3.575 9.473 6.504 790 H LYS 89 HN LYS 89 -11.709 6.741 4.175 791 HA LYS 89 HA LYS 89 -11.209 6.687 1.381 792 HB2 LYS 89 HB2 LYS 89 -13.872 6.648 2.821 793 HB3 LYS 89 HB1 LYS 89 -13.587 6.169 1.153 794 HG2 LYS 89 HG2 LYS 89 -12.046 4.390 2.032 795 HG3 LYS 89 HG1 LYS 89 -12.622 4.797 3.648 796 HD2 LYS 89 HD2 LYS 89 -13.899 2.936 2.904 797 HD3 LYS 89 HD1 LYS 89 -14.952 4.347 2.818 798 HE2 LYS 89 HE2 LYS 89 -15.192 2.943 0.835 799 HE3 LYS 89 HE1 LYS 89 -14.537 4.526 0.421 800 HZ1 LYS 89 HZ1 LYS 89 -12.334 3.559 0.312 801 HZ2 LYS 89 HZ2 LYS 89 -13.380 2.736 -0.727 802 HZ3 LYS 89 HZ3 LYS 89 -12.943 2.041 0.749 803 H ARG 90 HN ARG 90 -12.325 8.008 -0.233 804 HA ARG 90 HA ARG 90 -12.008 10.764 0.575 805 HB2 ARG 90 HB2 ARG 90 -12.477 9.615 -2.178 806 HB3 ARG 90 HB1 ARG 90 -11.982 11.262 -1.813 807 HG2 ARG 90 HG2 ARG 90 -10.386 8.774 -1.224 808 HG3 ARG 90 HG1 ARG 90 -10.092 9.905 -2.545 809 HD2 ARG 90 HD2 ARG 90 -9.463 11.628 -1.059 810 HD3 ARG 90 HD1 ARG 90 -10.110 10.770 0.333 811 HE ARG 90 HE ARG 90 -8.133 9.146 -0.680 812 HH11 ARG 90 HH11 ARG 90 -8.296 12.446 0.483 813 HH12 ARG 90 HH12 ARG 90 -6.697 12.424 1.159 814 HH21 ARG 90 HH21 ARG 90 -6.031 9.112 0.227 815 HH22 ARG 90 HH22 ARG 90 -5.414 10.524 1.028 816 H LYS 91 HN LYS 91 -13.996 10.451 1.902 817 HA LYS 91 HA LYS 91 -16.312 11.455 0.380 818 HB2 LYS 91 HB2 LYS 91 -16.313 9.578 2.753 819 HB3 LYS 91 HB1 LYS 91 -17.749 10.390 2.149 820 HG2 LYS 91 HG2 LYS 91 -17.562 9.217 0.040 821 HG3 LYS 91 HG1 LYS 91 -16.062 8.453 0.574 822 HD2 LYS 91 HD2 LYS 91 -17.245 7.317 2.361 823 HD3 LYS 91 HD1 LYS 91 -18.743 8.136 1.922 824 HE2 LYS 91 HE2 LYS 91 -17.218 6.268 0.114 825 HE3 LYS 91 HE1 LYS 91 -18.600 5.797 1.101 826 HZ1 LYS 91 HZ1 LYS 91 -19.296 6.261 -1.138 827 HZ2 LYS 91 HZ2 LYS 91 -18.612 7.805 -1.090 828 HZ3 LYS 91 HZ3 LYS 91 -19.939 7.434 -0.104 829 H ALA 92 HN ALA 92 -15.243 13.520 0.903 830 HA ALA 92 HA ALA 92 -15.061 14.208 3.729 831 HB1 ALA 92 HB1 ALA 92 -13.915 16.229 2.944 832 HB2 ALA 92 HB2 ALA 92 -14.211 15.736 1.278 833 HB3 ALA 92 HB3 ALA 92 -13.174 14.758 2.314 834 H ALA 93 HN ALA 93 -17.664 13.909 2.347 835 HA ALA 93 HA ALA 93 -19.734 14.806 2.558 836 HB1 ALA 93 HB1 ALA 93 -18.395 17.008 4.115 837 HB2 ALA 93 HB2 ALA 93 -19.024 15.505 4.790 838 HB3 ALA 93 HB3 ALA 93 -20.125 16.671 4.056 839 H GLN 94 HN GLN 94 -20.835 15.657 0.967 840 HA GLN 94 HA GLN 94 -21.412 16.876 -0.857 841 HB2 GLN 94 HB2 GLN 94 -19.997 19.143 0.560 842 HB3 GLN 94 HB1 GLN 94 -21.220 19.290 -0.694 843 HG2 GLN 94 HG2 GLN 94 -21.633 18.158 2.065 844 HG3 GLN 94 HG1 GLN 94 -22.155 19.742 1.498 845 HE21 GLN 94 HE21 GLN 94 -22.966 18.744 -1.116 846 HE22 GLN 94 HE22 GLN 94 -24.448 17.894 -0.863 847 H LYS 95 HN LYS 95 -19.913 15.537 -2.034 848 HA LYS 95 HA LYS 95 -17.188 16.106 -2.336 849 HB2 LYS 95 HB2 LYS 95 -18.999 14.584 -4.217 850 HB3 LYS 95 HB1 LYS 95 -17.244 14.480 -4.157 851 HG2 LYS 95 HG2 LYS 95 -17.347 13.546 -1.922 852 HG3 LYS 95 HG1 LYS 95 -19.099 13.722 -1.907 853 HD2 LYS 95 HD2 LYS 95 -18.595 11.439 -2.389 854 HD3 LYS 95 HD1 LYS 95 -19.194 12.182 -3.870 855 HE2 LYS 95 HE2 LYS 95 -16.929 12.418 -4.702 856 HE3 LYS 95 HE1 LYS 95 -16.284 11.772 -3.192 857 HZ1 LYS 95 HZ1 LYS 95 -16.333 10.079 -4.895 858 HZ2 LYS 95 HZ2 LYS 95 -17.991 10.304 -5.128 859 HZ3 LYS 95 HZ3 LYS 95 -17.423 9.679 -3.664 860 H ARG 96 HN ARG 96 -19.981 17.279 -4.120 861 HA ARG 96 HA ARG 96 -18.133 18.770 -5.867 862 HB2 ARG 96 HB2 ARG 96 -20.978 17.901 -6.366 863 HB3 ARG 96 HB1 ARG 96 -20.110 19.028 -7.397 864 HG2 ARG 96 HG2 ARG 96 -18.415 17.280 -7.815 865 HG3 ARG 96 HG1 ARG 96 -19.392 16.154 -6.869 866 HD2 ARG 96 HD2 ARG 96 -19.794 15.898 -9.271 867 HD3 ARG 96 HD1 ARG 96 -21.243 16.432 -8.422 868 HE ARG 96 HE ARG 96 -19.882 18.692 -9.365 869 HH11 ARG 96 HH11 ARG 96 -21.689 15.963 -10.592 870 HH12 ARG 96 HH12 ARG 96 -22.226 16.793 -12.019 871 HH21 ARG 96 HH21 ARG 96 -20.592 19.799 -11.235 872 HH22 ARG 96 HH22 ARG 96 -21.607 18.976 -12.380 873 H LYS 97 HN LYS 97 -19.785 19.154 -3.167 874 HA LYS 97 HA LYS 97 -20.728 20.835 -1.991 875 HB2 LYS 97 HB2 LYS 97 -19.168 22.526 -3.948 876 HB3 LYS 97 HB1 LYS 97 -19.899 23.122 -2.463 877 HG2 LYS 97 HG2 LYS 97 -18.501 21.445 -1.225 878 HG3 LYS 97 HG1 LYS 97 -17.658 21.145 -2.744 879 HD2 LYS 97 HD2 LYS 97 -16.933 23.434 -2.854 880 HD3 LYS 97 HD1 LYS 97 -17.900 23.848 -1.436 881 HE2 LYS 97 HE2 LYS 97 -15.516 22.007 -1.530 882 HE3 LYS 97 HE1 LYS 97 -15.590 23.603 -0.788 883 HZ1 LYS 97 HZ1 LYS 97 -17.011 21.150 0.085 884 HZ2 LYS 97 HZ2 LYS 97 -17.343 22.685 0.705 885 HZ3 LYS 97 HZ3 LYS 97 -15.814 21.998 0.925 886 H ASN 98 HN ASN 98 -22.610 19.837 -3.386 887 HA ASN 98 HA ASN 98 -23.872 21.658 -5.206 888 HB2 ASN 98 HB2 ASN 98 -24.879 19.154 -3.840 889 HB3 ASN 98 HB1 ASN 98 -25.814 20.073 -5.014 890 HD21 ASN 98 HD21 ASN 98 -25.176 20.069 -7.174 891 HD22 ASN 98 HD22 ASN 98 -24.103 18.863 -7.799
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