NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
634589 | 6bzk | 30390 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 HT1 GLY 1 -4.176 -29.808 -4.581 2 H2 GLY 1 HT2 GLY 1 -2.907 -29.185 -5.523 3 H3 GLY 1 HT3 GLY 1 -4.511 -28.721 -5.838 4 HA2 GLY 1 HA2 GLY 1 -3.621 -28.210 -3.135 5 HA3 GLY 1 HA1 GLY 1 -2.790 -27.278 -4.382 6 H SER 2 HN SER 2 -5.188 -27.494 -6.161 7 HA SER 2 HA SER 2 -6.426 -25.048 -5.475 8 HB2 SER 2 HB2 SER 2 -7.947 -25.518 -7.324 9 HB3 SER 2 HB1 SER 2 -6.299 -25.936 -7.784 10 HG SER 2 HG SER 2 -7.981 -27.539 -8.253 11 H LYS 3 HN LYS 3 -7.058 -28.318 -4.554 12 HA LYS 3 HA LYS 3 -9.794 -28.164 -3.918 13 HB2 LYS 3 HB2 LYS 3 -8.547 -30.284 -3.983 14 HB3 LYS 3 HB1 LYS 3 -7.625 -29.779 -2.567 15 HG2 LYS 3 HG2 LYS 3 -9.575 -29.788 -1.175 16 HG3 LYS 3 HG1 LYS 3 -10.646 -29.939 -2.564 17 HD2 LYS 3 HD2 LYS 3 -10.545 -32.119 -1.612 18 HD3 LYS 3 HD1 LYS 3 -9.494 -32.185 -3.024 19 HE2 LYS 3 HE2 LYS 3 -8.423 -33.254 -1.081 20 HE3 LYS 3 HE1 LYS 3 -7.523 -31.824 -1.567 21 HZ1 LYS 3 HZ1 LYS 3 -8.557 -32.362 0.923 22 HZ2 LYS 3 HZ2 LYS 3 -9.574 -31.162 0.281 23 HZ3 LYS 3 HZ3 LYS 3 -7.901 -30.890 0.394 24 H THR 4 HN THR 4 -6.903 -27.431 -1.987 25 HA THR 4 HA THR 4 -8.465 -26.630 0.312 26 HB THR 4 HB THR 4 -6.247 -25.969 1.230 27 HG1 THR 4 HG1 THR 4 -4.778 -27.149 -0.674 28 HG21 THR 4 HG21 THR 4 -5.998 -28.698 -0.023 29 HG22 THR 4 HG22 THR 4 -7.216 -28.378 1.212 30 HG23 THR 4 HG23 THR 4 -5.505 -28.174 1.586 31 H ILE 5 HN ILE 5 -8.353 -24.478 1.242 32 HA ILE 5 HA ILE 5 -9.111 -22.475 -0.586 33 HB ILE 5 HB ILE 5 -8.299 -22.304 2.324 34 HG12 ILE 5 HG12 ILE 5 -11.033 -22.154 1.023 35 HG13 ILE 5 HG11 ILE 5 -10.342 -23.660 1.629 36 HG21 ILE 5 HG21 ILE 5 -9.469 -20.247 0.433 37 HG22 ILE 5 HG22 ILE 5 -8.026 -20.095 1.431 38 HG23 ILE 5 HG23 ILE 5 -9.617 -20.116 2.185 39 HD11 ILE 5 HD11 ILE 5 -10.687 -21.165 3.314 40 HD12 ILE 5 HD12 ILE 5 -10.202 -22.765 3.875 41 HD13 ILE 5 HD13 ILE 5 -11.841 -22.498 3.282 42 H GLN 6 HN GLN 6 -6.061 -22.891 1.228 43 HA GLN 6 HA GLN 6 -4.030 -21.821 1.041 44 HB2 GLN 6 HB2 GLN 6 -4.882 -22.191 -1.822 45 HB3 GLN 6 HB1 GLN 6 -3.282 -21.597 -1.376 46 HG2 GLN 6 HG2 GLN 6 -2.810 -23.614 -0.140 47 HG3 GLN 6 HG1 GLN 6 -4.469 -24.171 -0.329 48 HE21 GLN 6 HE21 GLN 6 -1.959 -25.513 -1.275 49 HE22 GLN 6 HE22 GLN 6 -2.140 -25.682 -2.954 50 H GLU 7 HN GLU 7 -6.262 -20.058 1.504 51 HA GLU 7 HA GLU 7 -6.870 -17.842 1.399 52 HB2 GLU 7 HB2 GLU 7 -3.879 -17.563 1.042 53 HB3 GLU 7 HB1 GLU 7 -4.977 -16.291 1.575 54 HG2 GLU 7 HG2 GLU 7 -4.602 -18.937 3.006 55 HG3 GLU 7 HG1 GLU 7 -3.811 -17.432 3.471 56 H LYS 8 HN LYS 8 -6.915 -19.230 -1.210 57 HA LYS 8 HA LYS 8 -5.839 -17.552 -3.229 58 HB2 LYS 8 HB2 LYS 8 -8.127 -19.514 -3.247 59 HB3 LYS 8 HB1 LYS 8 -7.636 -18.627 -4.688 60 HG2 LYS 8 HG2 LYS 8 -5.298 -19.520 -4.342 61 HG3 LYS 8 HG1 LYS 8 -5.940 -20.544 -3.066 62 HD2 LYS 8 HD2 LYS 8 -7.030 -20.565 -5.887 63 HD3 LYS 8 HD1 LYS 8 -5.742 -21.642 -5.352 64 HE2 LYS 8 HE2 LYS 8 -7.281 -22.444 -3.519 65 HE3 LYS 8 HE1 LYS 8 -8.570 -21.502 -4.267 66 HZ1 LYS 8 HZ1 LYS 8 -8.835 -23.005 -5.856 67 HZ2 LYS 8 HZ2 LYS 8 -7.882 -24.049 -4.914 68 HZ3 LYS 8 HZ3 LYS 8 -7.170 -23.129 -6.152 69 H GLU 9 HN GLU 9 -8.932 -17.563 -1.525 70 HA GLU 9 HA GLU 9 -10.204 -15.580 -3.092 71 HB2 GLU 9 HB2 GLU 9 -10.602 -16.426 -0.213 72 HB3 GLU 9 HB1 GLU 9 -11.622 -15.234 -1.012 73 HG2 GLU 9 HG2 GLU 9 -11.218 -18.097 -1.944 74 HG3 GLU 9 HG1 GLU 9 -12.632 -17.493 -1.089 75 H GLN 10 HN GLN 10 -8.126 -15.382 -0.236 76 HA GLN 10 HA GLN 10 -8.432 -12.606 0.206 77 HB2 GLN 10 HB2 GLN 10 -7.445 -14.214 1.844 78 HB3 GLN 10 HB1 GLN 10 -6.016 -14.327 0.818 79 HG2 GLN 10 HG2 GLN 10 -5.615 -12.709 2.606 80 HG3 GLN 10 HG1 GLN 10 -5.679 -11.873 1.057 81 HE21 GLN 10 HE21 GLN 10 -6.811 -9.945 1.274 82 HE22 GLN 10 HE22 GLN 10 -8.189 -9.726 2.240 83 H GLU 11 HN GLU 11 -6.152 -14.474 -1.756 84 HA GLU 11 HA GLU 11 -4.467 -12.344 -2.503 85 HB2 GLU 11 HB2 GLU 11 -3.869 -14.712 -2.799 86 HB3 GLU 11 HB1 GLU 11 -5.128 -14.881 -4.019 87 HG2 GLU 11 HG2 GLU 11 -2.950 -14.554 -5.095 88 HG3 GLU 11 HG1 GLU 11 -3.984 -13.168 -5.415 89 H LEU 12 HN LEU 12 -7.366 -13.684 -4.094 90 HA LEU 12 HA LEU 12 -7.426 -11.286 -5.857 91 HB2 LEU 12 HB2 LEU 12 -8.509 -14.056 -6.420 92 HB3 LEU 12 HB1 LEU 12 -8.565 -12.674 -7.512 93 HG LEU 12 HG LEU 12 -6.030 -13.961 -6.451 94 HD11 LEU 12 HD11 LEU 12 -5.763 -14.698 -8.827 95 HD12 LEU 12 HD12 LEU 12 -7.384 -14.089 -9.163 96 HD13 LEU 12 HD13 LEU 12 -7.161 -15.427 -8.036 97 HD21 LEU 12 HD21 LEU 12 -5.414 -11.743 -6.902 98 HD22 LEU 12 HD22 LEU 12 -6.596 -11.569 -8.200 99 HD23 LEU 12 HD23 LEU 12 -5.125 -12.505 -8.463 100 H LYS 13 HN LYS 13 -9.231 -10.089 -5.909 101 HA LYS 13 HA LYS 13 -11.655 -11.092 -4.528 102 HB2 LYS 13 HB2 LYS 13 -10.384 -8.359 -4.247 103 HB3 LYS 13 HB1 LYS 13 -11.997 -8.774 -3.663 104 HG2 LYS 13 HG2 LYS 13 -11.018 -10.567 -2.260 105 HG3 LYS 13 HG1 LYS 13 -9.408 -10.112 -2.819 106 HD2 LYS 13 HD2 LYS 13 -9.691 -7.866 -1.860 107 HD3 LYS 13 HD1 LYS 13 -11.320 -8.285 -1.333 108 HE2 LYS 13 HE2 LYS 13 -9.757 -8.524 0.538 109 HE3 LYS 13 HE1 LYS 13 -10.374 -10.108 0.067 110 HZ1 LYS 13 HZ1 LYS 13 -8.135 -9.629 -1.491 111 HZ2 LYS 13 HZ2 LYS 13 -8.291 -10.747 -0.221 112 HZ3 LYS 13 HZ3 LYS 13 -7.707 -9.182 0.088 113 H ASN 14 HN ASN 14 -13.627 -10.163 -5.236 114 HA ASN 14 HA ASN 14 -13.862 -9.898 -8.023 115 HB2 ASN 14 HB2 ASN 14 -15.741 -9.204 -5.764 116 HB3 ASN 14 HB1 ASN 14 -16.194 -9.065 -7.462 117 HD21 ASN 14 HD21 ASN 14 -17.470 -10.926 -5.645 118 HD22 ASN 14 HD22 ASN 14 -17.100 -12.495 -6.176 119 H LEU 15 HN LEU 15 -13.660 -7.467 -5.458 120 HA LEU 15 HA LEU 15 -14.339 -5.212 -6.978 121 HB2 LEU 15 HB2 LEU 15 -14.156 -5.157 -4.535 122 HB3 LEU 15 HB1 LEU 15 -12.422 -5.439 -4.644 123 HG LEU 15 HG LEU 15 -12.146 -3.301 -5.860 124 HD11 LEU 15 HD11 LEU 15 -14.143 -2.905 -7.027 125 HD12 LEU 15 HD12 LEU 15 -14.270 -1.760 -5.696 126 HD13 LEU 15 HD13 LEU 15 -15.153 -3.285 -5.632 127 HD21 LEU 15 HD21 LEU 15 -11.960 -3.304 -3.418 128 HD22 LEU 15 HD22 LEU 15 -13.705 -3.098 -3.265 129 HD23 LEU 15 HD23 LEU 15 -12.722 -1.807 -3.955 130 H LYS 16 HN LYS 16 -11.161 -6.725 -6.404 131 HA LYS 16 HA LYS 16 -9.811 -4.838 -8.136 132 HB2 LYS 16 HB2 LYS 16 -8.895 -7.396 -6.821 133 HB3 LYS 16 HB1 LYS 16 -7.846 -6.368 -7.795 134 HG2 LYS 16 HG2 LYS 16 -8.494 -4.447 -6.249 135 HG3 LYS 16 HG1 LYS 16 -9.236 -5.651 -5.200 136 HD2 LYS 16 HD2 LYS 16 -6.341 -5.776 -6.085 137 HD3 LYS 16 HD1 LYS 16 -6.860 -5.014 -4.585 138 HE2 LYS 16 HE2 LYS 16 -7.269 -7.927 -5.340 139 HE3 LYS 16 HE1 LYS 16 -6.143 -7.306 -4.140 140 HZ1 LYS 16 HZ1 LYS 16 -8.130 -8.072 -3.064 141 HZ2 LYS 16 HZ2 LYS 16 -9.100 -7.081 -4.047 142 HZ3 LYS 16 HZ3 LYS 16 -8.035 -6.385 -2.921 143 H ASP 17 HN ASP 17 -8.993 -5.220 -10.182 144 HA ASP 17 HA ASP 17 -9.358 -7.770 -11.493 145 HB2 ASP 17 HB2 ASP 17 -11.629 -6.544 -11.546 146 HB3 ASP 17 HB1 ASP 17 -10.859 -5.439 -12.681 147 H ASN 18 HN ASN 18 -8.485 -7.762 -13.690 148 HA ASN 18 HA ASN 18 -6.195 -5.974 -13.888 149 HB2 ASN 18 HB2 ASN 18 -5.468 -7.425 -15.686 150 HB3 ASN 18 HB1 ASN 18 -5.998 -8.417 -14.329 151 HD21 ASN 18 HD21 ASN 18 -6.170 -10.011 -16.321 152 HD22 ASN 18 HD22 ASN 18 -7.678 -10.051 -17.099 153 H VAL 19 HN VAL 19 -9.330 -5.643 -14.705 154 HA VAL 19 HA VAL 19 -9.304 -4.809 -17.398 155 HB VAL 19 HB VAL 19 -11.073 -4.024 -15.072 156 HG11 VAL 19 HG11 VAL 19 -12.642 -3.293 -16.958 157 HG12 VAL 19 HG12 VAL 19 -11.228 -3.324 -18.012 158 HG13 VAL 19 HG13 VAL 19 -11.275 -2.227 -16.632 159 HG21 VAL 19 HG21 VAL 19 -12.591 -5.638 -15.957 160 HG22 VAL 19 HG22 VAL 19 -11.013 -6.424 -15.973 161 HG23 VAL 19 HG23 VAL 19 -11.686 -5.770 -17.465 162 H GLU 20 HN GLU 20 -8.831 -3.008 -14.370 163 HA GLU 20 HA GLU 20 -8.578 -0.445 -15.514 164 HB2 GLU 20 HB2 GLU 20 -8.907 -0.843 -13.096 165 HB3 GLU 20 HB1 GLU 20 -7.282 -1.521 -12.996 166 HG2 GLU 20 HG2 GLU 20 -6.316 0.613 -13.716 167 HG3 GLU 20 HG1 GLU 20 -7.929 1.298 -13.908 168 H LEU 21 HN LEU 21 -6.178 -2.959 -14.810 169 HA LEU 21 HA LEU 21 -3.894 -1.457 -15.551 170 HB2 LEU 21 HB2 LEU 21 -4.412 -4.434 -15.490 171 HB3 LEU 21 HB1 LEU 21 -2.841 -3.744 -15.882 172 HG LEU 21 HG LEU 21 -4.346 -3.147 -13.312 173 HD11 LEU 21 HD11 LEU 21 -3.822 -5.492 -13.292 174 HD12 LEU 21 HD12 LEU 21 -2.613 -4.685 -12.294 175 HD13 LEU 21 HD13 LEU 21 -2.206 -5.195 -13.932 176 HD21 LEU 21 HD21 LEU 21 -1.823 -2.612 -12.683 177 HD22 LEU 21 HD22 LEU 21 -2.789 -1.415 -13.535 178 HD23 LEU 21 HD23 LEU 21 -1.641 -2.413 -14.425 179 H GLU 22 HN GLU 22 -6.090 -3.534 -17.379 180 HA GLU 22 HA GLU 22 -4.650 -3.572 -19.803 181 HB2 GLU 22 HB2 GLU 22 -6.546 -5.082 -19.309 182 HB3 GLU 22 HB1 GLU 22 -7.648 -3.707 -19.387 183 HG2 GLU 22 HG2 GLU 22 -7.035 -3.314 -21.728 184 HG3 GLU 22 HG1 GLU 22 -5.864 -4.629 -21.660 185 H ARG 23 HN ARG 23 -7.109 -1.346 -18.547 186 HA ARG 23 HA ARG 23 -7.370 0.246 -20.863 187 HB2 ARG 23 HB2 ARG 23 -7.797 0.866 -17.935 188 HB3 ARG 23 HB1 ARG 23 -8.193 1.994 -19.233 189 HG2 ARG 23 HG2 ARG 23 -9.699 0.324 -20.238 190 HG3 ARG 23 HG1 ARG 23 -9.298 -0.817 -18.955 191 HD2 ARG 23 HD2 ARG 23 -10.190 0.759 -17.277 192 HD3 ARG 23 HD1 ARG 23 -10.603 1.891 -18.561 193 HE ARG 23 HE ARG 23 -12.023 -0.551 -17.877 194 HH11 ARG 23 HH11 ARG 23 -13.957 -0.887 -19.021 195 HH12 ARG 23 HH12 ARG 23 -14.303 0.066 -20.425 196 HH21 ARG 23 HH21 ARG 23 -11.361 1.892 -20.238 197 HH22 ARG 23 HH22 ARG 23 -12.834 1.640 -21.113 198 H LEU 24 HN LEU 24 -5.168 0.416 -18.099 199 HA LEU 24 HA LEU 24 -3.984 2.898 -18.701 200 HB2 LEU 24 HB2 LEU 24 -3.685 1.777 -16.539 201 HB3 LEU 24 HB1 LEU 24 -2.790 0.478 -17.322 202 HG LEU 24 HG LEU 24 -1.055 2.095 -18.030 203 HD11 LEU 24 HD11 LEU 24 -2.966 4.042 -16.743 204 HD12 LEU 24 HD12 LEU 24 -2.103 4.179 -18.276 205 HD13 LEU 24 HD13 LEU 24 -1.237 4.393 -16.758 206 HD21 LEU 24 HD21 LEU 24 -0.138 2.538 -15.782 207 HD22 LEU 24 HD22 LEU 24 -0.842 0.923 -15.866 208 HD23 LEU 24 HD23 LEU 24 -1.723 2.229 -15.072 209 H LYS 25 HN LYS 25 -3.122 -0.411 -19.664 210 HA LYS 25 HA LYS 25 -0.781 0.244 -21.099 211 HB2 LYS 25 HB2 LYS 25 -1.371 -2.057 -20.410 212 HB3 LYS 25 HB1 LYS 25 -2.703 -2.050 -21.565 213 HG2 LYS 25 HG2 LYS 25 -1.121 -1.730 -23.419 214 HG3 LYS 25 HG1 LYS 25 0.223 -1.680 -22.278 215 HD2 LYS 25 HD2 LYS 25 -0.264 -3.977 -21.570 216 HD3 LYS 25 HD1 LYS 25 -1.653 -4.033 -22.656 217 HE2 LYS 25 HE2 LYS 25 0.274 -5.126 -23.708 218 HE3 LYS 25 HE1 LYS 25 -0.135 -3.652 -24.585 219 HZ1 LYS 25 HZ1 LYS 25 2.311 -4.290 -23.558 220 HZ2 LYS 25 HZ2 LYS 25 1.692 -3.167 -22.444 221 HZ3 LYS 25 HZ3 LYS 25 1.820 -2.756 -24.088 222 H ASN 26 HN ASN 26 -0.465 1.091 -23.070 223 HA ASN 26 HA ASN 26 -2.830 1.817 -24.677 224 HB2 ASN 26 HB2 ASN 26 0.042 2.756 -24.871 225 HB3 ASN 26 HB1 ASN 26 -1.317 3.380 -25.805 226 HD21 ASN 26 HD21 ASN 26 -3.305 3.912 -24.116 227 HD22 ASN 26 HD22 ASN 26 -2.821 4.885 -22.811 228 H GLU 27 HN GLU 27 -3.195 1.008 -26.663 229 HA GLU 27 HA GLU 27 -1.090 -0.554 -28.020 230 HB2 GLU 27 HB2 GLU 27 -2.480 -2.147 -26.724 231 HB3 GLU 27 HB1 GLU 27 -3.915 -1.547 -27.556 232 HG2 GLU 27 HG2 GLU 27 -2.990 -2.250 -29.714 233 HG3 GLU 27 HG1 GLU 27 -1.510 -2.789 -28.923 234 H ARG 28 HN ARG 28 -1.032 -0.205 -30.160 235 HA ARG 28 HA ARG 28 -2.683 1.813 -31.320 236 HB2 ARG 28 HB2 ARG 28 -0.690 -0.115 -32.529 237 HB3 ARG 28 HB1 ARG 28 -1.489 1.169 -33.437 238 HG2 ARG 28 HG2 ARG 28 -0.569 2.849 -31.884 239 HG3 ARG 28 HG1 ARG 28 0.229 1.569 -30.970 240 HD2 ARG 28 HD2 ARG 28 1.514 0.939 -32.986 241 HD3 ARG 28 HD1 ARG 28 0.731 2.236 -33.885 242 HE ARG 28 HE ARG 28 2.847 2.523 -31.915 243 HH11 ARG 28 HH11 ARG 28 3.662 4.630 -31.683 244 HH12 ARG 28 HH12 ARG 28 2.800 5.967 -32.370 245 HH21 ARG 28 HH21 ARG 28 0.254 4.001 -33.666 246 HH22 ARG 28 HH22 ARG 28 0.870 5.611 -33.492 247 H HIS 29 HN HIS 29 -4.325 1.649 -32.816 248 HA HIS 29 HA HIS 29 -5.322 -1.050 -33.507 249 HB2 HIS 29 HB2 HIS 29 -7.011 1.226 -32.435 250 HB3 HIS 29 HB1 HIS 29 -7.618 -0.326 -33.013 251 HD2 HIS 29 HD2 HIS 29 -6.395 1.202 -29.740 252 HE1 HIS 29 HE1 HIS 29 -6.119 -2.979 -29.228 253 HE2 HIS 29 HE2 HIS 29 -6.037 -0.741 -28.032 254 H ASP 30 HN ASP 30 -6.429 -1.182 -35.456 255 HA ASP 30 HA ASP 30 -5.867 0.983 -37.337 256 HB2 ASP 30 HB2 ASP 30 -6.484 -0.618 -39.053 257 HB3 ASP 30 HB1 ASP 30 -5.366 -1.379 -37.923 258 H HIS 31 HN HIS 31 -8.223 0.546 -35.193 259 HA HIS 31 HA HIS 31 -10.155 2.064 -36.755 260 HB2 HIS 31 HB2 HIS 31 -12.007 0.535 -36.358 261 HB3 HIS 31 HB1 HIS 31 -10.733 -0.306 -37.241 262 HD2 HIS 31 HD2 HIS 31 -12.629 -0.598 -33.885 263 HE1 HIS 31 HE1 HIS 31 -9.445 -3.365 -33.734 264 HE2 HIS 31 HE2 HIS 31 -11.576 -2.601 -32.583 265 H ASP 32 HN ASP 32 -11.942 2.861 -35.395 266 HA ASP 32 HA ASP 32 -11.166 3.064 -32.533 267 HB2 ASP 32 HB2 ASP 32 -10.927 5.143 -34.039 268 HB3 ASP 32 HB1 ASP 32 -12.688 5.174 -34.062 269 H GLU 33 HN GLU 33 -13.283 1.575 -34.452 270 HA GLU 33 HA GLU 33 -15.832 2.259 -33.459 271 HB2 GLU 33 HB2 GLU 33 -15.415 0.873 -35.489 272 HB3 GLU 33 HB1 GLU 33 -14.901 -0.449 -34.445 273 HG2 GLU 33 HG2 GLU 33 -17.595 0.870 -34.075 274 HG3 GLU 33 HG1 GLU 33 -17.369 -0.421 -35.250 275 H GLU 34 HN GLU 34 -13.408 -0.067 -32.343 276 HA GLU 34 HA GLU 34 -14.953 -1.331 -30.362 277 HB2 GLU 34 HB2 GLU 34 -12.776 -2.181 -31.164 278 HB3 GLU 34 HB1 GLU 34 -11.968 -0.825 -30.378 279 HG2 GLU 34 HG2 GLU 34 -12.790 -1.567 -28.192 280 HG3 GLU 34 HG1 GLU 34 -13.677 -2.887 -28.954 281 H ALA 35 HN ALA 35 -12.911 1.562 -30.244 282 HA ALA 35 HA ALA 35 -13.071 2.034 -27.475 283 HB1 ALA 35 HB1 ALA 35 -12.199 4.178 -27.933 284 HB2 ALA 35 HB2 ALA 35 -12.925 4.224 -29.539 285 HB3 ALA 35 HB3 ALA 35 -11.556 3.159 -29.221 286 H GLU 36 HN GLU 36 -15.188 2.975 -30.141 287 HA GLU 36 HA GLU 36 -16.847 4.745 -28.701 288 HB2 GLU 36 HB2 GLU 36 -17.354 3.059 -31.153 289 HB3 GLU 36 HB1 GLU 36 -18.553 4.173 -30.497 290 HG2 GLU 36 HG2 GLU 36 -17.072 6.057 -30.803 291 HG3 GLU 36 HG1 GLU 36 -15.736 5.003 -31.253 292 H ARG 37 HN ARG 37 -16.998 1.231 -29.153 293 HA ARG 37 HA ARG 37 -19.532 0.852 -27.954 294 HB2 ARG 37 HB2 ARG 37 -17.157 -0.986 -28.264 295 HB3 ARG 37 HB1 ARG 37 -18.671 -1.504 -27.524 296 HG2 ARG 37 HG2 ARG 37 -19.880 -0.805 -29.593 297 HG3 ARG 37 HG1 ARG 37 -18.331 -0.413 -30.336 298 HD2 ARG 37 HD2 ARG 37 -19.018 -3.144 -29.228 299 HD3 ARG 37 HD1 ARG 37 -19.201 -2.702 -30.923 300 HE ARG 37 HE ARG 37 -16.583 -2.070 -30.214 301 HH11 ARG 37 HH11 ARG 37 -14.892 -3.523 -30.650 302 HH12 ARG 37 HH12 ARG 37 -15.237 -5.207 -30.859 303 HH21 ARG 37 HH21 ARG 37 -18.649 -4.841 -30.365 304 HH22 ARG 37 HH22 ARG 37 -17.364 -5.953 -30.697 305 H LYS 38 HN LYS 38 -16.262 0.980 -26.604 306 HA LYS 38 HA LYS 38 -16.926 0.202 -23.972 307 HB2 LYS 38 HB2 LYS 38 -14.696 1.931 -25.054 308 HB3 LYS 38 HB1 LYS 38 -14.818 1.459 -23.359 309 HG2 LYS 38 HG2 LYS 38 -14.802 -0.920 -24.017 310 HG3 LYS 38 HG1 LYS 38 -14.671 -0.449 -25.712 311 HD2 LYS 38 HD2 LYS 38 -12.533 0.682 -25.242 312 HD3 LYS 38 HD1 LYS 38 -12.662 0.228 -23.542 313 HE2 LYS 38 HE2 LYS 38 -12.636 -2.156 -24.171 314 HE3 LYS 38 HE1 LYS 38 -12.516 -1.709 -25.872 315 HZ1 LYS 38 HZ1 LYS 38 -10.419 -0.661 -25.459 316 HZ2 LYS 38 HZ2 LYS 38 -10.357 -2.246 -24.850 317 HZ3 LYS 38 HZ3 LYS 38 -10.549 -0.932 -23.790 318 H ALA 39 HN ALA 39 -16.913 3.346 -25.589 319 HA ALA 39 HA ALA 39 -17.372 4.959 -23.329 320 HB1 ALA 39 HB1 ALA 39 -18.102 5.325 -26.238 321 HB2 ALA 39 HB2 ALA 39 -16.720 6.006 -25.380 322 HB3 ALA 39 HB3 ALA 39 -18.351 6.571 -25.016 323 H LEU 40 HN LEU 40 -19.596 3.244 -25.484 324 HA LEU 40 HA LEU 40 -22.000 4.311 -24.484 325 HB2 LEU 40 HB2 LEU 40 -21.889 3.026 -26.571 326 HB3 LEU 40 HB1 LEU 40 -21.454 1.576 -25.670 327 HG LEU 40 HG LEU 40 -23.626 1.659 -24.484 328 HD11 LEU 40 HD11 LEU 40 -25.344 3.287 -25.636 329 HD12 LEU 40 HD12 LEU 40 -23.904 4.203 -26.080 330 HD13 LEU 40 HD13 LEU 40 -24.277 3.910 -24.381 331 HD21 LEU 40 HD21 LEU 40 -23.491 0.354 -26.535 332 HD22 LEU 40 HD22 LEU 40 -23.778 1.795 -27.511 333 HD23 LEU 40 HD23 LEU 40 -25.059 1.160 -26.478 334 H GLU 41 HN GLU 41 -20.128 1.447 -23.524 335 HA GLU 41 HA GLU 41 -21.906 0.505 -21.549 336 HB2 GLU 41 HB2 GLU 41 -20.035 -0.830 -22.463 337 HB3 GLU 41 HB1 GLU 41 -18.890 0.239 -21.653 338 HG2 GLU 41 HG2 GLU 41 -19.819 -0.374 -19.469 339 HG3 GLU 41 HG1 GLU 41 -21.030 -1.389 -20.250 340 H ASP 42 HN ASP 42 -19.184 2.772 -21.393 341 HA ASP 42 HA ASP 42 -19.157 3.142 -18.602 342 HB2 ASP 42 HB2 ASP 42 -17.358 3.906 -20.126 343 HB3 ASP 42 HB1 ASP 42 -18.442 5.146 -20.755 344 H LYS 43 HN LYS 43 -20.929 4.826 -21.174 345 HA LYS 43 HA LYS 43 -22.102 6.826 -19.579 346 HB2 LYS 43 HB2 LYS 43 -22.113 6.868 -22.047 347 HB3 LYS 43 HB1 LYS 43 -23.216 5.493 -22.062 348 HG2 LYS 43 HG2 LYS 43 -24.905 6.813 -20.850 349 HG3 LYS 43 HG1 LYS 43 -23.798 8.185 -20.789 350 HD2 LYS 43 HD2 LYS 43 -23.768 8.274 -23.253 351 HD3 LYS 43 HD1 LYS 43 -24.870 6.899 -23.317 352 HE2 LYS 43 HE2 LYS 43 -26.572 8.196 -22.095 353 HE3 LYS 43 HE1 LYS 43 -25.472 9.572 -22.017 354 HZ1 LYS 43 HZ1 LYS 43 -26.268 10.187 -23.975 355 HZ2 LYS 43 HZ2 LYS 43 -27.163 8.752 -24.140 356 HZ3 LYS 43 HZ3 LYS 43 -25.548 8.815 -24.665 357 H LEU 44 HN LEU 44 -23.211 3.561 -20.429 358 HA LEU 44 HA LEU 44 -25.711 3.713 -19.106 359 HB2 LEU 44 HB2 LEU 44 -23.955 1.361 -19.827 360 HB3 LEU 44 HB1 LEU 44 -25.547 1.179 -19.101 361 HG LEU 44 HG LEU 44 -25.039 2.705 -21.678 362 HD11 LEU 44 HD11 LEU 44 -26.055 -0.126 -21.294 363 HD12 LEU 44 HD12 LEU 44 -24.459 0.308 -21.907 364 HD13 LEU 44 HD13 LEU 44 -25.901 0.721 -22.833 365 HD21 LEU 44 HD21 LEU 44 -27.607 2.056 -21.847 366 HD22 LEU 44 HD22 LEU 44 -27.116 3.460 -20.910 367 HD23 LEU 44 HD23 LEU 44 -27.489 1.944 -20.092 368 H ALA 45 HN ALA 45 -22.492 2.726 -18.040 369 HA ALA 45 HA ALA 45 -23.207 1.725 -15.506 370 HB1 ALA 45 HB1 ALA 45 -20.880 1.950 -14.936 371 HB2 ALA 45 HB2 ALA 45 -20.630 3.141 -16.214 372 HB3 ALA 45 HB3 ALA 45 -20.971 1.461 -16.628 373 H ASP 46 HN ASP 46 -22.423 4.992 -16.617 374 HA ASP 46 HA ASP 46 -22.350 6.249 -14.096 375 HB2 ASP 46 HB2 ASP 46 -23.024 7.286 -16.851 376 HB3 ASP 46 HB1 ASP 46 -22.926 8.328 -15.433 377 H LYS 47 HN LYS 47 -25.027 5.565 -16.307 378 HA LYS 47 HA LYS 47 -26.947 6.896 -14.564 379 HB2 LYS 47 HB2 LYS 47 -27.216 6.952 -17.026 380 HB3 LYS 47 HB1 LYS 47 -27.389 5.197 -17.034 381 HG2 LYS 47 HG2 LYS 47 -29.383 5.366 -15.607 382 HG3 LYS 47 HG1 LYS 47 -29.199 7.119 -15.540 383 HD2 LYS 47 HD2 LYS 47 -29.468 7.233 -17.997 384 HD3 LYS 47 HD1 LYS 47 -29.684 5.483 -18.047 385 HE2 LYS 47 HE2 LYS 47 -31.448 7.399 -16.494 386 HE3 LYS 47 HE1 LYS 47 -31.858 6.695 -18.058 387 HZ1 LYS 47 HZ1 LYS 47 -32.617 4.927 -16.994 388 HZ2 LYS 47 HZ2 LYS 47 -32.139 5.568 -15.495 389 HZ3 LYS 47 HZ3 LYS 47 -31.061 4.614 -16.398 390 H GLN 48 HN GLN 48 -27.244 5.859 -12.680 391 HA GLN 48 HA GLN 48 -28.515 3.259 -12.728 392 HB2 GLN 48 HB2 GLN 48 -26.924 2.178 -11.202 393 HB3 GLN 48 HB1 GLN 48 -26.143 2.608 -12.723 394 HG2 GLN 48 HG2 GLN 48 -25.263 4.676 -11.663 395 HG3 GLN 48 HG1 GLN 48 -25.997 4.186 -10.138 396 HE21 GLN 48 HE21 GLN 48 -23.071 4.192 -11.672 397 HE22 GLN 48 HE22 GLN 48 -22.371 2.819 -10.959 398 H GLU 49 HN GLU 49 -29.313 2.630 -10.584 399 HA GLU 49 HA GLU 49 -30.526 4.805 -9.244 400 HB2 GLU 49 HB2 GLU 49 -30.240 1.890 -8.511 401 HB3 GLU 49 HB1 GLU 49 -31.137 3.040 -7.521 402 HG2 GLU 49 HG2 GLU 49 -32.658 3.522 -9.337 403 HG3 GLU 49 HG1 GLU 49 -31.694 2.574 -10.466 404 H HIS 50 HN HIS 50 -27.689 2.834 -8.487 405 HA HIS 50 HA HIS 50 -25.992 3.118 -6.966 406 HB2 HIS 50 HB2 HIS 50 -25.912 5.364 -8.120 407 HB3 HIS 50 HB1 HIS 50 -26.912 5.994 -6.812 408 HD2 HIS 50 HD2 HIS 50 -25.379 6.942 -4.731 409 HE1 HIS 50 HE1 HIS 50 -21.918 4.623 -5.412 410 HE2 HIS 50 HE2 HIS 50 -22.940 6.430 -3.950 411 H LEU 51 HN LEU 51 -28.303 2.055 -5.924 412 HA LEU 51 HA LEU 51 -28.767 3.436 -3.353 413 HB2 LEU 51 HB2 LEU 51 -30.759 2.785 -4.644 414 HB3 LEU 51 HB1 LEU 51 -30.213 1.111 -4.657 415 HG LEU 51 HG LEU 51 -30.348 1.056 -2.178 416 HD11 LEU 51 HD11 LEU 51 -30.016 3.245 -1.407 417 HD12 LEU 51 HD12 LEU 51 -31.755 3.065 -1.216 418 HD13 LEU 51 HD13 LEU 51 -31.109 3.943 -2.602 419 HD21 LEU 51 HD21 LEU 51 -32.775 1.016 -2.046 420 HD22 LEU 51 HD22 LEU 51 -32.290 0.431 -3.638 421 HD23 LEU 51 HD23 LEU 51 -32.906 2.074 -3.451 422 H ASP 52 HN ASP 52 -27.572 2.799 -1.677 423 HA ASP 52 HA ASP 52 -26.243 1.518 -0.301 424 HB2 ASP 52 HB2 ASP 52 -28.478 0.349 -0.127 425 HB3 ASP 52 HB1 ASP 52 -27.892 -0.794 -1.335 426 H GLY 53 HN GLY 53 -25.197 2.002 -2.924 427 HA2 GLY 53 HA2 GLY 53 -23.232 1.349 -3.985 428 HA3 GLY 53 HA1 GLY 53 -23.245 -0.138 -3.041 429 H ALA 54 HN ALA 54 -26.282 0.216 -4.308 430 HA ALA 54 HA ALA 54 -27.432 -0.942 -5.928 431 HB1 ALA 54 HB1 ALA 54 -26.533 -0.749 -8.209 432 HB2 ALA 54 HB2 ALA 54 -24.979 -0.231 -7.555 433 HB3 ALA 54 HB3 ALA 54 -26.406 0.784 -7.347 434 H LEU 55 HN LEU 55 -25.541 -2.418 -4.177 435 HA LEU 55 HA LEU 55 -24.179 -4.425 -5.624 436 HB2 LEU 55 HB2 LEU 55 -25.345 -4.403 -2.834 437 HB3 LEU 55 HB1 LEU 55 -24.356 -5.719 -3.462 438 HG LEU 55 HG LEU 55 -23.458 -2.822 -3.370 439 HD11 LEU 55 HD11 LEU 55 -22.164 -3.423 -1.398 440 HD12 LEU 55 HD12 LEU 55 -22.730 -5.091 -1.494 441 HD13 LEU 55 HD13 LEU 55 -23.863 -3.797 -1.103 442 HD21 LEU 55 HD21 LEU 55 -21.169 -4.181 -3.473 443 HD22 LEU 55 HD22 LEU 55 -22.061 -3.831 -4.947 444 HD23 LEU 55 HD23 LEU 55 -22.184 -5.424 -4.203 445 H ARG 56 HN ARG 56 -27.486 -4.211 -4.392 446 HA ARG 56 HA ARG 56 -28.277 -6.861 -4.951 447 HB2 ARG 56 HB2 ARG 56 -29.846 -4.281 -4.809 448 HB3 ARG 56 HB1 ARG 56 -30.596 -5.868 -4.985 449 HG2 ARG 56 HG2 ARG 56 -29.673 -6.617 -2.885 450 HG3 ARG 56 HG1 ARG 56 -28.693 -5.156 -2.740 451 HD2 ARG 56 HD2 ARG 56 -31.716 -5.146 -2.862 452 HD3 ARG 56 HD1 ARG 56 -30.800 -5.122 -1.357 453 HE ARG 56 HE ARG 56 -29.843 -3.034 -2.964 454 HH11 ARG 56 HH11 ARG 56 -30.588 -0.917 -2.615 455 HH12 ARG 56 HH12 ARG 56 -32.096 -0.658 -1.803 456 HH21 ARG 56 HH21 ARG 56 -32.741 -4.037 -1.361 457 HH22 ARG 56 HH22 ARG 56 -33.315 -2.424 -1.093 458 H TYR 57 HN TYR 57 -28.314 -3.912 -6.898 459 HA TYR 57 HA TYR 57 -29.590 -5.174 -9.154 460 HB2 TYR 57 HB2 TYR 57 -29.890 -2.789 -8.797 461 HB3 TYR 57 HB1 TYR 57 -28.149 -2.526 -8.880 462 HD1 TYR 57 HD1 TYR 57 -31.079 -3.740 -10.845 463 HD2 TYR 57 HD2 TYR 57 -27.055 -2.241 -10.968 464 HE1 TYR 57 HE1 TYR 57 -31.230 -3.537 -13.312 465 HE2 TYR 57 HE2 TYR 57 -27.206 -2.037 -13.435 466 HH TYR 57 HH TYR 57 -29.976 -3.281 -15.214 Start of MODEL 2 1 H1 GLY 1 HT1 GLY 1 -33.451 18.284 -46.436 2 H2 GLY 1 HT2 GLY 1 -32.991 18.962 -47.925 3 H3 GLY 1 HT3 GLY 1 -33.456 19.968 -46.636 4 HA2 GLY 1 HA2 GLY 1 -31.504 19.683 -45.493 5 HA3 GLY 1 HA1 GLY 1 -31.178 18.142 -46.288 6 H SER 2 HN SER 2 -29.030 19.391 -46.481 7 HA SER 2 HA SER 2 -28.838 21.490 -48.411 8 HB2 SER 2 HB2 SER 2 -26.453 21.203 -48.212 9 HB3 SER 2 HB1 SER 2 -27.156 21.041 -46.606 10 HG SER 2 HG SER 2 -26.532 19.032 -46.562 11 H LYS 3 HN LYS 3 -27.651 21.309 -50.458 12 HA LYS 3 HA LYS 3 -28.781 19.378 -52.171 13 HB2 LYS 3 HB2 LYS 3 -26.433 21.247 -52.522 14 HB3 LYS 3 HB1 LYS 3 -27.065 20.234 -53.820 15 HG2 LYS 3 HG2 LYS 3 -29.286 21.279 -53.557 16 HG3 LYS 3 HG1 LYS 3 -28.652 22.298 -52.264 17 HD2 LYS 3 HD2 LYS 3 -27.054 23.318 -53.820 18 HD3 LYS 3 HD1 LYS 3 -27.622 22.266 -55.117 19 HE2 LYS 3 HE2 LYS 3 -28.685 24.466 -55.305 20 HE3 LYS 3 HE1 LYS 3 -29.893 23.250 -54.889 21 HZ1 LYS 3 HZ1 LYS 3 -29.960 25.370 -53.568 22 HZ2 LYS 3 HZ2 LYS 3 -28.502 24.881 -52.847 23 HZ3 LYS 3 HZ3 LYS 3 -29.904 23.940 -52.658 24 H THR 4 HN THR 4 -25.619 19.573 -50.593 25 HA THR 4 HA THR 4 -24.636 17.180 -51.884 26 HB THR 4 HB THR 4 -22.698 17.467 -50.388 27 HG1 THR 4 HG1 THR 4 -23.342 19.856 -49.388 28 HG21 THR 4 HG21 THR 4 -23.373 20.213 -51.415 29 HG22 THR 4 HG22 THR 4 -23.152 18.881 -52.550 30 HG23 THR 4 HG23 THR 4 -21.837 19.352 -51.474 31 H ILE 5 HN ILE 5 -23.898 15.302 -50.628 32 HA ILE 5 HA ILE 5 -25.900 14.537 -48.608 33 HB ILE 5 HB ILE 5 -25.158 12.236 -49.120 34 HG12 ILE 5 HG12 ILE 5 -23.461 13.530 -51.272 35 HG13 ILE 5 HG11 ILE 5 -22.806 12.884 -49.770 36 HG21 ILE 5 HG21 ILE 5 -26.956 13.500 -50.430 37 HG22 ILE 5 HG22 ILE 5 -26.251 12.097 -51.233 38 HG23 ILE 5 HG23 ILE 5 -25.737 13.721 -51.684 39 HD11 ILE 5 HD11 ILE 5 -24.276 11.349 -51.925 40 HD12 ILE 5 HD12 ILE 5 -23.877 10.675 -50.344 41 HD13 ILE 5 HD13 ILE 5 -22.589 11.165 -51.446 42 H GLN 6 HN GLN 6 -23.074 16.007 -48.485 43 HA GLN 6 HA GLN 6 -21.427 14.396 -46.844 44 HB2 GLN 6 HB2 GLN 6 -21.626 17.393 -47.171 45 HB3 GLN 6 HB1 GLN 6 -20.425 16.617 -46.139 46 HG2 GLN 6 HG2 GLN 6 -19.593 15.329 -48.078 47 HG3 GLN 6 HG1 GLN 6 -20.776 16.122 -49.114 48 HE21 GLN 6 HE21 GLN 6 -19.462 17.464 -50.405 49 HE22 GLN 6 HE22 GLN 6 -18.386 18.618 -49.779 50 H GLU 7 HN GLU 7 -24.016 16.689 -46.085 51 HA GLU 7 HA GLU 7 -23.644 16.706 -43.280 52 HB2 GLU 7 HB2 GLU 7 -26.077 17.229 -44.992 53 HB3 GLU 7 HB1 GLU 7 -26.090 17.397 -43.237 54 HG2 GLU 7 HG2 GLU 7 -24.361 19.088 -43.321 55 HG3 GLU 7 HG1 GLU 7 -24.127 18.834 -45.048 56 H LYS 8 HN LYS 8 -25.544 14.615 -45.411 57 HA LYS 8 HA LYS 8 -26.867 13.161 -43.374 58 HB2 LYS 8 HB2 LYS 8 -26.152 12.452 -46.218 59 HB3 LYS 8 HB1 LYS 8 -27.081 11.376 -45.175 60 HG2 LYS 8 HG2 LYS 8 -28.700 13.293 -44.800 61 HG3 LYS 8 HG1 LYS 8 -27.845 14.175 -46.062 62 HD2 LYS 8 HD2 LYS 8 -29.021 11.420 -46.497 63 HD3 LYS 8 HD1 LYS 8 -29.913 12.903 -46.824 64 HE2 LYS 8 HE2 LYS 8 -28.040 13.608 -48.354 65 HE3 LYS 8 HE1 LYS 8 -27.324 12.014 -48.127 66 HZ1 LYS 8 HZ1 LYS 8 -30.038 11.700 -48.743 67 HZ2 LYS 8 HZ2 LYS 8 -28.683 11.201 -49.639 68 HZ3 LYS 8 HZ3 LYS 8 -29.351 12.741 -49.892 69 H GLU 9 HN GLU 9 -23.760 12.721 -44.993 70 HA GLU 9 HA GLU 9 -23.133 10.194 -43.879 71 HB2 GLU 9 HB2 GLU 9 -21.391 12.423 -44.940 72 HB3 GLU 9 HB1 GLU 9 -20.738 10.886 -44.372 73 HG2 GLU 9 HG2 GLU 9 -21.997 9.660 -46.032 74 HG3 GLU 9 HG1 GLU 9 -22.872 11.109 -46.516 75 H GLN 10 HN GLN 10 -22.586 13.501 -42.760 76 HA GLN 10 HA GLN 10 -20.961 12.845 -40.533 77 HB2 GLN 10 HB2 GLN 10 -22.766 15.214 -41.075 78 HB3 GLN 10 HB1 GLN 10 -21.743 15.091 -39.647 79 HG2 GLN 10 HG2 GLN 10 -20.734 14.972 -42.510 80 HG3 GLN 10 HG1 GLN 10 -20.664 16.394 -41.475 81 HE21 GLN 10 HE21 GLN 10 -18.616 14.193 -42.626 82 HE22 GLN 10 HE22 GLN 10 -17.605 13.951 -41.286 83 H GLU 11 HN GLU 11 -24.458 13.124 -40.954 84 HA GLU 11 HA GLU 11 -25.185 12.869 -38.239 85 HB2 GLU 11 HB2 GLU 11 -26.642 12.165 -40.791 86 HB3 GLU 11 HB1 GLU 11 -27.382 12.052 -39.194 87 HG2 GLU 11 HG2 GLU 11 -27.034 14.417 -38.801 88 HG3 GLU 11 HG1 GLU 11 -26.108 14.573 -40.293 89 H LEU 12 HN LEU 12 -24.573 10.473 -40.769 90 HA LEU 12 HA LEU 12 -24.498 8.173 -40.704 91 HB2 LEU 12 HB2 LEU 12 -22.466 9.139 -39.298 92 HB3 LEU 12 HB1 LEU 12 -23.314 8.390 -37.948 93 HG LEU 12 HG LEU 12 -23.413 6.287 -39.549 94 HD11 LEU 12 HD11 LEU 12 -20.862 7.544 -40.573 95 HD12 LEU 12 HD12 LEU 12 -22.381 7.717 -41.446 96 HD13 LEU 12 HD13 LEU 12 -21.699 6.115 -41.177 97 HD21 LEU 12 HD21 LEU 12 -20.966 7.266 -38.058 98 HD22 LEU 12 HD22 LEU 12 -21.087 5.635 -38.716 99 HD23 LEU 12 HD23 LEU 12 -22.221 6.171 -37.475 100 H LYS 13 HN LYS 13 -26.835 9.580 -39.352 101 HA LYS 13 HA LYS 13 -27.625 7.679 -37.291 102 HB2 LYS 13 HB2 LYS 13 -28.163 10.060 -37.007 103 HB3 LYS 13 HB1 LYS 13 -29.074 10.047 -38.510 104 HG2 LYS 13 HG2 LYS 13 -30.649 9.887 -36.686 105 HG3 LYS 13 HG1 LYS 13 -30.608 8.320 -37.482 106 HD2 LYS 13 HD2 LYS 13 -29.219 7.391 -35.736 107 HD3 LYS 13 HD1 LYS 13 -28.968 8.982 -35.018 108 HE2 LYS 13 HE2 LYS 13 -31.383 9.125 -34.522 109 HE3 LYS 13 HE1 LYS 13 -31.623 7.533 -35.240 110 HZ1 LYS 13 HZ1 LYS 13 -30.232 6.555 -33.584 111 HZ2 LYS 13 HZ2 LYS 13 -31.401 7.502 -32.793 112 HZ3 LYS 13 HZ3 LYS 13 -29.810 8.072 -32.955 113 H ASN 14 HN ASN 14 -28.755 5.881 -37.688 114 HA ASN 14 HA ASN 14 -29.941 4.261 -38.816 115 HB2 ASN 14 HB2 ASN 14 -31.312 6.701 -39.974 116 HB3 ASN 14 HB1 ASN 14 -31.925 5.051 -40.045 117 HD21 ASN 14 HD21 ASN 14 -32.788 7.669 -38.519 118 HD22 ASN 14 HD22 ASN 14 -33.067 7.100 -36.945 119 H LEU 15 HN LEU 15 -27.443 5.039 -39.993 120 HA LEU 15 HA LEU 15 -27.973 4.983 -42.898 121 HB2 LEU 15 HB2 LEU 15 -26.419 6.710 -42.104 122 HB3 LEU 15 HB1 LEU 15 -25.414 5.476 -41.349 123 HG LEU 15 HG LEU 15 -24.985 4.464 -43.568 124 HD11 LEU 15 HD11 LEU 15 -26.911 6.617 -44.433 125 HD12 LEU 15 HD12 LEU 15 -26.844 4.923 -44.920 126 HD13 LEU 15 HD13 LEU 15 -25.662 6.065 -45.550 127 HD21 LEU 15 HD21 LEU 15 -24.439 7.429 -43.272 128 HD22 LEU 15 HD22 LEU 15 -23.688 6.431 -44.516 129 HD23 LEU 15 HD23 LEU 15 -23.384 6.092 -42.812 130 H LYS 16 HN LYS 16 -27.872 3.100 -43.929 131 HA LYS 16 HA LYS 16 -26.724 0.753 -42.593 132 HB2 LYS 16 HB2 LYS 16 -28.249 0.962 -45.202 133 HB3 LYS 16 HB1 LYS 16 -27.807 -0.528 -44.377 134 HG2 LYS 16 HG2 LYS 16 -29.622 1.615 -43.214 135 HG3 LYS 16 HG1 LYS 16 -30.181 0.133 -43.977 136 HD2 LYS 16 HD2 LYS 16 -28.772 -1.127 -42.255 137 HD3 LYS 16 HD1 LYS 16 -28.604 0.412 -41.411 138 HE2 LYS 16 HE2 LYS 16 -31.254 -0.851 -42.137 139 HE3 LYS 16 HE1 LYS 16 -30.506 -0.931 -40.541 140 HZ1 LYS 16 HZ1 LYS 16 -31.040 1.637 -41.911 141 HZ2 LYS 16 HZ2 LYS 16 -30.691 1.373 -40.269 142 HZ3 LYS 16 HZ3 LYS 16 -32.188 0.893 -40.909 143 H ASP 17 HN ASP 17 -25.653 3.150 -44.619 144 HA ASP 17 HA ASP 17 -23.991 1.494 -46.341 145 HB2 ASP 17 HB2 ASP 17 -24.950 3.654 -47.119 146 HB3 ASP 17 HB1 ASP 17 -23.962 4.491 -45.924 147 H ASN 18 HN ASN 18 -22.961 0.397 -44.467 148 HA ASN 18 HA ASN 18 -20.996 2.001 -42.985 149 HB2 ASN 18 HB2 ASN 18 -21.875 -0.885 -42.791 150 HB3 ASN 18 HB1 ASN 18 -20.556 -0.206 -41.839 151 HD21 ASN 18 HD21 ASN 18 -22.998 -1.216 -40.648 152 HD22 ASN 18 HD22 ASN 18 -23.798 0.098 -39.931 153 H VAL 19 HN VAL 19 -21.116 0.571 -45.943 154 HA VAL 19 HA VAL 19 -18.583 -0.783 -45.976 155 HB VAL 19 HB VAL 19 -18.903 -0.677 -48.475 156 HG11 VAL 19 HG11 VAL 19 -21.368 -1.663 -47.019 157 HG12 VAL 19 HG12 VAL 19 -19.818 -2.503 -46.946 158 HG13 VAL 19 HG13 VAL 19 -20.648 -2.316 -48.490 159 HG21 VAL 19 HG21 VAL 19 -20.916 0.245 -49.377 160 HG22 VAL 19 HG22 VAL 19 -20.252 1.485 -48.314 161 HG23 VAL 19 HG23 VAL 19 -21.602 0.489 -47.771 162 H GLU 20 HN GLU 20 -19.661 2.488 -46.352 163 HA GLU 20 HA GLU 20 -17.515 3.543 -47.844 164 HB2 GLU 20 HB2 GLU 20 -19.640 4.748 -47.364 165 HB3 GLU 20 HB1 GLU 20 -19.130 4.929 -45.688 166 HG2 GLU 20 HG2 GLU 20 -17.372 5.868 -47.961 167 HG3 GLU 20 HG1 GLU 20 -18.657 6.890 -47.327 168 H LEU 21 HN LEU 21 -17.960 3.057 -44.365 169 HA LEU 21 HA LEU 21 -15.571 4.330 -43.532 170 HB2 LEU 21 HB2 LEU 21 -17.250 2.163 -42.256 171 HB3 LEU 21 HB1 LEU 21 -15.850 2.879 -41.464 172 HG LEU 21 HG LEU 21 -18.210 4.494 -42.492 173 HD11 LEU 21 HD11 LEU 21 -17.615 3.385 -39.738 174 HD12 LEU 21 HD12 LEU 21 -19.024 3.047 -40.743 175 HD13 LEU 21 HD13 LEU 21 -18.803 4.651 -40.046 176 HD21 LEU 21 HD21 LEU 21 -16.461 6.030 -42.264 177 HD22 LEU 21 HD22 LEU 21 -15.690 5.127 -40.961 178 HD23 LEU 21 HD23 LEU 21 -17.142 6.072 -40.642 179 H GLU 22 HN GLU 22 -16.304 1.009 -44.489 180 HA GLU 22 HA GLU 22 -13.817 -0.135 -43.797 181 HB2 GLU 22 HB2 GLU 22 -15.848 -0.900 -45.905 182 HB3 GLU 22 HB1 GLU 22 -14.448 -1.888 -45.484 183 HG2 GLU 22 HG2 GLU 22 -16.508 -0.963 -43.465 184 HG3 GLU 22 HG1 GLU 22 -16.573 -2.526 -44.276 185 H ARG 23 HN ARG 23 -14.960 1.472 -46.735 186 HA ARG 23 HA ARG 23 -12.754 0.902 -48.385 187 HB2 ARG 23 HB2 ARG 23 -14.904 1.856 -49.186 188 HB3 ARG 23 HB1 ARG 23 -14.494 3.382 -48.403 189 HG2 ARG 23 HG2 ARG 23 -12.457 3.551 -49.797 190 HG3 ARG 23 HG1 ARG 23 -12.875 2.030 -50.585 191 HD2 ARG 23 HD2 ARG 23 -14.605 4.518 -50.590 192 HD3 ARG 23 HD1 ARG 23 -13.576 4.004 -51.924 193 HE ARG 23 HE ARG 23 -16.121 2.839 -51.147 194 HH11 ARG 23 HH11 ARG 23 -16.901 1.224 -52.541 195 HH12 ARG 23 HH12 ARG 23 -15.847 0.526 -53.725 196 HH21 ARG 23 HH21 ARG 23 -13.113 2.456 -52.817 197 HH22 ARG 23 HH22 ARG 23 -13.703 1.223 -53.881 198 H LEU 24 HN LEU 24 -13.366 3.591 -46.147 199 HA LEU 24 HA LEU 24 -11.044 5.075 -46.721 200 HB2 LEU 24 HB2 LEU 24 -12.925 5.998 -45.444 201 HB3 LEU 24 HB1 LEU 24 -12.604 4.868 -44.132 202 HG LEU 24 HG LEU 24 -10.374 5.886 -43.794 203 HD11 LEU 24 HD11 LEU 24 -11.230 7.500 -46.195 204 HD12 LEU 24 HD12 LEU 24 -9.674 6.734 -45.867 205 HD13 LEU 24 HD13 LEU 24 -10.127 8.205 -45.014 206 HD21 LEU 24 HD21 LEU 24 -12.128 6.794 -42.446 207 HD22 LEU 24 HD22 LEU 24 -12.779 7.723 -43.796 208 HD23 LEU 24 HD23 LEU 24 -11.237 8.180 -43.074 209 H LYS 25 HN LYS 25 -11.667 2.524 -44.329 210 HA LYS 25 HA LYS 25 -9.039 2.597 -43.204 211 HB2 LYS 25 HB2 LYS 25 -11.221 0.500 -43.121 212 HB3 LYS 25 HB1 LYS 25 -9.709 0.398 -42.216 213 HG2 LYS 25 HG2 LYS 25 -10.213 2.393 -40.976 214 HG3 LYS 25 HG1 LYS 25 -11.575 2.772 -42.024 215 HD2 LYS 25 HD2 LYS 25 -12.527 1.857 -40.036 216 HD3 LYS 25 HD1 LYS 25 -12.620 0.576 -41.241 217 HE2 LYS 25 HE2 LYS 25 -11.817 -0.286 -39.071 218 HE3 LYS 25 HE1 LYS 25 -10.581 -0.460 -40.308 219 HZ1 LYS 25 HZ1 LYS 25 -9.442 1.430 -39.495 220 HZ2 LYS 25 HZ2 LYS 25 -9.804 0.470 -38.141 221 HZ3 LYS 25 HZ3 LYS 25 -10.723 1.860 -38.471 222 H ASN 26 HN ASN 26 -7.288 1.257 -43.573 223 HA ASN 26 HA ASN 26 -7.171 0.050 -46.239 224 HB2 ASN 26 HB2 ASN 26 -5.081 0.656 -44.144 225 HB3 ASN 26 HB1 ASN 26 -4.725 -0.197 -45.646 226 HD21 ASN 26 HD21 ASN 26 -3.600 2.395 -45.004 227 HD22 ASN 26 HD22 ASN 26 -4.212 3.511 -46.127 228 H GLU 27 HN GLU 27 -8.122 -0.975 -43.274 229 HA GLU 27 HA GLU 27 -8.504 -3.054 -42.387 230 HB2 GLU 27 HB2 GLU 27 -8.877 -3.504 -44.939 231 HB3 GLU 27 HB1 GLU 27 -7.328 -4.338 -44.844 232 HG2 GLU 27 HG2 GLU 27 -9.034 -5.986 -44.461 233 HG3 GLU 27 HG1 GLU 27 -8.279 -5.667 -42.903 234 H ARG 28 HN ARG 28 -5.705 -1.661 -42.576 235 HA ARG 28 HA ARG 28 -3.741 -3.683 -42.389 236 HB2 ARG 28 HB2 ARG 28 -3.848 -0.874 -41.281 237 HB3 ARG 28 HB1 ARG 28 -2.427 -1.912 -41.148 238 HG2 ARG 28 HG2 ARG 28 -2.241 -2.080 -43.551 239 HG3 ARG 28 HG1 ARG 28 -3.778 -1.247 -43.776 240 HD2 ARG 28 HD2 ARG 28 -1.367 -0.011 -42.423 241 HD3 ARG 28 HD1 ARG 28 -1.769 0.224 -44.123 242 HE ARG 28 HE ARG 28 -4.042 0.885 -42.625 243 HH11 ARG 28 HH11 ARG 28 -4.481 3.062 -42.149 244 HH12 ARG 28 HH12 ARG 28 -3.201 4.226 -42.185 245 HH21 ARG 28 HH21 ARG 28 -0.769 1.918 -43.068 246 HH22 ARG 28 HH22 ARG 28 -1.099 3.579 -42.707 247 H HIS 29 HN HIS 29 -5.816 -2.157 -39.963 248 HA HIS 29 HA HIS 29 -4.595 -3.464 -37.726 249 HB2 HIS 29 HB2 HIS 29 -7.303 -2.145 -38.029 250 HB3 HIS 29 HB1 HIS 29 -6.615 -2.687 -36.499 251 HD2 HIS 29 HD2 HIS 29 -6.539 0.428 -38.709 252 HE1 HIS 29 HE1 HIS 29 -3.211 0.757 -36.133 253 HE2 HIS 29 HE2 HIS 29 -4.661 1.999 -37.808 254 H ASP 30 HN ASP 30 -5.268 -5.270 -36.595 255 HA ASP 30 HA ASP 30 -6.375 -7.401 -38.067 256 HB2 ASP 30 HB2 ASP 30 -4.886 -7.688 -36.108 257 HB3 ASP 30 HB1 ASP 30 -6.183 -7.112 -35.060 258 H HIS 31 HN HIS 31 -7.800 -5.246 -35.629 259 HA HIS 31 HA HIS 31 -10.447 -5.701 -36.733 260 HB2 HIS 31 HB2 HIS 31 -11.440 -6.469 -34.636 261 HB3 HIS 31 HB1 HIS 31 -10.186 -7.594 -35.158 262 HD2 HIS 31 HD2 HIS 31 -11.012 -5.403 -32.102 263 HE1 HIS 31 HE1 HIS 31 -7.019 -6.682 -31.618 264 HE2 HIS 31 HE2 HIS 31 -8.981 -5.554 -30.468 265 H ASP 32 HN ASP 32 -12.075 -4.290 -35.695 266 HA ASP 32 HA ASP 32 -11.119 -1.652 -35.401 267 HB2 ASP 32 HB2 ASP 32 -13.781 -2.928 -34.763 268 HB3 ASP 32 HB1 ASP 32 -13.483 -1.200 -34.585 269 H GLU 33 HN GLU 33 -10.808 -0.353 -33.626 270 HA GLU 33 HA GLU 33 -9.961 -1.596 -31.227 271 HB2 GLU 33 HB2 GLU 33 -9.686 0.693 -30.368 272 HB3 GLU 33 HB1 GLU 33 -8.992 0.516 -31.976 273 HG2 GLU 33 HG2 GLU 33 -11.846 1.456 -31.767 274 HG3 GLU 33 HG1 GLU 33 -10.566 2.593 -31.367 275 H GLU 34 HN GLU 34 -13.038 -0.512 -32.309 276 HA GLU 34 HA GLU 34 -15.106 -0.411 -31.306 277 HB2 GLU 34 HB2 GLU 34 -13.721 -2.460 -29.568 278 HB3 GLU 34 HB1 GLU 34 -15.438 -2.076 -29.437 279 HG2 GLU 34 HG2 GLU 34 -15.830 -2.749 -31.726 280 HG3 GLU 34 HG1 GLU 34 -14.103 -2.938 -32.015 281 H ALA 35 HN ALA 35 -13.102 1.544 -30.478 282 HA ALA 35 HA ALA 35 -13.083 1.965 -27.694 283 HB1 ALA 35 HB1 ALA 35 -12.923 3.988 -29.940 284 HB2 ALA 35 HB2 ALA 35 -11.560 3.138 -29.215 285 HB3 ALA 35 HB3 ALA 35 -12.488 4.292 -28.258 286 H GLU 36 HN GLU 36 -15.342 2.965 -30.218 287 HA GLU 36 HA GLU 36 -16.922 4.711 -28.671 288 HB2 GLU 36 HB2 GLU 36 -17.598 3.005 -31.080 289 HB3 GLU 36 HB1 GLU 36 -18.704 4.185 -30.382 290 HG2 GLU 36 HG2 GLU 36 -17.639 5.407 -32.083 291 HG3 GLU 36 HG1 GLU 36 -16.739 5.873 -30.645 292 H ARG 37 HN ARG 37 -17.076 1.205 -29.154 293 HA ARG 37 HA ARG 37 -19.543 0.740 -27.889 294 HB2 ARG 37 HB2 ARG 37 -18.314 -0.961 -29.212 295 HB3 ARG 37 HB1 ARG 37 -17.111 -1.066 -27.927 296 HG2 ARG 37 HG2 ARG 37 -18.828 -1.797 -26.337 297 HG3 ARG 37 HG1 ARG 37 -20.072 -1.625 -27.576 298 HD2 ARG 37 HD2 ARG 37 -19.443 -3.963 -27.438 299 HD3 ARG 37 HD1 ARG 37 -18.848 -3.311 -28.963 300 HE ARG 37 HE ARG 37 -16.848 -3.073 -26.958 301 HH11 ARG 37 HH11 ARG 37 -15.114 -4.539 -27.009 302 HH12 ARG 37 HH12 ARG 37 -15.265 -6.019 -27.895 303 HH21 ARG 37 HH21 ARG 37 -18.503 -5.369 -28.951 304 HH22 ARG 37 HH22 ARG 37 -17.182 -6.490 -28.994 305 H LYS 38 HN LYS 38 -16.244 0.872 -26.573 306 HA LYS 38 HA LYS 38 -16.899 0.183 -23.918 307 HB2 LYS 38 HB2 LYS 38 -14.637 1.825 -25.070 308 HB3 LYS 38 HB1 LYS 38 -14.744 1.385 -23.364 309 HG2 LYS 38 HG2 LYS 38 -14.809 -1.005 -23.981 310 HG3 LYS 38 HG1 LYS 38 -14.696 -0.566 -25.687 311 HD2 LYS 38 HD2 LYS 38 -12.514 0.485 -25.299 312 HD3 LYS 38 HD1 LYS 38 -12.627 0.117 -23.577 313 HE2 LYS 38 HE2 LYS 38 -11.237 -1.562 -24.697 314 HE3 LYS 38 HE1 LYS 38 -12.730 -2.305 -24.120 315 HZ1 LYS 38 HZ1 LYS 38 -12.343 -1.288 -26.881 316 HZ2 LYS 38 HZ2 LYS 38 -13.656 -2.192 -26.296 317 HZ3 LYS 38 HZ3 LYS 38 -12.120 -2.908 -26.431 318 H ALA 39 HN ALA 39 -16.802 3.292 -25.603 319 HA ALA 39 HA ALA 39 -17.197 4.961 -23.368 320 HB1 ALA 39 HB1 ALA 39 -16.517 5.744 -25.636 321 HB2 ALA 39 HB2 ALA 39 -17.872 6.655 -24.968 322 HB3 ALA 39 HB3 ALA 39 -18.157 5.427 -26.200 323 H LEU 40 HN LEU 40 -19.480 3.287 -25.491 324 HA LEU 40 HA LEU 40 -21.842 4.454 -24.455 325 HB2 LEU 40 HB2 LEU 40 -21.338 1.807 -25.821 326 HB3 LEU 40 HB1 LEU 40 -22.947 2.360 -25.371 327 HG LEU 40 HG LEU 40 -21.054 3.952 -27.135 328 HD11 LEU 40 HD11 LEU 40 -23.259 1.999 -27.828 329 HD12 LEU 40 HD12 LEU 40 -21.570 1.944 -28.334 330 HD13 LEU 40 HD13 LEU 40 -22.639 3.192 -28.972 331 HD21 LEU 40 HD21 LEU 40 -23.445 4.908 -27.783 332 HD22 LEU 40 HD22 LEU 40 -22.621 5.502 -26.348 333 HD23 LEU 40 HD23 LEU 40 -23.899 4.298 -26.192 334 H GLU 41 HN GLU 41 -19.978 1.608 -23.511 335 HA GLU 41 HA GLU 41 -21.808 0.613 -21.595 336 HB2 GLU 41 HB2 GLU 41 -18.818 0.308 -21.877 337 HB3 GLU 41 HB1 GLU 41 -19.746 -0.504 -20.618 338 HG2 GLU 41 HG2 GLU 41 -21.080 -1.675 -22.259 339 HG3 GLU 41 HG1 GLU 41 -20.365 -0.748 -23.576 340 H ASP 42 HN ASP 42 -19.160 2.945 -21.384 341 HA ASP 42 HA ASP 42 -19.126 3.249 -18.586 342 HB2 ASP 42 HB2 ASP 42 -17.367 4.117 -20.097 343 HB3 ASP 42 HB1 ASP 42 -18.501 5.326 -20.697 344 H LYS 43 HN LYS 43 -20.970 4.950 -21.099 345 HA LYS 43 HA LYS 43 -22.220 6.820 -19.384 346 HB2 LYS 43 HB2 LYS 43 -23.015 5.690 -22.070 347 HB3 LYS 43 HB1 LYS 43 -23.960 6.921 -21.231 348 HG2 LYS 43 HG2 LYS 43 -22.128 8.477 -21.269 349 HG3 LYS 43 HG1 LYS 43 -21.004 7.240 -21.821 350 HD2 LYS 43 HD2 LYS 43 -21.572 8.564 -23.742 351 HD3 LYS 43 HD1 LYS 43 -22.421 7.030 -23.915 352 HE2 LYS 43 HE2 LYS 43 -24.497 8.020 -23.158 353 HE3 LYS 43 HE1 LYS 43 -23.680 9.524 -22.734 354 HZ1 LYS 43 HZ1 LYS 43 -23.466 8.518 -25.480 355 HZ2 LYS 43 HZ2 LYS 43 -23.452 10.117 -24.910 356 HZ3 LYS 43 HZ3 LYS 43 -24.915 9.259 -25.002 357 H LEU 44 HN LEU 44 -23.120 3.558 -20.408 358 HA LEU 44 HA LEU 44 -25.705 3.510 -19.297 359 HB2 LEU 44 HB2 LEU 44 -24.912 1.818 -20.887 360 HB3 LEU 44 HB1 LEU 44 -23.742 1.238 -19.706 361 HG LEU 44 HG LEU 44 -25.589 0.611 -18.182 362 HD11 LEU 44 HD11 LEU 44 -27.379 2.060 -18.618 363 HD12 LEU 44 HD12 LEU 44 -27.928 0.578 -19.391 364 HD13 LEU 44 HD13 LEU 44 -27.239 1.876 -20.366 365 HD21 LEU 44 HD21 LEU 44 -26.361 -1.305 -19.451 366 HD22 LEU 44 HD22 LEU 44 -24.698 -0.965 -19.932 367 HD23 LEU 44 HD23 LEU 44 -26.035 -0.481 -20.976 368 H ALA 45 HN ALA 45 -22.550 2.608 -17.944 369 HA ALA 45 HA ALA 45 -23.470 1.657 -15.457 370 HB1 ALA 45 HB1 ALA 45 -21.219 1.176 -16.093 371 HB2 ALA 45 HB2 ALA 45 -21.122 2.236 -14.687 372 HB3 ALA 45 HB3 ALA 45 -20.843 2.886 -16.303 373 H ASP 46 HN ASP 46 -22.591 4.900 -16.563 374 HA ASP 46 HA ASP 46 -22.783 6.142 -14.020 375 HB2 ASP 46 HB2 ASP 46 -22.914 7.216 -16.843 376 HB3 ASP 46 HB1 ASP 46 -23.005 8.261 -15.427 377 H LYS 47 HN LYS 47 -24.540 7.873 -13.503 378 HA LYS 47 HA LYS 47 -26.732 8.323 -13.037 379 HB2 LYS 47 HB2 LYS 47 -27.049 7.440 -15.917 380 HB3 LYS 47 HB1 LYS 47 -28.281 8.279 -14.976 381 HG2 LYS 47 HG2 LYS 47 -26.737 10.176 -14.642 382 HG3 LYS 47 HG1 LYS 47 -25.511 9.343 -15.598 383 HD2 LYS 47 HD2 LYS 47 -27.012 9.349 -17.549 384 HD3 LYS 47 HD1 LYS 47 -28.254 10.162 -16.597 385 HE2 LYS 47 HE2 LYS 47 -27.035 11.806 -17.940 386 HE3 LYS 47 HE1 LYS 47 -26.693 12.062 -16.229 387 HZ1 LYS 47 HZ1 LYS 47 -24.557 11.802 -16.673 388 HZ2 LYS 47 HZ2 LYS 47 -24.892 11.485 -18.308 389 HZ3 LYS 47 HZ3 LYS 47 -24.848 10.212 -17.184 390 H GLN 48 HN GLN 48 -25.840 5.814 -12.177 391 HA GLN 48 HA GLN 48 -28.362 4.272 -12.274 392 HB2 GLN 48 HB2 GLN 48 -26.732 3.210 -13.819 393 HB3 GLN 48 HB1 GLN 48 -25.591 3.062 -12.482 394 HG2 GLN 48 HG2 GLN 48 -27.166 1.649 -11.252 395 HG3 GLN 48 HG1 GLN 48 -28.371 1.851 -12.524 396 HE21 GLN 48 HE21 GLN 48 -27.787 -0.745 -12.102 397 HE22 GLN 48 HE22 GLN 48 -26.725 -1.360 -13.276 398 H GLU 49 HN GLU 49 -29.067 3.731 -10.308 399 HA GLU 49 HA GLU 49 -27.306 3.103 -8.131 400 HB2 GLU 49 HB2 GLU 49 -27.983 4.955 -6.654 401 HB3 GLU 49 HB1 GLU 49 -27.115 5.549 -8.069 402 HG2 GLU 49 HG2 GLU 49 -29.293 6.031 -9.172 403 HG3 GLU 49 HG1 GLU 49 -30.125 5.512 -7.707 404 H HIS 50 HN HIS 50 -29.662 2.065 -9.626 405 HA HIS 50 HA HIS 50 -31.386 1.501 -7.283 406 HB2 HIS 50 HB2 HIS 50 -32.353 2.086 -10.096 407 HB3 HIS 50 HB1 HIS 50 -33.364 1.592 -8.740 408 HD2 HIS 50 HD2 HIS 50 -32.048 4.829 -10.268 409 HE1 HIS 50 HE1 HIS 50 -33.193 5.802 -6.322 410 HE2 HIS 50 HE2 HIS 50 -32.511 6.761 -8.573 411 H LEU 51 HN LEU 51 -32.296 -0.556 -7.240 412 HA LEU 51 HA LEU 51 -30.778 -2.631 -8.425 413 HB2 LEU 51 HB2 LEU 51 -33.463 -2.642 -7.039 414 HB3 LEU 51 HB1 LEU 51 -32.668 -4.111 -7.590 415 HG LEU 51 HG LEU 51 -31.382 -2.110 -5.699 416 HD11 LEU 51 HD11 LEU 51 -31.884 -3.852 -3.953 417 HD12 LEU 51 HD12 LEU 51 -32.905 -4.668 -5.138 418 HD13 LEU 51 HD13 LEU 51 -33.316 -3.041 -4.590 419 HD21 LEU 51 HD21 LEU 51 -29.609 -3.355 -6.580 420 HD22 LEU 51 HD22 LEU 51 -30.597 -4.795 -6.827 421 HD23 LEU 51 HD23 LEU 51 -30.059 -4.360 -5.207 422 H ASP 52 HN ASP 52 -33.887 -1.171 -9.246 423 HA ASP 52 HA ASP 52 -34.650 -2.984 -11.264 424 HB2 ASP 52 HB2 ASP 52 -35.270 -0.059 -10.835 425 HB3 ASP 52 HB1 ASP 52 -35.994 -1.011 -12.129 426 H GLY 53 HN GLY 53 -32.634 -0.080 -11.333 427 HA2 GLY 53 HA2 GLY 53 -32.337 0.151 -14.120 428 HA3 GLY 53 HA1 GLY 53 -31.193 0.753 -12.927 429 H ALA 54 HN ALA 54 -30.555 -1.770 -11.714 430 HA ALA 54 HA ALA 54 -28.469 -2.636 -13.400 431 HB1 ALA 54 HB1 ALA 54 -29.710 -3.921 -10.962 432 HB2 ALA 54 HB2 ALA 54 -28.288 -2.880 -11.007 433 HB3 ALA 54 HB3 ALA 54 -28.229 -4.486 -11.734 434 H LEU 55 HN LEU 55 -31.691 -3.994 -12.771 435 HA LEU 55 HA LEU 55 -31.317 -6.451 -14.086 436 HB2 LEU 55 HB2 LEU 55 -33.795 -4.791 -13.626 437 HB3 LEU 55 HB1 LEU 55 -33.835 -6.413 -14.310 438 HG LEU 55 HG LEU 55 -32.565 -5.735 -11.640 439 HD11 LEU 55 HD11 LEU 55 -34.602 -6.783 -10.662 440 HD12 LEU 55 HD12 LEU 55 -35.309 -6.860 -12.275 441 HD13 LEU 55 HD13 LEU 55 -34.963 -5.295 -11.537 442 HD21 LEU 55 HD21 LEU 55 -33.089 -8.348 -11.448 443 HD22 LEU 55 HD22 LEU 55 -31.619 -7.784 -12.232 444 HD23 LEU 55 HD23 LEU 55 -33.004 -8.270 -13.209 445 H ARG 56 HN ARG 56 -32.489 -3.334 -15.361 446 HA ARG 56 HA ARG 56 -32.927 -4.409 -17.992 447 HB2 ARG 56 HB2 ARG 56 -33.289 -2.060 -18.656 448 HB3 ARG 56 HB1 ARG 56 -34.225 -2.491 -17.224 449 HG2 ARG 56 HG2 ARG 56 -32.564 -1.445 -15.782 450 HG3 ARG 56 HG1 ARG 56 -31.547 -1.070 -17.172 451 HD2 ARG 56 HD2 ARG 56 -34.378 -0.058 -16.797 452 HD3 ARG 56 HD1 ARG 56 -32.933 0.872 -16.416 453 HE ARG 56 HE ARG 56 -32.669 0.018 -19.059 454 HH11 ARG 56 HH11 ARG 56 -33.240 1.403 -20.769 455 HH12 ARG 56 HH12 ARG 56 -34.349 2.703 -20.489 456 HH21 ARG 56 HH21 ARG 56 -34.783 1.963 -17.130 457 HH22 ARG 56 HH22 ARG 56 -35.222 3.020 -18.428 458 H TYR 57 HN TYR 57 -30.176 -3.395 -16.281 459 HA TYR 57 HA TYR 57 -28.474 -2.136 -17.961 460 HB2 TYR 57 HB2 TYR 57 -27.823 -3.000 -15.744 461 HB3 TYR 57 HB1 TYR 57 -27.783 -4.637 -16.402 462 HD1 TYR 57 HD1 TYR 57 -26.247 -1.259 -16.664 463 HD2 TYR 57 HD2 TYR 57 -25.921 -5.422 -17.670 464 HE1 TYR 57 HE1 TYR 57 -23.927 -0.885 -17.459 465 HE2 TYR 57 HE2 TYR 57 -23.602 -5.049 -18.465 466 HH TYR 57 HH TYR 57 -21.745 -2.742 -17.690 Start of MODEL 3 1 H1 GLY 1 HT1 GLY 1 -12.821 17.567 -77.361 2 H2 GLY 1 HT2 GLY 1 -13.145 19.161 -76.875 3 H3 GLY 1 HT3 GLY 1 -11.595 18.737 -77.425 4 HA2 GLY 1 HA2 GLY 1 -13.821 19.632 -78.912 5 HA3 GLY 1 HA1 GLY 1 -12.171 19.335 -79.462 6 H SER 2 HN SER 2 -15.317 18.411 -79.877 7 HA SER 2 HA SER 2 -14.534 16.009 -81.346 8 HB2 SER 2 HB2 SER 2 -15.065 15.133 -79.114 9 HB3 SER 2 HB1 SER 2 -16.624 15.950 -79.154 10 HG SER 2 HG SER 2 -15.963 13.573 -80.149 11 H LYS 3 HN LYS 3 -15.914 15.523 -83.031 12 HA LYS 3 HA LYS 3 -17.445 17.617 -84.121 13 HB2 LYS 3 HB2 LYS 3 -16.441 15.816 -85.476 14 HB3 LYS 3 HB1 LYS 3 -17.562 14.658 -84.761 15 HG2 LYS 3 HG2 LYS 3 -19.470 15.909 -85.687 16 HG3 LYS 3 HG1 LYS 3 -18.366 17.101 -86.373 17 HD2 LYS 3 HD2 LYS 3 -17.322 15.344 -87.752 18 HD3 LYS 3 HD1 LYS 3 -18.421 14.149 -87.063 19 HE2 LYS 3 HE2 LYS 3 -20.349 15.389 -87.966 20 HE3 LYS 3 HE1 LYS 3 -19.257 16.597 -88.648 21 HZ1 LYS 3 HZ1 LYS 3 -18.583 13.892 -89.359 22 HZ2 LYS 3 HZ2 LYS 3 -18.734 15.269 -90.344 23 HZ3 LYS 3 HZ3 LYS 3 -20.111 14.370 -89.919 24 H THR 4 HN THR 4 -18.404 14.678 -82.371 25 HA THR 4 HA THR 4 -21.086 15.857 -81.938 26 HB THR 4 HB THR 4 -21.981 13.580 -82.037 27 HG1 THR 4 HG1 THR 4 -20.711 11.911 -82.163 28 HG21 THR 4 HG21 THR 4 -20.321 14.061 -84.509 29 HG22 THR 4 HG22 THR 4 -21.715 15.062 -84.102 30 HG23 THR 4 HG23 THR 4 -21.927 13.337 -84.405 31 H ILE 5 HN ILE 5 -22.137 15.111 -79.973 32 HA ILE 5 HA ILE 5 -20.355 13.984 -77.904 33 HB ILE 5 HB ILE 5 -20.232 16.476 -77.782 34 HG12 ILE 5 HG12 ILE 5 -21.788 15.347 -75.445 35 HG13 ILE 5 HG11 ILE 5 -20.113 14.897 -75.766 36 HG21 ILE 5 HG21 ILE 5 -23.135 16.374 -76.945 37 HG22 ILE 5 HG22 ILE 5 -22.660 16.717 -78.608 38 HG23 ILE 5 HG23 ILE 5 -22.150 17.791 -77.305 39 HD11 ILE 5 HD11 ILE 5 -19.431 17.249 -75.629 40 HD12 ILE 5 HD12 ILE 5 -20.273 16.779 -74.152 41 HD13 ILE 5 HD13 ILE 5 -21.108 17.736 -75.376 42 H GLN 6 HN GLN 6 -21.350 12.490 -76.748 43 HA GLN 6 HA GLN 6 -24.320 12.365 -76.766 44 HB2 GLN 6 HB2 GLN 6 -22.251 10.161 -76.688 45 HB3 GLN 6 HB1 GLN 6 -23.965 9.900 -76.375 46 HG2 GLN 6 HG2 GLN 6 -24.507 10.822 -78.600 47 HG3 GLN 6 HG1 GLN 6 -22.790 11.072 -78.913 48 HE21 GLN 6 HE21 GLN 6 -22.373 9.506 -80.522 49 HE22 GLN 6 HE22 GLN 6 -22.680 7.849 -80.327 50 H GLU 7 HN GLU 7 -22.669 13.882 -74.937 51 HA GLU 7 HA GLU 7 -22.578 14.386 -72.717 52 HB2 GLU 7 HB2 GLU 7 -24.512 12.084 -72.348 53 HB3 GLU 7 HB1 GLU 7 -24.158 13.356 -71.184 54 HG2 GLU 7 HG2 GLU 7 -24.985 15.051 -72.773 55 HG3 GLU 7 HG1 GLU 7 -25.354 13.780 -73.936 56 H LYS 8 HN LYS 8 -21.007 12.066 -74.062 57 HA LYS 8 HA LYS 8 -20.320 10.247 -71.985 58 HB2 LYS 8 HB2 LYS 8 -18.856 11.125 -74.472 59 HB3 LYS 8 HB1 LYS 8 -18.211 9.909 -73.370 60 HG2 LYS 8 HG2 LYS 8 -20.370 8.625 -73.658 61 HG3 LYS 8 HG1 LYS 8 -20.812 9.769 -74.918 62 HD2 LYS 8 HD2 LYS 8 -18.238 8.182 -74.977 63 HD3 LYS 8 HD1 LYS 8 -19.727 7.616 -75.729 64 HE2 LYS 8 HE2 LYS 8 -19.784 9.764 -77.053 65 HE3 LYS 8 HE1 LYS 8 -18.185 10.135 -76.410 66 HZ1 LYS 8 HZ1 LYS 8 -18.920 8.315 -78.482 67 HZ2 LYS 8 HZ2 LYS 8 -17.958 7.573 -77.294 68 HZ3 LYS 8 HZ3 LYS 8 -17.400 8.962 -78.101 69 H GLU 9 HN GLU 9 -19.057 13.375 -73.010 70 HA GLU 9 HA GLU 9 -16.793 13.429 -71.312 71 HB2 GLU 9 HB2 GLU 9 -18.443 15.638 -72.545 72 HB3 GLU 9 HB1 GLU 9 -17.002 15.949 -71.582 73 HG2 GLU 9 HG2 GLU 9 -15.621 14.689 -73.115 74 HG3 GLU 9 HG1 GLU 9 -17.031 14.138 -74.015 75 H GLN 10 HN GLN 10 -20.152 14.413 -70.837 76 HA GLN 10 HA GLN 10 -19.834 15.675 -68.334 77 HB2 GLN 10 HB2 GLN 10 -21.872 15.849 -69.744 78 HB3 GLN 10 HB1 GLN 10 -22.249 14.168 -69.366 79 HG2 GLN 10 HG2 GLN 10 -22.389 14.704 -66.982 80 HG3 GLN 10 HG1 GLN 10 -21.923 16.372 -67.309 81 HE21 GLN 10 HE21 GLN 10 -24.302 16.214 -66.046 82 HE22 GLN 10 HE22 GLN 10 -25.604 16.429 -67.112 83 H GLU 11 HN GLU 11 -20.428 12.304 -69.226 84 HA GLU 11 HA GLU 11 -20.894 11.287 -66.645 85 HB2 GLU 11 HB2 GLU 11 -21.368 10.029 -68.714 86 HB3 GLU 11 HB1 GLU 11 -19.639 9.906 -69.033 87 HG2 GLU 11 HG2 GLU 11 -20.448 7.841 -67.993 88 HG3 GLU 11 HG1 GLU 11 -19.350 8.667 -66.895 89 H LEU 12 HN LEU 12 -17.885 11.738 -68.475 90 HA LEU 12 HA LEU 12 -16.299 10.773 -66.188 91 HB2 LEU 12 HB2 LEU 12 -15.430 11.637 -68.957 92 HB3 LEU 12 HB1 LEU 12 -14.395 10.917 -67.726 93 HG LEU 12 HG LEU 12 -16.827 9.581 -68.959 94 HD11 LEU 12 HD11 LEU 12 -15.034 8.067 -69.938 95 HD12 LEU 12 HD12 LEU 12 -13.853 9.276 -69.437 96 HD13 LEU 12 HD13 LEU 12 -15.096 9.694 -70.614 97 HD21 LEU 12 HD21 LEU 12 -16.620 8.581 -66.848 98 HD22 LEU 12 HD22 LEU 12 -14.871 8.804 -66.797 99 HD23 LEU 12 HD23 LEU 12 -15.573 7.550 -67.818 100 H LYS 13 HN LYS 13 -14.964 12.050 -64.997 101 HA LYS 13 HA LYS 13 -14.901 14.955 -65.608 102 HB2 LYS 13 HB2 LYS 13 -15.277 13.644 -62.911 103 HB3 LYS 13 HB1 LYS 13 -15.044 15.374 -63.170 104 HG2 LYS 13 HG2 LYS 13 -17.066 15.309 -64.704 105 HG3 LYS 13 HG1 LYS 13 -17.355 13.668 -64.136 106 HD2 LYS 13 HD2 LYS 13 -17.122 16.042 -62.269 107 HD3 LYS 13 HD1 LYS 13 -18.659 15.478 -62.919 108 HE2 LYS 13 HE2 LYS 13 -16.745 13.855 -61.207 109 HE3 LYS 13 HE1 LYS 13 -18.292 14.517 -60.700 110 HZ1 LYS 13 HZ1 LYS 13 -19.015 13.172 -62.878 111 HZ2 LYS 13 HZ2 LYS 13 -19.042 12.514 -61.312 112 HZ3 LYS 13 HZ3 LYS 13 -17.730 12.201 -62.344 113 H ASN 14 HN ASN 14 -13.018 16.045 -65.029 114 HA ASN 14 HA ASN 14 -10.607 14.610 -65.241 115 HB2 ASN 14 HB2 ASN 14 -10.862 17.007 -65.822 116 HB3 ASN 14 HB1 ASN 14 -11.023 17.386 -64.107 117 HD21 ASN 14 HD21 ASN 14 -8.884 18.496 -65.608 118 HD22 ASN 14 HD22 ASN 14 -7.428 17.797 -65.083 119 H LEU 15 HN LEU 15 -12.310 15.932 -62.427 120 HA LEU 15 HA LEU 15 -10.334 14.680 -60.622 121 HB2 LEU 15 HB2 LEU 15 -10.810 17.051 -60.219 122 HB3 LEU 15 HB1 LEU 15 -12.530 16.700 -60.083 123 HG LEU 15 HG LEU 15 -12.085 15.270 -58.110 124 HD11 LEU 15 HD11 LEU 15 -9.231 15.963 -58.798 125 HD12 LEU 15 HD12 LEU 15 -9.920 14.399 -58.360 126 HD13 LEU 15 HD13 LEU 15 -9.673 15.627 -57.123 127 HD21 LEU 15 HD21 LEU 15 -11.342 17.116 -56.582 128 HD22 LEU 15 HD22 LEU 15 -12.592 17.617 -57.723 129 HD23 LEU 15 HD23 LEU 15 -10.908 18.064 -58.004 130 H LYS 16 HN LYS 16 -10.808 12.778 -59.750 131 HA LYS 16 HA LYS 16 -13.650 12.037 -59.316 132 HB2 LYS 16 HB2 LYS 16 -11.421 10.269 -60.343 133 HB3 LYS 16 HB1 LYS 16 -13.038 9.711 -59.911 134 HG2 LYS 16 HG2 LYS 16 -13.959 11.371 -61.583 135 HG3 LYS 16 HG1 LYS 16 -12.305 11.662 -62.111 136 HD2 LYS 16 HD2 LYS 16 -13.555 8.904 -62.067 137 HD3 LYS 16 HD1 LYS 16 -13.598 9.953 -63.482 138 HE2 LYS 16 HE2 LYS 16 -11.082 10.073 -63.378 139 HE3 LYS 16 HE1 LYS 16 -11.131 8.852 -62.106 140 HZ1 LYS 16 HZ1 LYS 16 -10.979 8.278 -64.700 141 HZ2 LYS 16 HZ2 LYS 16 -12.662 8.228 -64.481 142 HZ3 LYS 16 HZ3 LYS 16 -11.650 7.236 -63.543 143 H ASP 17 HN ASP 17 -14.073 10.778 -57.497 144 HA ASP 17 HA ASP 17 -12.108 11.034 -55.358 145 HB2 ASP 17 HB2 ASP 17 -13.909 10.323 -53.897 146 HB3 ASP 17 HB1 ASP 17 -14.512 11.565 -54.992 147 H ASN 18 HN ASN 18 -12.476 8.877 -57.759 148 HA ASN 18 HA ASN 18 -12.519 6.355 -56.509 149 HB2 ASN 18 HB2 ASN 18 -12.766 6.813 -58.977 150 HB3 ASN 18 HB1 ASN 18 -11.022 7.064 -59.037 151 HD21 ASN 18 HD21 ASN 18 -10.542 5.160 -60.291 152 HD22 ASN 18 HD22 ASN 18 -10.778 3.593 -59.685 153 H VAL 19 HN VAL 19 -9.853 8.555 -57.277 154 HA VAL 19 HA VAL 19 -7.730 6.843 -56.567 155 HB VAL 19 HB VAL 19 -7.971 9.860 -56.538 156 HG11 VAL 19 HG11 VAL 19 -5.597 8.052 -56.039 157 HG12 VAL 19 HG12 VAL 19 -6.187 9.371 -55.027 158 HG13 VAL 19 HG13 VAL 19 -5.415 9.721 -56.573 159 HG21 VAL 19 HG21 VAL 19 -6.509 8.008 -58.439 160 HG22 VAL 19 HG22 VAL 19 -6.812 9.733 -58.648 161 HG23 VAL 19 HG23 VAL 19 -8.149 8.587 -58.723 162 H GLU 20 HN GLU 20 -9.587 9.198 -54.660 163 HA GLU 20 HA GLU 20 -8.133 8.882 -52.252 164 HB2 GLU 20 HB2 GLU 20 -10.961 9.797 -52.799 165 HB3 GLU 20 HB1 GLU 20 -10.259 9.776 -51.181 166 HG2 GLU 20 HG2 GLU 20 -8.513 11.311 -51.842 167 HG3 GLU 20 HG1 GLU 20 -9.000 11.221 -53.533 168 H LEU 21 HN LEU 21 -10.948 7.205 -53.578 169 HA LEU 21 HA LEU 21 -11.544 5.656 -51.284 170 HB2 LEU 21 HB2 LEU 21 -12.075 5.188 -54.221 171 HB3 LEU 21 HB1 LEU 21 -12.662 4.110 -52.959 172 HG LEU 21 HG LEU 21 -13.256 7.088 -53.040 173 HD11 LEU 21 HD11 LEU 21 -14.288 6.126 -54.980 174 HD12 LEU 21 HD12 LEU 21 -15.554 6.293 -53.764 175 HD13 LEU 21 HD13 LEU 21 -14.826 4.715 -54.069 176 HD21 LEU 21 HD21 LEU 21 -13.658 6.441 -50.829 177 HD22 LEU 21 HD22 LEU 21 -14.088 4.789 -51.274 178 HD23 LEU 21 HD23 LEU 21 -15.227 6.105 -51.552 179 H GLU 22 HN GLU 22 -9.394 5.128 -54.033 180 HA GLU 22 HA GLU 22 -8.704 2.452 -53.480 181 HB2 GLU 22 HB2 GLU 22 -8.186 3.591 -55.612 182 HB3 GLU 22 HB1 GLU 22 -7.011 4.606 -54.774 183 HG2 GLU 22 HG2 GLU 22 -5.707 2.625 -54.149 184 HG3 GLU 22 HG1 GLU 22 -6.905 1.576 -54.907 185 H ARG 23 HN ARG 23 -7.302 5.520 -52.395 186 HA ARG 23 HA ARG 23 -5.094 4.441 -51.007 187 HB2 ARG 23 HB2 ARG 23 -6.635 7.015 -50.650 188 HB3 ARG 23 HB1 ARG 23 -5.166 6.632 -49.754 189 HG2 ARG 23 HG2 ARG 23 -3.895 6.436 -51.815 190 HG3 ARG 23 HG1 ARG 23 -5.357 6.648 -52.779 191 HD2 ARG 23 HD2 ARG 23 -4.128 8.760 -52.669 192 HD3 ARG 23 HD1 ARG 23 -5.652 8.908 -51.798 193 HE ARG 23 HE ARG 23 -3.552 8.113 -50.038 194 HH11 ARG 23 HH11 ARG 23 -2.762 9.678 -48.594 195 HH12 ARG 23 HH12 ARG 23 -3.068 11.356 -48.891 196 HH21 ARG 23 HH21 ARG 23 -4.854 10.785 -51.809 197 HH22 ARG 23 HH22 ARG 23 -4.253 11.983 -50.711 198 H LEU 24 HN LEU 24 -8.425 5.074 -50.034 199 HA LEU 24 HA LEU 24 -8.148 4.705 -47.272 200 HB2 LEU 24 HB2 LEU 24 -10.162 5.649 -48.298 201 HB3 LEU 24 HB1 LEU 24 -10.520 4.100 -49.054 202 HG LEU 24 HG LEU 24 -10.753 3.060 -46.818 203 HD11 LEU 24 HD11 LEU 24 -9.915 5.819 -45.931 204 HD12 LEU 24 HD12 LEU 24 -9.358 4.247 -45.351 205 HD13 LEU 24 HD13 LEU 24 -10.951 4.840 -44.890 206 HD21 LEU 24 HD21 LEU 24 -12.749 3.976 -47.867 207 HD22 LEU 24 HD22 LEU 24 -12.368 5.589 -47.262 208 HD23 LEU 24 HD23 LEU 24 -12.814 4.308 -46.135 209 H LYS 25 HN LYS 25 -8.790 2.330 -49.846 210 HA LYS 25 HA LYS 25 -8.720 0.033 -49.850 211 HB2 LYS 25 HB2 LYS 25 -6.684 0.785 -47.769 212 HB3 LYS 25 HB1 LYS 25 -7.119 -0.911 -47.933 213 HG2 LYS 25 HG2 LYS 25 -6.398 0.688 -50.381 214 HG3 LYS 25 HG1 LYS 25 -5.125 0.053 -49.346 215 HD2 LYS 25 HD2 LYS 25 -6.109 -2.226 -49.588 216 HD3 LYS 25 HD1 LYS 25 -7.300 -1.569 -50.707 217 HE2 LYS 25 HE2 LYS 25 -5.491 -0.817 -52.205 218 HE3 LYS 25 HE1 LYS 25 -4.293 -1.469 -51.086 219 HZ1 LYS 25 HZ1 LYS 25 -5.719 -3.621 -51.384 220 HZ2 LYS 25 HZ2 LYS 25 -4.524 -3.208 -52.519 221 HZ3 LYS 25 HZ3 LYS 25 -6.159 -2.885 -52.848 222 H ASN 26 HN ASN 26 -9.294 -1.937 -48.559 223 HA ASN 26 HA ASN 26 -11.529 -1.296 -46.792 224 HB2 ASN 26 HB2 ASN 26 -11.786 -2.964 -48.609 225 HB3 ASN 26 HB1 ASN 26 -10.567 -3.972 -47.831 226 HD21 ASN 26 HD21 ASN 26 -13.170 -5.002 -48.175 227 HD22 ASN 26 HD22 ASN 26 -13.931 -5.115 -46.662 228 H GLU 27 HN GLU 27 -10.997 -0.919 -44.725 229 HA GLU 27 HA GLU 27 -8.706 -1.892 -43.406 230 HB2 GLU 27 HB2 GLU 27 -10.017 0.078 -42.658 231 HB3 GLU 27 HB1 GLU 27 -11.326 -1.001 -42.176 232 HG2 GLU 27 HG2 GLU 27 -9.839 -2.133 -40.587 233 HG3 GLU 27 HG1 GLU 27 -8.493 -1.117 -41.099 234 H ARG 28 HN ARG 28 -8.277 -3.751 -42.371 235 HA ARG 28 HA ARG 28 -9.880 -6.035 -42.731 236 HB2 ARG 28 HB2 ARG 28 -8.325 -7.051 -40.999 237 HB3 ARG 28 HB1 ARG 28 -7.538 -6.342 -42.409 238 HG2 ARG 28 HG2 ARG 28 -7.072 -4.289 -41.153 239 HG3 ARG 28 HG1 ARG 28 -7.917 -4.937 -39.748 240 HD2 ARG 28 HD2 ARG 28 -5.515 -6.270 -41.018 241 HD3 ARG 28 HD1 ARG 28 -5.406 -5.167 -39.648 242 HE ARG 28 HE ARG 28 -7.278 -7.120 -38.965 243 HH11 ARG 28 HH11 ARG 28 -6.656 -8.904 -37.706 244 HH12 ARG 28 HH12 ARG 28 -4.992 -9.386 -37.658 245 HH21 ARG 28 HH21 ARG 28 -3.931 -6.877 -39.804 246 HH22 ARG 28 HH22 ARG 28 -3.449 -8.237 -38.845 247 H HIS 29 HN HIS 29 -11.488 -6.919 -41.581 248 HA HIS 29 HA HIS 29 -12.686 -5.419 -39.441 249 HB2 HIS 29 HB2 HIS 29 -14.393 -7.160 -39.458 250 HB3 HIS 29 HB1 HIS 29 -14.023 -6.671 -41.113 251 HD2 HIS 29 HD2 HIS 29 -13.938 -9.860 -38.932 252 HE1 HIS 29 HE1 HIS 29 -11.952 -10.796 -42.538 253 HE2 HIS 29 HE2 HIS 29 -12.921 -11.765 -40.399 254 H ASP 30 HN ASP 30 -10.285 -7.823 -39.607 255 HA ASP 30 HA ASP 30 -10.759 -9.268 -37.233 256 HB2 ASP 30 HB2 ASP 30 -8.219 -8.625 -38.733 257 HB3 ASP 30 HB1 ASP 30 -8.252 -9.667 -37.314 258 H HIS 31 HN HIS 31 -9.063 -6.222 -37.841 259 HA HIS 31 HA HIS 31 -8.526 -5.908 -34.954 260 HB2 HIS 31 HB2 HIS 31 -6.639 -5.513 -36.465 261 HB3 HIS 31 HB1 HIS 31 -7.575 -4.299 -37.337 262 HD2 HIS 31 HD2 HIS 31 -7.336 -1.758 -36.266 263 HE1 HIS 31 HE1 HIS 31 -5.790 -2.852 -32.494 264 HE2 HIS 31 HE2 HIS 31 -6.389 -0.893 -33.993 265 H ASP 32 HN ASP 32 -9.998 -4.865 -33.795 266 HA ASP 32 HA ASP 32 -11.291 -2.459 -34.891 267 HB2 ASP 32 HB2 ASP 32 -12.834 -4.381 -35.283 268 HB3 ASP 32 HB1 ASP 32 -12.838 -4.687 -33.546 269 H GLU 33 HN GLU 33 -10.704 -0.927 -33.508 270 HA GLU 33 HA GLU 33 -9.801 -1.344 -30.878 271 HB2 GLU 33 HB2 GLU 33 -9.253 0.658 -32.215 272 HB3 GLU 33 HB1 GLU 33 -10.933 1.180 -32.113 273 HG2 GLU 33 HG2 GLU 33 -9.595 2.348 -30.429 274 HG3 GLU 33 HG1 GLU 33 -10.735 1.268 -29.633 275 H GLU 34 HN GLU 34 -12.982 -0.442 -32.146 276 HA GLU 34 HA GLU 34 -15.065 -0.381 -31.175 277 HB2 GLU 34 HB2 GLU 34 -13.783 -2.295 -29.207 278 HB3 GLU 34 HB1 GLU 34 -15.512 -2.014 -29.392 279 HG2 GLU 34 HG2 GLU 34 -15.377 -2.766 -31.743 280 HG3 GLU 34 HG1 GLU 34 -13.654 -3.071 -31.537 281 H ALA 35 HN ALA 35 -13.110 1.632 -30.409 282 HA ALA 35 HA ALA 35 -13.093 2.138 -27.637 283 HB1 ALA 35 HB1 ALA 35 -12.727 4.550 -28.387 284 HB2 ALA 35 HB2 ALA 35 -12.859 3.950 -30.041 285 HB3 ALA 35 HB3 ALA 35 -11.570 3.364 -28.990 286 H GLU 36 HN GLU 36 -15.386 3.017 -30.179 287 HA GLU 36 HA GLU 36 -17.004 4.745 -28.633 288 HB2 GLU 36 HB2 GLU 36 -17.600 3.072 -31.075 289 HB3 GLU 36 HB1 GLU 36 -18.786 4.154 -30.345 290 HG2 GLU 36 HG2 GLU 36 -17.364 6.072 -30.710 291 HG3 GLU 36 HG1 GLU 36 -16.031 5.051 -31.240 292 H ARG 37 HN ARG 37 -17.076 1.242 -29.132 293 HA ARG 37 HA ARG 37 -19.530 0.715 -27.865 294 HB2 ARG 37 HB2 ARG 37 -18.236 -0.919 -29.235 295 HB3 ARG 37 HB1 ARG 37 -17.066 -1.048 -27.926 296 HG2 ARG 37 HG2 ARG 37 -19.930 -1.474 -27.161 297 HG3 ARG 37 HG1 ARG 37 -19.212 -2.718 -28.178 298 HD2 ARG 37 HD2 ARG 37 -17.328 -2.907 -26.540 299 HD3 ARG 37 HD1 ARG 37 -18.161 -1.763 -25.496 300 HE ARG 37 HE ARG 37 -19.937 -3.858 -26.126 301 HH11 ARG 37 HH11 ARG 37 -20.284 -5.494 -24.588 302 HH12 ARG 37 HH12 ARG 37 -19.120 -5.756 -23.334 303 HH21 ARG 37 HH21 ARG 37 -17.003 -3.227 -24.403 304 HH22 ARG 37 HH22 ARG 37 -17.262 -4.472 -23.228 305 H LYS 38 HN LYS 38 -16.229 0.910 -26.566 306 HA LYS 38 HA LYS 38 -16.855 0.180 -23.914 307 HB2 LYS 38 HB2 LYS 38 -14.637 1.878 -25.069 308 HB3 LYS 38 HB1 LYS 38 -14.739 1.445 -23.362 309 HG2 LYS 38 HG2 LYS 38 -14.602 -0.905 -23.864 310 HG3 LYS 38 HG1 LYS 38 -14.790 -0.604 -25.590 311 HD2 LYS 38 HD2 LYS 38 -12.454 -1.018 -25.206 312 HD3 LYS 38 HD1 LYS 38 -12.626 0.711 -25.496 313 HE2 LYS 38 HE2 LYS 38 -12.483 1.189 -23.126 314 HE3 LYS 38 HE1 LYS 38 -12.547 -0.529 -22.730 315 HZ1 LYS 38 HZ1 LYS 38 -10.292 0.168 -22.640 316 HZ2 LYS 38 HZ2 LYS 38 -10.388 0.916 -24.162 317 HZ3 LYS 38 HZ3 LYS 38 -10.465 -0.778 -24.037 318 H ALA 39 HN ALA 39 -16.840 3.307 -25.569 319 HA ALA 39 HA ALA 39 -17.273 4.942 -23.316 320 HB1 ALA 39 HB1 ALA 39 -16.604 5.824 -25.517 321 HB2 ALA 39 HB2 ALA 39 -18.062 6.619 -24.923 322 HB3 ALA 39 HB3 ALA 39 -18.179 5.378 -26.171 323 H LEU 40 HN LEU 40 -19.515 3.245 -25.465 324 HA LEU 40 HA LEU 40 -21.907 4.340 -24.465 325 HB2 LEU 40 HB2 LEU 40 -21.807 3.062 -26.557 326 HB3 LEU 40 HB1 LEU 40 -21.395 1.604 -25.660 327 HG LEU 40 HG LEU 40 -23.569 1.711 -24.479 328 HD11 LEU 40 HD11 LEU 40 -23.808 4.264 -26.066 329 HD12 LEU 40 HD12 LEU 40 -24.190 3.970 -24.369 330 HD13 LEU 40 HD13 LEU 40 -25.261 3.367 -25.629 331 HD21 LEU 40 HD21 LEU 40 -23.752 1.883 -27.504 332 HD22 LEU 40 HD22 LEU 40 -24.995 1.202 -26.453 333 HD23 LEU 40 HD23 LEU 40 -23.412 0.429 -26.563 334 H GLU 41 HN GLU 41 -20.073 1.449 -23.511 335 HA GLU 41 HA GLU 41 -21.871 0.518 -21.550 336 HB2 GLU 41 HB2 GLU 41 -20.007 -0.830 -22.456 337 HB3 GLU 41 HB1 GLU 41 -18.857 0.224 -21.635 338 HG2 GLU 41 HG2 GLU 41 -19.806 -0.389 -19.460 339 HG3 GLU 41 HG1 GLU 41 -21.021 -1.390 -20.254 340 H ASP 42 HN ASP 42 -19.127 2.758 -21.358 341 HA ASP 42 HA ASP 42 -19.122 3.109 -18.565 342 HB2 ASP 42 HB2 ASP 42 -17.301 3.865 -20.062 343 HB3 ASP 42 HB1 ASP 42 -18.364 5.116 -20.702 344 H LYS 43 HN LYS 43 -20.843 4.843 -21.140 345 HA LYS 43 HA LYS 43 -22.032 6.803 -19.484 346 HB2 LYS 43 HB2 LYS 43 -22.861 5.660 -22.155 347 HB3 LYS 43 HB1 LYS 43 -23.727 6.975 -21.363 348 HG2 LYS 43 HG2 LYS 43 -21.657 8.320 -21.321 349 HG3 LYS 43 HG1 LYS 43 -20.786 7.013 -22.119 350 HD2 LYS 43 HD2 LYS 43 -22.299 7.179 -24.059 351 HD3 LYS 43 HD1 LYS 43 -23.173 8.488 -23.264 352 HE2 LYS 43 HE2 LYS 43 -21.115 9.847 -23.226 353 HE3 LYS 43 HE1 LYS 43 -20.235 8.537 -24.013 354 HZ1 LYS 43 HZ1 LYS 43 -22.646 9.257 -25.386 355 HZ2 LYS 43 HZ2 LYS 43 -21.067 9.077 -25.988 356 HZ3 LYS 43 HZ3 LYS 43 -21.548 10.545 -25.279 357 H LEU 44 HN LEU 44 -23.059 3.564 -20.453 358 HA LEU 44 HA LEU 44 -25.664 3.677 -19.346 359 HB2 LEU 44 HB2 LEU 44 -23.814 1.354 -19.904 360 HB3 LEU 44 HB1 LEU 44 -25.458 1.146 -19.311 361 HG LEU 44 HG LEU 44 -24.764 2.674 -21.845 362 HD11 LEU 44 HD11 LEU 44 -24.118 0.400 -22.226 363 HD12 LEU 44 HD12 LEU 44 -25.705 0.598 -22.970 364 HD13 LEU 44 HD13 LEU 44 -25.558 -0.214 -21.411 365 HD21 LEU 44 HD21 LEU 44 -27.323 1.877 -20.461 366 HD22 LEU 44 HD22 LEU 44 -27.301 1.975 -22.220 367 HD23 LEU 44 HD23 LEU 44 -26.911 3.394 -21.257 368 H ALA 45 HN ALA 45 -22.532 2.748 -17.998 369 HA ALA 45 HA ALA 45 -23.451 1.743 -15.533 370 HB1 ALA 45 HB1 ALA 45 -21.203 1.893 -14.804 371 HB2 ALA 45 HB2 ALA 45 -20.852 3.230 -15.897 372 HB3 ALA 45 HB3 ALA 45 -21.096 1.607 -16.540 373 H ASP 46 HN ASP 46 -22.609 5.016 -16.579 374 HA ASP 46 HA ASP 46 -22.911 7.075 -15.597 375 HB2 ASP 46 HB2 ASP 46 -25.279 6.244 -15.888 376 HB3 ASP 46 HB1 ASP 46 -25.234 5.739 -14.200 377 H LYS 47 HN LYS 47 -21.090 5.286 -14.233 378 HA LYS 47 HA LYS 47 -21.592 5.712 -11.376 379 HB2 LYS 47 HB2 LYS 47 -19.382 4.282 -12.871 380 HB3 LYS 47 HB1 LYS 47 -19.452 4.433 -11.114 381 HG2 LYS 47 HG2 LYS 47 -21.650 3.306 -11.103 382 HG3 LYS 47 HG1 LYS 47 -21.576 3.147 -12.858 383 HD2 LYS 47 HD2 LYS 47 -19.552 1.773 -12.672 384 HD3 LYS 47 HD1 LYS 47 -19.564 1.967 -10.919 385 HE2 LYS 47 HE2 LYS 47 -20.560 -0.189 -11.522 386 HE3 LYS 47 HE1 LYS 47 -21.790 0.869 -10.830 387 HZ1 LYS 47 HZ1 LYS 47 -22.612 -0.201 -12.817 388 HZ2 LYS 47 HZ2 LYS 47 -21.311 0.406 -13.724 389 HZ3 LYS 47 HZ3 LYS 47 -22.469 1.467 -13.080 390 H GLN 48 HN GLN 48 -20.339 7.466 -13.886 391 HA GLN 48 HA GLN 48 -17.976 8.570 -12.777 392 HB2 GLN 48 HB2 GLN 48 -19.948 9.648 -14.804 393 HB3 GLN 48 HB1 GLN 48 -18.473 10.499 -14.355 394 HG2 GLN 48 HG2 GLN 48 -18.563 7.678 -15.475 395 HG3 GLN 48 HG1 GLN 48 -18.187 9.120 -16.410 396 HE21 GLN 48 HE21 GLN 48 -16.340 10.520 -15.183 397 HE22 GLN 48 HE22 GLN 48 -15.011 9.599 -14.665 398 H GLU 49 HN GLU 49 -21.383 9.469 -12.535 399 HA GLU 49 HA GLU 49 -21.003 11.912 -11.154 400 HB2 GLU 49 HB2 GLU 49 -23.331 9.988 -11.252 401 HB3 GLU 49 HB1 GLU 49 -23.385 11.512 -10.367 402 HG2 GLU 49 HG2 GLU 49 -22.988 12.780 -12.384 403 HG3 GLU 49 HG1 GLU 49 -22.690 11.312 -13.311 404 H HIS 50 HN HIS 50 -21.362 8.573 -10.048 405 HA HIS 50 HA HIS 50 -21.528 9.140 -7.278 406 HB2 HIS 50 HB2 HIS 50 -22.093 6.948 -8.406 407 HB3 HIS 50 HB1 HIS 50 -20.360 6.648 -8.530 408 HD2 HIS 50 HD2 HIS 50 -23.175 6.515 -5.855 409 HE1 HIS 50 HE1 HIS 50 -19.535 5.675 -3.886 410 HE2 HIS 50 HE2 HIS 50 -22.063 5.699 -3.637 411 H LEU 51 HN LEU 51 -19.993 9.458 -5.744 412 HA LEU 51 HA LEU 51 -17.451 10.419 -6.476 413 HB2 LEU 51 HB2 LEU 51 -18.565 11.073 -4.389 414 HB3 LEU 51 HB1 LEU 51 -18.432 9.423 -3.786 415 HG LEU 51 HG LEU 51 -15.962 9.588 -3.877 416 HD11 LEU 51 HD11 LEU 51 -15.126 12.068 -4.144 417 HD12 LEU 51 HD12 LEU 51 -16.622 12.286 -5.051 418 HD13 LEU 51 HD13 LEU 51 -15.428 11.102 -5.586 419 HD21 LEU 51 HD21 LEU 51 -15.719 11.011 -1.960 420 HD22 LEU 51 HD22 LEU 51 -17.337 10.318 -1.866 421 HD23 LEU 51 HD23 LEU 51 -17.120 11.977 -2.421 422 H ASP 52 HN ASP 52 -18.479 7.293 -5.137 423 HA ASP 52 HA ASP 52 -17.394 5.280 -4.947 424 HB2 ASP 52 HB2 ASP 52 -17.519 5.721 -7.486 425 HB3 ASP 52 HB1 ASP 52 -15.807 6.120 -7.374 426 H GLY 53 HN GLY 53 -14.700 4.599 -5.730 427 HA2 GLY 53 HA2 GLY 53 -13.295 5.335 -3.405 428 HA3 GLY 53 HA1 GLY 53 -12.581 4.575 -4.824 429 H ALA 54 HN ALA 54 -13.215 6.652 -6.719 430 HA ALA 54 HA ALA 54 -12.243 8.548 -7.576 431 HB1 ALA 54 HB1 ALA 54 -12.423 10.512 -6.263 432 HB2 ALA 54 HB2 ALA 54 -12.275 9.613 -4.754 433 HB3 ALA 54 HB3 ALA 54 -13.743 9.475 -5.722 434 H LEU 55 HN LEU 55 -10.515 6.392 -6.516 435 HA LEU 55 HA LEU 55 -8.275 7.448 -5.161 436 HB2 LEU 55 HB2 LEU 55 -8.557 5.096 -7.039 437 HB3 LEU 55 HB1 LEU 55 -7.080 5.453 -6.149 438 HG LEU 55 HG LEU 55 -9.788 5.047 -4.841 439 HD11 LEU 55 HD11 LEU 55 -9.037 2.806 -4.274 440 HD12 LEU 55 HD12 LEU 55 -7.477 3.093 -5.047 441 HD13 LEU 55 HD13 LEU 55 -8.944 3.008 -6.024 442 HD21 LEU 55 HD21 LEU 55 -8.523 6.193 -3.247 443 HD22 LEU 55 HD22 LEU 55 -6.990 5.553 -3.838 444 HD23 LEU 55 HD23 LEU 55 -8.060 4.535 -2.876 445 H ARG 56 HN ARG 56 -9.067 7.188 -8.596 446 HA ARG 56 HA ARG 56 -6.570 8.014 -9.621 447 HB2 ARG 56 HB2 ARG 56 -9.372 8.218 -10.736 448 HB3 ARG 56 HB1 ARG 56 -7.931 8.665 -11.650 449 HG2 ARG 56 HG2 ARG 56 -7.025 6.401 -11.372 450 HG3 ARG 56 HG1 ARG 56 -8.431 5.943 -10.411 451 HD2 ARG 56 HD2 ARG 56 -9.904 6.378 -12.329 452 HD3 ARG 56 HD1 ARG 56 -8.518 6.878 -13.293 453 HE ARG 56 HE ARG 56 -7.938 4.632 -13.554 454 HH11 ARG 56 HH11 ARG 56 -8.368 2.411 -13.353 455 HH12 ARG 56 HH12 ARG 56 -9.566 1.864 -12.226 456 HH21 ARG 56 HH21 ARG 56 -10.363 5.051 -11.119 457 HH22 ARG 56 HH22 ARG 56 -10.695 3.359 -10.963 458 H TYR 57 HN TYR 57 -9.433 9.825 -8.598 459 HA TYR 57 HA TYR 57 -8.741 12.363 -9.517 460 HB2 TYR 57 HB2 TYR 57 -10.925 11.912 -8.552 461 HB3 TYR 57 HB1 TYR 57 -10.198 11.572 -6.982 462 HD1 TYR 57 HD1 TYR 57 -10.635 14.243 -9.552 463 HD2 TYR 57 HD2 TYR 57 -9.713 13.325 -5.457 464 HE1 TYR 57 HE1 TYR 57 -10.728 16.657 -8.987 465 HE2 TYR 57 HE2 TYR 57 -9.806 15.738 -4.893 466 HH TYR 57 HH TYR 57 -9.951 17.811 -5.714 Start of MODEL 4 1 H1 GLY 1 HT1 GLY 1 1.272 -18.159 -33.924 2 H2 GLY 1 HT2 GLY 1 1.361 -18.294 -32.233 3 H3 GLY 1 HT3 GLY 1 2.719 -17.789 -33.121 4 HA2 GLY 1 HA2 GLY 1 1.388 -15.819 -33.862 5 HA3 GLY 1 HA1 GLY 1 0.197 -16.304 -32.654 6 H SER 2 HN SER 2 3.134 -14.668 -33.210 7 HA SER 2 HA SER 2 4.609 -13.556 -31.842 8 HB2 SER 2 HB2 SER 2 2.241 -13.629 -29.960 9 HB3 SER 2 HB1 SER 2 3.649 -12.585 -29.790 10 HG SER 2 HG SER 2 1.850 -11.588 -30.870 11 H LYS 3 HN LYS 3 4.869 -16.359 -31.847 12 HA LYS 3 HA LYS 3 4.983 -17.522 -29.284 13 HB2 LYS 3 HB2 LYS 3 6.496 -18.096 -31.838 14 HB3 LYS 3 HB1 LYS 3 6.670 -19.076 -30.388 15 HG2 LYS 3 HG2 LYS 3 3.911 -18.516 -31.461 16 HG3 LYS 3 HG1 LYS 3 4.898 -19.750 -32.237 17 HD2 LYS 3 HD2 LYS 3 4.537 -19.776 -29.241 18 HD3 LYS 3 HD1 LYS 3 3.291 -20.447 -30.287 19 HE2 LYS 3 HE2 LYS 3 5.033 -21.904 -31.344 20 HE3 LYS 3 HE1 LYS 3 6.201 -21.305 -30.170 21 HZ1 LYS 3 HZ1 LYS 3 4.241 -22.011 -28.547 22 HZ2 LYS 3 HZ2 LYS 3 5.472 -23.081 -29.022 23 HZ3 LYS 3 HZ3 LYS 3 3.961 -23.122 -29.799 24 H THR 4 HN THR 4 7.349 -15.664 -31.143 25 HA THR 4 HA THR 4 9.403 -15.950 -29.121 26 HB THR 4 HB THR 4 10.673 -14.395 -30.564 27 HG1 THR 4 HG1 THR 4 8.918 -14.443 -32.618 28 HG21 THR 4 HG21 THR 4 9.379 -16.421 -32.376 29 HG22 THR 4 HG22 THR 4 10.367 -16.948 -31.013 30 HG23 THR 4 HG23 THR 4 11.073 -15.945 -32.279 31 H ILE 5 HN ILE 5 10.392 -14.054 -28.086 32 HA ILE 5 HA ILE 5 8.357 -12.377 -26.896 33 HB ILE 5 HB ILE 5 10.222 -11.586 -25.478 34 HG12 ILE 5 HG12 ILE 5 11.915 -13.541 -27.061 35 HG13 ILE 5 HG11 ILE 5 11.980 -11.794 -27.284 36 HG21 ILE 5 HG21 ILE 5 10.068 -14.590 -25.848 37 HG22 ILE 5 HG22 ILE 5 8.978 -13.614 -24.865 38 HG23 ILE 5 HG23 ILE 5 10.674 -13.772 -24.408 39 HD11 ILE 5 HD11 ILE 5 13.748 -12.417 -25.754 40 HD12 ILE 5 HD12 ILE 5 12.618 -13.324 -24.750 41 HD13 ILE 5 HD13 ILE 5 12.504 -11.566 -24.837 42 H GLN 6 HN GLN 6 10.834 -12.038 -29.328 43 HA GLN 6 HA GLN 6 11.600 -10.220 -30.520 44 HB2 GLN 6 HB2 GLN 6 8.644 -9.719 -30.229 45 HB3 GLN 6 HB1 GLN 6 9.671 -8.684 -31.218 46 HG2 GLN 6 HG2 GLN 6 9.439 -11.686 -31.545 47 HG3 GLN 6 HG1 GLN 6 8.553 -10.514 -32.516 48 HE21 GLN 6 HE21 GLN 6 10.195 -8.709 -33.459 49 HE22 GLN 6 HE22 GLN 6 11.603 -9.351 -34.157 50 H GLU 7 HN GLU 7 11.778 -10.025 -27.593 51 HA GLU 7 HA GLU 7 12.283 -8.498 -25.960 52 HB2 GLU 7 HB2 GLU 7 12.900 -6.860 -28.425 53 HB3 GLU 7 HB1 GLU 7 13.363 -6.403 -26.786 54 HG2 GLU 7 HG2 GLU 7 14.650 -8.484 -26.554 55 HG3 GLU 7 HG1 GLU 7 14.168 -8.974 -28.176 56 H LYS 8 HN LYS 8 9.472 -8.565 -26.905 57 HA LYS 8 HA LYS 8 8.436 -5.927 -27.050 58 HB2 LYS 8 HB2 LYS 8 7.185 -8.543 -26.223 59 HB3 LYS 8 HB1 LYS 8 6.273 -7.035 -26.275 60 HG2 LYS 8 HG2 LYS 8 7.005 -6.770 -28.679 61 HG3 LYS 8 HG1 LYS 8 7.684 -8.389 -28.591 62 HD2 LYS 8 HD2 LYS 8 4.790 -7.791 -27.946 63 HD3 LYS 8 HD1 LYS 8 5.336 -8.238 -29.561 64 HE2 LYS 8 HE2 LYS 8 6.331 -10.330 -28.559 65 HE3 LYS 8 HE1 LYS 8 5.549 -9.905 -27.038 66 HZ1 LYS 8 HZ1 LYS 8 3.418 -9.877 -28.204 67 HZ2 LYS 8 HZ2 LYS 8 4.164 -11.402 -28.279 68 HZ3 LYS 8 HZ3 LYS 8 4.189 -10.373 -29.630 69 H GLU 9 HN GLU 9 9.089 -8.103 -24.345 70 HA GLU 9 HA GLU 9 7.887 -6.518 -22.328 71 HB2 GLU 9 HB2 GLU 9 10.107 -8.565 -22.215 72 HB3 GLU 9 HB1 GLU 9 9.445 -7.782 -20.781 73 HG2 GLU 9 HG2 GLU 9 7.744 -9.285 -22.793 74 HG3 GLU 9 HG1 GLU 9 8.396 -10.017 -21.330 75 H GLN 10 HN GLN 10 11.147 -6.566 -23.698 76 HA GLN 10 HA GLN 10 12.345 -4.766 -21.885 77 HB2 GLN 10 HB2 GLN 10 13.606 -6.176 -23.490 78 HB3 GLN 10 HB1 GLN 10 12.990 -5.188 -24.814 79 HG2 GLN 10 HG2 GLN 10 14.071 -3.204 -23.884 80 HG3 GLN 10 HG1 GLN 10 14.619 -4.129 -22.488 81 HE21 GLN 10 HE21 GLN 10 16.897 -3.839 -22.985 82 HE22 GLN 10 HE22 GLN 10 17.619 -4.593 -24.324 83 H GLU 11 HN GLU 11 10.620 -4.265 -24.936 84 HA GLU 11 HA GLU 11 11.020 -1.471 -25.127 85 HB2 GLU 11 HB2 GLU 11 10.239 -2.882 -27.006 86 HB3 GLU 11 HB1 GLU 11 8.707 -3.129 -26.168 87 HG2 GLU 11 HG2 GLU 11 8.255 -0.720 -26.227 88 HG3 GLU 11 HG1 GLU 11 9.816 -0.429 -26.992 89 H LEU 12 HN LEU 12 8.526 -3.433 -23.577 90 HA LEU 12 HA LEU 12 6.738 -1.383 -22.899 91 HB2 LEU 12 HB2 LEU 12 6.167 -3.764 -22.742 92 HB3 LEU 12 HB1 LEU 12 7.330 -3.968 -21.435 93 HG LEU 12 HG LEU 12 6.044 -2.378 -20.039 94 HD11 LEU 12 HD11 LEU 12 3.633 -1.918 -20.995 95 HD12 LEU 12 HD12 LEU 12 4.404 -2.167 -22.561 96 HD13 LEU 12 HD13 LEU 12 4.970 -0.883 -21.492 97 HD21 LEU 12 HD21 LEU 12 3.970 -3.820 -19.822 98 HD22 LEU 12 HD22 LEU 12 5.494 -4.708 -19.790 99 HD23 LEU 12 HD23 LEU 12 4.513 -4.691 -21.256 100 H LYS 13 HN LYS 13 9.566 -2.658 -21.172 101 HA LYS 13 HA LYS 13 9.193 -1.098 -18.823 102 HB2 LYS 13 HB2 LYS 13 11.641 -2.428 -19.992 103 HB3 LYS 13 HB1 LYS 13 11.647 -1.587 -18.443 104 HG2 LYS 13 HG2 LYS 13 9.861 -3.081 -17.619 105 HG3 LYS 13 HG1 LYS 13 9.856 -3.931 -19.163 106 HD2 LYS 13 HD2 LYS 13 12.227 -4.551 -18.826 107 HD3 LYS 13 HD1 LYS 13 12.213 -3.724 -17.267 108 HE2 LYS 13 HE2 LYS 13 10.404 -6.040 -18.018 109 HE3 LYS 13 HE1 LYS 13 11.856 -6.172 -17.025 110 HZ1 LYS 13 HZ1 LYS 13 10.876 -4.649 -15.436 111 HZ2 LYS 13 HZ2 LYS 13 9.857 -5.987 -15.674 112 HZ3 LYS 13 HZ3 LYS 13 9.485 -4.495 -16.397 113 H ASN 14 HN ASN 14 9.975 0.870 -18.227 114 HA ASN 14 HA ASN 14 10.884 2.632 -20.404 115 HB2 ASN 14 HB2 ASN 14 10.219 4.457 -18.959 116 HB3 ASN 14 HB1 ASN 14 8.906 3.285 -19.044 117 HD21 ASN 14 HD21 ASN 14 8.414 4.543 -16.876 118 HD22 ASN 14 HD22 ASN 14 9.091 3.876 -15.469 119 H LEU 15 HN LEU 15 12.487 0.647 -18.595 120 HA LEU 15 HA LEU 15 14.263 2.180 -17.021 121 HB2 LEU 15 HB2 LEU 15 14.590 -0.500 -18.378 122 HB3 LEU 15 HB1 LEU 15 15.820 0.197 -17.330 123 HG LEU 15 HG LEU 15 12.945 -0.274 -16.468 124 HD11 LEU 15 HD11 LEU 15 13.756 -2.265 -15.324 125 HD12 LEU 15 HD12 LEU 15 15.397 -1.958 -15.888 126 HD13 LEU 15 HD13 LEU 15 14.136 -2.389 -17.042 127 HD21 LEU 15 HD21 LEU 15 13.795 1.290 -14.950 128 HD22 LEU 15 HD22 LEU 15 15.451 0.707 -15.108 129 HD23 LEU 15 HD23 LEU 15 14.277 -0.212 -14.170 130 H LYS 16 HN LYS 16 14.327 1.237 -20.425 131 HA LYS 16 HA LYS 16 16.169 3.414 -20.997 132 HB2 LYS 16 HB2 LYS 16 17.838 2.015 -22.099 133 HB3 LYS 16 HB1 LYS 16 17.688 1.549 -20.406 134 HG2 LYS 16 HG2 LYS 16 16.187 -0.312 -21.063 135 HG3 LYS 16 HG1 LYS 16 16.387 0.137 -22.758 136 HD2 LYS 16 HD2 LYS 16 18.840 -0.207 -22.531 137 HD3 LYS 16 HD1 LYS 16 18.587 -0.748 -20.871 138 HE2 LYS 16 HE2 LYS 16 17.345 -2.029 -23.322 139 HE3 LYS 16 HE1 LYS 16 18.744 -2.658 -22.452 140 HZ1 LYS 16 HZ1 LYS 16 16.915 -3.795 -21.582 141 HZ2 LYS 16 HZ2 LYS 16 15.958 -2.395 -21.495 142 HZ3 LYS 16 HZ3 LYS 16 17.258 -2.606 -20.422 143 H ASP 17 HN ASP 17 16.480 3.704 -23.346 144 HA ASP 17 HA ASP 17 15.593 3.992 -25.445 145 HB2 ASP 17 HB2 ASP 17 16.089 1.507 -25.472 146 HB3 ASP 17 HB1 ASP 17 14.392 1.245 -25.069 147 H ASN 18 HN ASN 18 14.159 5.229 -23.509 148 HA ASN 18 HA ASN 18 11.405 4.557 -23.403 149 HB2 ASN 18 HB2 ASN 18 12.902 7.130 -22.902 150 HB3 ASN 18 HB1 ASN 18 11.161 6.978 -22.676 151 HD21 ASN 18 HD21 ASN 18 12.984 7.516 -20.491 152 HD22 ASN 18 HD22 ASN 18 12.942 6.179 -19.447 153 H VAL 19 HN VAL 19 13.342 6.354 -25.688 154 HA VAL 19 HA VAL 19 11.324 7.816 -26.983 155 HB VAL 19 HB VAL 19 13.932 6.672 -28.007 156 HG11 VAL 19 HG11 VAL 19 11.908 8.493 -29.329 157 HG12 VAL 19 HG12 VAL 19 12.601 7.000 -29.962 158 HG13 VAL 19 HG13 VAL 19 13.600 8.446 -29.823 159 HG21 VAL 19 HG21 VAL 19 13.119 9.500 -27.267 160 HG22 VAL 19 HG22 VAL 19 14.735 8.948 -27.705 161 HG23 VAL 19 HG23 VAL 19 13.998 8.409 -26.196 162 H GLU 20 HN GLU 20 12.558 4.531 -27.600 163 HA GLU 20 HA GLU 20 10.986 3.996 -29.876 164 HB2 GLU 20 HB2 GLU 20 12.901 2.600 -29.189 165 HB3 GLU 20 HB1 GLU 20 11.990 2.050 -27.784 166 HG2 GLU 20 HG2 GLU 20 10.285 1.063 -29.245 167 HG3 GLU 20 HG1 GLU 20 11.130 1.671 -30.668 168 H LEU 21 HN LEU 21 10.360 3.521 -26.419 169 HA LEU 21 HA LEU 21 7.910 2.161 -26.663 170 HB2 LEU 21 HB2 LEU 21 9.145 2.288 -24.549 171 HB3 LEU 21 HB1 LEU 21 8.869 4.027 -24.475 172 HG LEU 21 HG LEU 21 6.426 3.635 -24.355 173 HD11 LEU 21 HD11 LEU 21 5.991 1.624 -25.485 174 HD12 LEU 21 HD12 LEU 21 5.826 1.136 -23.801 175 HD13 LEU 21 HD13 LEU 21 7.309 0.770 -24.682 176 HD21 LEU 21 HD21 LEU 21 7.936 1.962 -22.324 177 HD22 LEU 21 HD22 LEU 21 6.389 2.775 -22.083 178 HD23 LEU 21 HD23 LEU 21 7.860 3.724 -22.296 179 H GLU 22 HN GLU 22 8.653 5.627 -26.420 180 HA GLU 22 HA GLU 22 5.995 6.565 -26.383 181 HB2 GLU 22 HB2 GLU 22 7.954 7.961 -25.808 182 HB3 GLU 22 HB1 GLU 22 8.459 7.929 -27.497 183 HG2 GLU 22 HG2 GLU 22 6.377 9.036 -28.169 184 HG3 GLU 22 HG1 GLU 22 5.807 9.012 -26.501 185 H ARG 23 HN ARG 23 8.226 5.889 -29.054 186 HA ARG 23 HA ARG 23 6.637 6.881 -31.151 187 HB2 ARG 23 HB2 ARG 23 9.010 6.266 -31.419 188 HB3 ARG 23 HB1 ARG 23 8.590 4.566 -31.199 189 HG2 ARG 23 HG2 ARG 23 7.213 4.589 -33.199 190 HG3 ARG 23 HG1 ARG 23 7.439 6.329 -33.380 191 HD2 ARG 23 HD2 ARG 23 9.698 4.312 -33.432 192 HD3 ARG 23 HD1 ARG 23 8.922 4.960 -34.875 193 HE ARG 23 HE ARG 23 9.736 7.139 -33.318 194 HH11 ARG 23 HH11 ARG 23 11.685 8.202 -33.796 195 HH12 ARG 23 HH12 ARG 23 12.918 7.378 -34.691 196 HH21 ARG 23 HH21 ARG 23 11.095 4.446 -35.015 197 HH22 ARG 23 HH22 ARG 23 12.585 5.251 -35.382 198 H LEU 24 HN LEU 24 6.793 3.655 -29.670 199 HA LEU 24 HA LEU 24 4.980 2.378 -31.402 200 HB2 LEU 24 HB2 LEU 24 6.430 1.143 -29.855 201 HB3 LEU 24 HB1 LEU 24 5.565 1.825 -28.480 202 HG LEU 24 HG LEU 24 3.483 0.720 -29.239 203 HD11 LEU 24 HD11 LEU 24 5.265 -0.088 -31.534 204 HD12 LEU 24 HD12 LEU 24 3.609 0.520 -31.572 205 HD13 LEU 24 HD13 LEU 24 3.926 -1.132 -31.055 206 HD21 LEU 24 HD21 LEU 24 5.741 -1.294 -29.179 207 HD22 LEU 24 HD22 LEU 24 4.098 -1.492 -28.570 208 HD23 LEU 24 HD23 LEU 24 5.221 -0.410 -27.745 209 H LYS 25 HN LYS 25 4.479 4.104 -28.338 210 HA LYS 25 HA LYS 25 1.704 3.640 -28.120 211 HB2 LYS 25 HB2 LYS 25 3.108 4.491 -26.269 212 HB3 LYS 25 HB1 LYS 25 3.303 6.016 -27.132 213 HG2 LYS 25 HG2 LYS 25 0.869 6.385 -27.061 214 HG3 LYS 25 HG1 LYS 25 0.653 4.843 -26.231 215 HD2 LYS 25 HD2 LYS 25 2.031 5.655 -24.354 216 HD3 LYS 25 HD1 LYS 25 2.253 7.196 -25.183 217 HE2 LYS 25 HE2 LYS 25 -0.181 7.582 -25.134 218 HE3 LYS 25 HE1 LYS 25 -0.411 6.037 -24.315 219 HZ1 LYS 25 HZ1 LYS 25 1.543 7.617 -22.994 220 HZ2 LYS 25 HZ2 LYS 25 0.106 6.950 -22.380 221 HZ3 LYS 25 HZ3 LYS 25 0.085 8.472 -23.137 222 H ASN 26 HN ASN 26 -0.010 4.518 -29.114 223 HA ASN 26 HA ASN 26 0.451 6.447 -31.264 224 HB2 ASN 26 HB2 ASN 26 -0.975 4.401 -31.572 225 HB3 ASN 26 HB1 ASN 26 -2.131 5.101 -30.440 226 HD21 ASN 26 HD21 ASN 26 -3.813 5.450 -32.018 227 HD22 ASN 26 HD22 ASN 26 -3.651 6.579 -33.275 228 H GLU 27 HN GLU 27 0.583 8.507 -30.581 229 HA GLU 27 HA GLU 27 -0.674 9.562 -28.283 230 HB2 GLU 27 HB2 GLU 27 0.417 10.916 -30.759 231 HB3 GLU 27 HB1 GLU 27 -0.132 11.785 -29.326 232 HG2 GLU 27 HG2 GLU 27 1.989 9.625 -29.260 233 HG3 GLU 27 HG1 GLU 27 2.354 11.345 -29.384 234 H ARG 28 HN ARG 28 -1.624 9.490 -31.691 235 HA ARG 28 HA ARG 28 -3.944 11.127 -31.362 236 HB2 ARG 28 HB2 ARG 28 -3.133 9.163 -33.516 237 HB3 ARG 28 HB1 ARG 28 -4.574 10.178 -33.605 238 HG2 ARG 28 HG2 ARG 28 -3.179 12.197 -33.401 239 HG3 ARG 28 HG1 ARG 28 -1.733 11.193 -33.294 240 HD2 ARG 28 HD2 ARG 28 -2.201 10.277 -35.536 241 HD3 ARG 28 HD1 ARG 28 -3.644 11.279 -35.645 242 HE ARG 28 HE ARG 28 -1.441 12.949 -35.101 243 HH11 ARG 28 HH11 ARG 28 -0.502 14.116 -36.809 244 HH12 ARG 28 HH12 ARG 28 -0.746 13.597 -38.444 245 HH21 ARG 28 HH21 ARG 28 -2.711 10.878 -37.565 246 HH22 ARG 28 HH22 ARG 28 -1.997 11.764 -38.871 247 H HIS 29 HN HIS 29 -6.076 10.550 -31.076 248 HA HIS 29 HA HIS 29 -6.614 8.207 -29.575 249 HB2 HIS 29 HB2 HIS 29 -7.915 10.353 -29.447 250 HB3 HIS 29 HB1 HIS 29 -8.626 9.952 -31.009 251 HD2 HIS 29 HD2 HIS 29 -10.956 8.511 -30.713 252 HE1 HIS 29 HE1 HIS 29 -10.153 6.820 -26.929 253 HE2 HIS 29 HE2 HIS 29 -11.870 6.996 -28.792 254 H ASP 30 HN ASP 30 -7.475 6.262 -30.142 255 HA ASP 30 HA ASP 30 -7.086 5.283 -32.753 256 HB2 ASP 30 HB2 ASP 30 -8.635 4.205 -30.399 257 HB3 ASP 30 HB1 ASP 30 -8.446 3.313 -31.908 258 H HIS 31 HN HIS 31 -9.976 6.455 -31.098 259 HA HIS 31 HA HIS 31 -12.135 6.789 -31.811 260 HB2 HIS 31 HB2 HIS 31 -12.361 8.123 -33.782 261 HB3 HIS 31 HB1 HIS 31 -10.825 8.572 -33.048 262 HD2 HIS 31 HD2 HIS 31 -8.594 8.135 -34.685 263 HE1 HIS 31 HE1 HIS 31 -10.607 6.116 -37.795 264 HE2 HIS 31 HE2 HIS 31 -8.389 7.122 -37.081 265 H ASP 32 HN ASP 32 -11.056 4.099 -32.148 266 HA ASP 32 HA ASP 32 -12.115 3.094 -34.657 267 HB2 ASP 32 HB2 ASP 32 -11.352 0.930 -33.856 268 HB3 ASP 32 HB1 ASP 32 -10.103 2.127 -33.536 269 H GLU 33 HN GLU 33 -13.610 1.081 -34.452 270 HA GLU 33 HA GLU 33 -16.096 1.934 -33.412 271 HB2 GLU 33 HB2 GLU 33 -15.147 -0.735 -34.452 272 HB3 GLU 33 HB1 GLU 33 -16.806 -0.450 -33.931 273 HG2 GLU 33 HG2 GLU 33 -17.103 1.282 -35.591 274 HG3 GLU 33 HG1 GLU 33 -15.397 1.229 -36.028 275 H GLU 34 HN GLU 34 -13.659 -0.311 -32.186 276 HA GLU 34 HA GLU 34 -15.176 -1.389 -30.066 277 HB2 GLU 34 HB2 GLU 34 -12.199 -1.034 -30.428 278 HB3 GLU 34 HB1 GLU 34 -12.900 -1.842 -29.027 279 HG2 GLU 34 HG2 GLU 34 -13.936 -3.519 -30.425 280 HG3 GLU 34 HG1 GLU 34 -13.475 -2.659 -31.890 281 H ALA 35 HN ALA 35 -13.163 1.509 -30.274 282 HA ALA 35 HA ALA 35 -13.178 2.193 -27.543 283 HB1 ALA 35 HB1 ALA 35 -12.997 3.920 -30.020 284 HB2 ALA 35 HB2 ALA 35 -11.661 3.310 -29.044 285 HB3 ALA 35 HB3 ALA 35 -12.755 4.526 -28.382 286 H GLU 36 HN GLU 36 -15.443 2.915 -30.167 287 HA GLU 36 HA GLU 36 -17.102 4.706 -28.752 288 HB2 GLU 36 HB2 GLU 36 -17.183 4.406 -31.205 289 HB3 GLU 36 HB1 GLU 36 -17.854 2.792 -30.977 290 HG2 GLU 36 HG2 GLU 36 -19.809 3.735 -29.839 291 HG3 GLU 36 HG1 GLU 36 -19.130 5.355 -29.980 292 H ARG 37 HN ARG 37 -17.178 1.179 -29.103 293 HA ARG 37 HA ARG 37 -19.600 0.707 -27.751 294 HB2 ARG 37 HB2 ARG 37 -18.439 -1.006 -29.090 295 HB3 ARG 37 HB1 ARG 37 -17.143 -1.057 -27.895 296 HG2 ARG 37 HG2 ARG 37 -18.682 -1.833 -26.180 297 HG3 ARG 37 HG1 ARG 37 -20.052 -1.642 -27.274 298 HD2 ARG 37 HD2 ARG 37 -19.385 -3.992 -27.200 299 HD3 ARG 37 HD1 ARG 37 -19.042 -3.327 -28.795 300 HE ARG 37 HE ARG 37 -16.767 -3.087 -27.090 301 HH11 ARG 37 HH11 ARG 37 -15.030 -4.501 -27.469 302 HH12 ARG 37 HH12 ARG 37 -15.279 -5.941 -28.398 303 HH21 ARG 37 HH21 ARG 37 -18.650 -5.328 -28.935 304 HH22 ARG 37 HH22 ARG 37 -17.329 -6.410 -29.227 305 H LYS 38 HN LYS 38 -16.259 0.908 -26.565 306 HA LYS 38 HA LYS 38 -16.770 0.225 -23.884 307 HB2 LYS 38 HB2 LYS 38 -14.504 0.332 -24.836 308 HB3 LYS 38 HB1 LYS 38 -14.659 2.082 -24.995 309 HG2 LYS 38 HG2 LYS 38 -14.789 2.381 -22.619 310 HG3 LYS 38 HG1 LYS 38 -14.988 0.652 -22.348 311 HD2 LYS 38 HD2 LYS 38 -12.717 1.104 -21.805 312 HD3 LYS 38 HD1 LYS 38 -12.664 0.374 -23.406 313 HE2 LYS 38 HE2 LYS 38 -11.201 2.352 -23.295 314 HE3 LYS 38 HE1 LYS 38 -12.521 2.628 -24.424 315 HZ1 LYS 38 HZ1 LYS 38 -13.086 3.371 -21.690 316 HZ2 LYS 38 HZ2 LYS 38 -13.404 4.211 -23.132 317 HZ3 LYS 38 HZ3 LYS 38 -11.861 4.285 -22.425 318 H ALA 39 HN ALA 39 -16.760 3.376 -25.525 319 HA ALA 39 HA ALA 39 -17.219 4.971 -23.251 320 HB1 ALA 39 HB1 ALA 39 -18.083 5.457 -26.112 321 HB2 ALA 39 HB2 ALA 39 -16.520 5.895 -25.423 322 HB3 ALA 39 HB3 ALA 39 -17.989 6.677 -24.843 323 H LEU 40 HN LEU 40 -19.439 3.318 -25.456 324 HA LEU 40 HA LEU 40 -21.841 4.402 -24.465 325 HB2 LEU 40 HB2 LEU 40 -21.722 3.158 -26.576 326 HB3 LEU 40 HB1 LEU 40 -21.318 1.684 -25.699 327 HG LEU 40 HG LEU 40 -23.502 1.772 -24.540 328 HD11 LEU 40 HD11 LEU 40 -23.728 4.352 -26.084 329 HD12 LEU 40 HD12 LEU 40 -24.124 4.030 -24.395 330 HD13 LEU 40 HD13 LEU 40 -25.186 3.446 -25.674 331 HD21 LEU 40 HD21 LEU 40 -23.747 2.035 -27.553 332 HD22 LEU 40 HD22 LEU 40 -24.886 1.215 -26.486 333 HD23 LEU 40 HD23 LEU 40 -23.260 0.570 -26.701 334 H GLU 41 HN GLU 41 -20.017 1.498 -23.538 335 HA GLU 41 HA GLU 41 -21.833 0.533 -21.611 336 HB2 GLU 41 HB2 GLU 41 -19.967 -0.807 -22.515 337 HB3 GLU 41 HB1 GLU 41 -18.816 0.248 -21.697 338 HG2 GLU 41 HG2 GLU 41 -19.183 -1.778 -20.371 339 HG3 GLU 41 HG1 GLU 41 -19.822 -0.383 -19.510 340 H ASP 42 HN ASP 42 -19.097 2.775 -21.362 341 HA ASP 42 HA ASP 42 -19.123 3.098 -18.565 342 HB2 ASP 42 HB2 ASP 42 -17.287 3.873 -20.035 343 HB3 ASP 42 HB1 ASP 42 -18.349 5.129 -20.671 344 H LYS 43 HN LYS 43 -20.822 4.848 -21.143 345 HA LYS 43 HA LYS 43 -22.035 6.792 -19.484 346 HB2 LYS 43 HB2 LYS 43 -22.829 5.665 -22.173 347 HB3 LYS 43 HB1 LYS 43 -23.714 6.968 -21.380 348 HG2 LYS 43 HG2 LYS 43 -21.650 8.324 -21.302 349 HG3 LYS 43 HG1 LYS 43 -20.765 7.030 -22.107 350 HD2 LYS 43 HD2 LYS 43 -22.219 7.217 -24.070 351 HD3 LYS 43 HD1 LYS 43 -23.170 8.465 -23.265 352 HE2 LYS 43 HE2 LYS 43 -21.555 9.504 -24.787 353 HE3 LYS 43 HE1 LYS 43 -21.138 9.889 -23.117 354 HZ1 LYS 43 HZ1 LYS 43 -19.505 8.134 -23.131 355 HZ2 LYS 43 HZ2 LYS 43 -19.205 9.201 -24.419 356 HZ3 LYS 43 HZ3 LYS 43 -19.933 7.693 -24.713 357 H LEU 44 HN LEU 44 -23.038 3.557 -20.488 358 HA LEU 44 HA LEU 44 -25.653 3.646 -19.405 359 HB2 LEU 44 HB2 LEU 44 -23.786 1.338 -19.967 360 HB3 LEU 44 HB1 LEU 44 -25.435 1.117 -19.392 361 HG LEU 44 HG LEU 44 -24.724 2.669 -21.904 362 HD11 LEU 44 HD11 LEU 44 -24.067 0.419 -22.331 363 HD12 LEU 44 HD12 LEU 44 -25.673 0.585 -23.040 364 HD13 LEU 44 HD13 LEU 44 -25.474 -0.229 -21.488 365 HD21 LEU 44 HD21 LEU 44 -26.879 3.376 -21.332 366 HD22 LEU 44 HD22 LEU 44 -27.292 1.849 -20.553 367 HD23 LEU 44 HD23 LEU 44 -27.252 1.962 -22.311 368 H ALA 45 HN ALA 45 -22.529 2.723 -18.038 369 HA ALA 45 HA ALA 45 -23.465 1.690 -15.590 370 HB1 ALA 45 HB1 ALA 45 -21.140 1.432 -16.427 371 HB2 ALA 45 HB2 ALA 45 -21.198 2.045 -14.776 372 HB3 ALA 45 HB3 ALA 45 -20.862 3.145 -16.112 373 H ASP 46 HN ASP 46 -22.649 4.983 -16.599 374 HA ASP 46 HA ASP 46 -22.849 6.226 -14.080 375 HB2 ASP 46 HB2 ASP 46 -21.884 7.305 -16.090 376 HB3 ASP 46 HB1 ASP 46 -23.497 7.397 -16.795 377 H LYS 47 HN LYS 47 -25.283 5.611 -16.591 378 HA LYS 47 HA LYS 47 -27.426 6.971 -15.377 379 HB2 LYS 47 HB2 LYS 47 -27.462 6.183 -17.715 380 HB3 LYS 47 HB1 LYS 47 -27.505 4.515 -17.150 381 HG2 LYS 47 HG2 LYS 47 -29.649 4.939 -16.013 382 HG3 LYS 47 HG1 LYS 47 -29.600 6.622 -16.537 383 HD2 LYS 47 HD2 LYS 47 -29.630 5.895 -18.892 384 HD3 LYS 47 HD1 LYS 47 -29.673 4.210 -18.373 385 HE2 LYS 47 HE2 LYS 47 -31.813 4.612 -17.219 386 HE3 LYS 47 HE1 LYS 47 -31.772 6.301 -17.724 387 HZ1 LYS 47 HZ1 LYS 47 -31.371 4.742 -19.992 388 HZ2 LYS 47 HZ2 LYS 47 -32.721 5.698 -19.612 389 HZ3 LYS 47 HZ3 LYS 47 -32.682 4.061 -19.160 390 H GLN 48 HN GLN 48 -26.333 3.602 -15.103 391 HA GLN 48 HA GLN 48 -28.414 2.921 -13.210 392 HB2 GLN 48 HB2 GLN 48 -25.965 1.452 -14.204 393 HB3 GLN 48 HB1 GLN 48 -27.087 0.777 -13.022 394 HG2 GLN 48 HG2 GLN 48 -28.921 0.899 -14.585 395 HG3 GLN 48 HG1 GLN 48 -27.943 1.802 -15.741 396 HE21 GLN 48 HE21 GLN 48 -29.261 -0.875 -16.112 397 HE22 GLN 48 HE22 GLN 48 -28.002 -1.941 -16.512 398 H GLU 49 HN GLU 49 -28.227 2.700 -11.016 399 HA GLU 49 HA GLU 49 -26.331 4.317 -9.667 400 HB2 GLU 49 HB2 GLU 49 -28.278 2.231 -8.677 401 HB3 GLU 49 HB1 GLU 49 -27.249 3.168 -7.595 402 HG2 GLU 49 HG2 GLU 49 -28.228 5.246 -8.350 403 HG3 GLU 49 HG1 GLU 49 -29.130 4.420 -9.618 404 H HIS 50 HN HIS 50 -26.543 0.820 -10.190 405 HA HIS 50 HA HIS 50 -23.704 0.581 -9.406 406 HB2 HIS 50 HB2 HIS 50 -25.942 -1.221 -8.447 407 HB3 HIS 50 HB1 HIS 50 -24.222 -1.514 -8.195 408 HD2 HIS 50 HD2 HIS 50 -23.053 0.010 -6.137 409 HE1 HIS 50 HE1 HIS 50 -26.511 2.207 -5.120 410 HE2 HIS 50 HE2 HIS 50 -24.121 1.685 -4.442 411 H LEU 51 HN LEU 51 -22.563 -1.011 -10.482 412 HA LEU 51 HA LEU 51 -23.465 -1.708 -13.079 413 HB2 LEU 51 HB2 LEU 51 -21.147 -2.701 -11.414 414 HB3 LEU 51 HB1 LEU 51 -21.427 -3.222 -13.072 415 HG LEU 51 HG LEU 51 -21.135 -0.312 -12.250 416 HD11 LEU 51 HD11 LEU 51 -18.852 -0.496 -13.218 417 HD12 LEU 51 HD12 LEU 51 -19.089 -2.235 -13.393 418 HD13 LEU 51 HD13 LEU 51 -19.054 -1.507 -11.788 419 HD21 LEU 51 HD21 LEU 51 -21.462 -1.772 -14.868 420 HD22 LEU 51 HD22 LEU 51 -20.507 -0.292 -14.832 421 HD23 LEU 51 HD23 LEU 51 -22.193 -0.259 -14.334 422 H ASP 52 HN ASP 52 -23.314 -3.477 -10.029 423 HA ASP 52 HA ASP 52 -23.998 -6.026 -11.011 424 HB2 ASP 52 HB2 ASP 52 -24.421 -4.717 -8.323 425 HB3 ASP 52 HB1 ASP 52 -24.832 -6.401 -8.643 426 H GLY 53 HN GLY 53 -25.986 -3.292 -9.975 427 HA2 GLY 53 HA2 GLY 53 -28.491 -4.596 -10.048 428 HA3 GLY 53 HA1 GLY 53 -28.238 -2.858 -10.193 429 H ALA 54 HN ALA 54 -26.383 -3.506 -12.564 430 HA ALA 54 HA ALA 54 -28.230 -2.990 -14.621 431 HB1 ALA 54 HB1 ALA 54 -26.399 -3.124 -16.099 432 HB2 ALA 54 HB2 ALA 54 -25.544 -4.280 -15.077 433 HB3 ALA 54 HB3 ALA 54 -25.684 -2.595 -14.576 434 H LEU 55 HN LEU 55 -26.745 -6.011 -13.513 435 HA LEU 55 HA LEU 55 -27.212 -8.213 -13.998 436 HB2 LEU 55 HB2 LEU 55 -29.935 -7.082 -14.695 437 HB3 LEU 55 HB1 LEU 55 -29.570 -8.771 -14.348 438 HG LEU 55 HG LEU 55 -29.171 -6.475 -12.406 439 HD11 LEU 55 HD11 LEU 55 -31.329 -8.585 -12.666 440 HD12 LEU 55 HD12 LEU 55 -31.532 -6.834 -12.709 441 HD13 LEU 55 HD13 LEU 55 -31.082 -7.632 -11.202 442 HD21 LEU 55 HD21 LEU 55 -28.647 -9.446 -12.296 443 HD22 LEU 55 HD22 LEU 55 -29.067 -8.581 -10.819 444 HD23 LEU 55 HD23 LEU 55 -27.634 -8.119 -11.729 445 H ARG 56 HN ARG 56 -26.230 -6.381 -16.135 446 HA ARG 56 HA ARG 56 -25.757 -6.472 -18.393 447 HB2 ARG 56 HB2 ARG 56 -26.882 -9.275 -18.301 448 HB3 ARG 56 HB1 ARG 56 -25.664 -8.633 -19.398 449 HG2 ARG 56 HG2 ARG 56 -25.356 -9.119 -16.422 450 HG3 ARG 56 HG1 ARG 56 -24.546 -9.985 -17.723 451 HD2 ARG 56 HD2 ARG 56 -24.144 -7.089 -16.925 452 HD3 ARG 56 HD1 ARG 56 -22.979 -8.398 -16.821 453 HE ARG 56 HE ARG 56 -23.699 -8.249 -19.495 454 HH11 ARG 56 HH11 ARG 56 -22.449 -7.059 -20.972 455 HH12 ARG 56 HH12 ARG 56 -21.432 -5.778 -20.402 456 HH21 ARG 56 HH21 ARG 56 -22.308 -6.205 -17.074 457 HH22 ARG 56 HH22 ARG 56 -21.352 -5.294 -18.196 458 H TYR 57 HN TYR 57 -28.420 -5.592 -17.462 459 HA TYR 57 HA TYR 57 -29.714 -5.545 -20.036 460 HB2 TYR 57 HB2 TYR 57 -30.559 -7.690 -19.275 461 HB3 TYR 57 HB1 TYR 57 -31.036 -6.990 -17.727 462 HD1 TYR 57 HD1 TYR 57 -31.640 -6.786 -21.404 463 HD2 TYR 57 HD2 TYR 57 -33.131 -5.905 -17.474 464 HE1 TYR 57 HE1 TYR 57 -33.820 -6.119 -22.381 465 HE2 TYR 57 HE2 TYR 57 -35.311 -5.239 -18.450 466 HH TYR 57 HH TYR 57 -36.045 -4.327 -20.854 Start of MODEL 5 1 H1 GLY 1 HT1 GLY 1 11.760 13.483 -5.458 2 H2 GLY 1 HT2 GLY 1 12.412 12.457 -6.645 3 H3 GLY 1 HT3 GLY 1 10.810 12.245 -6.124 4 HA2 GLY 1 HA2 GLY 1 11.465 13.551 -8.344 5 HA3 GLY 1 HA1 GLY 1 10.003 13.882 -7.412 6 H SER 2 HN SER 2 12.898 15.172 -8.598 7 HA SER 2 HA SER 2 13.518 17.147 -6.689 8 HB2 SER 2 HB2 SER 2 15.024 16.585 -8.541 9 HB3 SER 2 HB1 SER 2 13.856 17.216 -9.698 10 HG SER 2 HG SER 2 14.408 19.189 -9.177 11 H LYS 3 HN LYS 3 11.336 17.205 -9.493 12 HA LYS 3 HA LYS 3 10.522 19.928 -8.973 13 HB2 LYS 3 HB2 LYS 3 9.451 17.833 -10.887 14 HB3 LYS 3 HB1 LYS 3 8.912 19.512 -10.826 15 HG2 LYS 3 HG2 LYS 3 11.096 20.323 -11.424 16 HG3 LYS 3 HG1 LYS 3 11.812 18.728 -11.210 17 HD2 LYS 3 HD2 LYS 3 11.570 19.005 -13.566 18 HD3 LYS 3 HD1 LYS 3 10.260 17.932 -13.083 19 HE2 LYS 3 HE2 LYS 3 9.463 19.682 -14.632 20 HE3 LYS 3 HE1 LYS 3 8.695 19.842 -13.059 21 HZ1 LYS 3 HZ1 LYS 3 9.575 21.850 -12.812 22 HZ2 LYS 3 HZ2 LYS 3 10.123 21.765 -14.418 23 HZ3 LYS 3 HZ3 LYS 3 11.139 21.280 -13.145 24 H THR 4 HN THR 4 8.066 20.423 -8.660 25 HA THR 4 HA THR 4 7.039 18.678 -6.548 26 HB THR 4 HB THR 4 5.461 20.527 -6.151 27 HG1 THR 4 HG1 THR 4 5.843 21.100 -8.579 28 HG21 THR 4 HG21 THR 4 8.213 21.711 -6.472 29 HG22 THR 4 HG22 THR 4 7.883 20.472 -5.261 30 HG23 THR 4 HG23 THR 4 7.030 22.015 -5.202 31 H ILE 5 HN ILE 5 6.752 18.946 -9.853 32 HA ILE 5 HA ILE 5 3.978 18.680 -10.297 33 HB ILE 5 HB ILE 5 6.331 17.638 -11.891 34 HG12 ILE 5 HG12 ILE 5 6.326 20.080 -11.652 35 HG13 ILE 5 HG11 ILE 5 5.912 19.633 -13.301 36 HG21 ILE 5 HG21 ILE 5 4.447 16.386 -12.615 37 HG22 ILE 5 HG22 ILE 5 4.611 17.697 -13.784 38 HG23 ILE 5 HG23 ILE 5 3.381 17.788 -12.522 39 HD11 ILE 5 HD11 ILE 5 4.191 20.842 -11.170 40 HD12 ILE 5 HD12 ILE 5 3.418 19.778 -12.342 41 HD13 ILE 5 HD13 ILE 5 4.273 21.217 -12.888 42 H GLN 6 HN GLN 6 6.525 16.249 -9.827 43 HA GLN 6 HA GLN 6 4.846 13.986 -10.134 44 HB2 GLN 6 HB2 GLN 6 7.486 14.361 -8.716 45 HB3 GLN 6 HB1 GLN 6 6.678 12.800 -8.839 46 HG2 GLN 6 HG2 GLN 6 6.775 12.862 -11.253 47 HG3 GLN 6 HG1 GLN 6 7.368 14.520 -11.239 48 HE21 GLN 6 HE21 GLN 6 8.725 12.094 -12.356 49 HE22 GLN 6 HE22 GLN 6 10.209 11.990 -11.538 50 H GLU 7 HN GLU 7 5.770 15.927 -7.327 51 HA GLU 7 HA GLU 7 4.629 14.291 -5.334 52 HB2 GLU 7 HB2 GLU 7 6.176 16.161 -4.856 53 HB3 GLU 7 HB1 GLU 7 4.930 17.305 -5.354 54 HG2 GLU 7 HG2 GLU 7 3.450 16.516 -3.566 55 HG3 GLU 7 HG1 GLU 7 4.641 15.305 -3.094 56 H LYS 8 HN LYS 8 3.279 16.930 -7.279 57 HA LYS 8 HA LYS 8 0.763 17.091 -6.021 58 HB2 LYS 8 HB2 LYS 8 1.681 18.739 -7.644 59 HB3 LYS 8 HB1 LYS 8 1.400 17.582 -8.946 60 HG2 LYS 8 HG2 LYS 8 -1.045 17.523 -8.182 61 HG3 LYS 8 HG1 LYS 8 -0.665 18.914 -7.173 62 HD2 LYS 8 HD2 LYS 8 -0.266 18.802 -10.177 63 HD3 LYS 8 HD1 LYS 8 -1.640 19.559 -9.376 64 HE2 LYS 8 HE2 LYS 8 1.271 20.379 -9.121 65 HE3 LYS 8 HE1 LYS 8 -0.009 21.270 -9.929 66 HZ1 LYS 8 HZ1 LYS 8 -1.105 20.947 -7.541 67 HZ2 LYS 8 HZ2 LYS 8 -0.146 22.290 -7.949 68 HZ3 LYS 8 HZ3 LYS 8 0.530 20.988 -7.090 69 H GLU 9 HN GLU 9 1.915 15.136 -8.747 70 HA GLU 9 HA GLU 9 -0.567 13.909 -9.350 71 HB2 GLU 9 HB2 GLU 9 2.282 13.028 -9.843 72 HB3 GLU 9 HB1 GLU 9 0.882 12.129 -10.425 73 HG2 GLU 9 HG2 GLU 9 1.356 15.058 -11.047 74 HG3 GLU 9 HG1 GLU 9 1.856 13.744 -12.106 75 H GLN 10 HN GLN 10 2.056 13.041 -7.146 76 HA GLN 10 HA GLN 10 1.120 10.479 -6.426 77 HB2 GLN 10 HB2 GLN 10 3.391 11.343 -5.906 78 HB3 GLN 10 HB1 GLN 10 2.678 12.437 -4.720 79 HG2 GLN 10 HG2 GLN 10 1.793 10.541 -3.454 80 HG3 GLN 10 HG1 GLN 10 2.410 9.418 -4.665 81 HE21 GLN 10 HE21 GLN 10 3.389 8.878 -2.214 82 HE22 GLN 10 HE22 GLN 10 4.972 9.458 -2.016 83 H GLU 11 HN GLU 11 0.431 13.700 -5.131 84 HA GLU 11 HA GLU 11 -1.059 12.900 -2.878 85 HB2 GLU 11 HB2 GLU 11 -1.141 15.409 -4.559 86 HB3 GLU 11 HB1 GLU 11 -2.081 15.207 -3.081 87 HG2 GLU 11 HG2 GLU 11 -0.069 14.876 -1.773 88 HG3 GLU 11 HG1 GLU 11 0.925 14.865 -3.227 89 H LEU 12 HN LEU 12 -2.010 13.486 -6.240 90 HA LEU 12 HA LEU 12 -4.807 12.791 -5.620 91 HB2 LEU 12 HB2 LEU 12 -3.549 13.748 -8.205 92 HB3 LEU 12 HB1 LEU 12 -5.271 13.521 -7.913 93 HG LEU 12 HG LEU 12 -3.485 15.448 -6.394 94 HD11 LEU 12 HD11 LEU 12 -3.998 15.984 -8.831 95 HD12 LEU 12 HD12 LEU 12 -4.514 17.197 -7.661 96 HD13 LEU 12 HD13 LEU 12 -5.693 16.088 -8.360 97 HD21 LEU 12 HD21 LEU 12 -6.387 14.654 -6.172 98 HD22 LEU 12 HD22 LEU 12 -5.906 16.304 -5.768 99 HD23 LEU 12 HD23 LEU 12 -5.211 14.947 -4.888 100 H LYS 13 HN LYS 13 -5.804 10.985 -6.381 101 HA LYS 13 HA LYS 13 -4.136 8.760 -7.112 102 HB2 LYS 13 HB2 LYS 13 -7.133 9.067 -6.860 103 HB3 LYS 13 HB1 LYS 13 -6.339 7.547 -7.267 104 HG2 LYS 13 HG2 LYS 13 -5.049 7.651 -5.166 105 HG3 LYS 13 HG1 LYS 13 -5.844 9.168 -4.751 106 HD2 LYS 13 HD2 LYS 13 -8.038 8.023 -4.789 107 HD3 LYS 13 HD1 LYS 13 -7.227 6.504 -5.169 108 HE2 LYS 13 HE2 LYS 13 -6.722 8.164 -2.682 109 HE3 LYS 13 HE1 LYS 13 -7.722 6.711 -2.742 110 HZ1 LYS 13 HZ1 LYS 13 -5.491 5.825 -3.880 111 HZ2 LYS 13 HZ2 LYS 13 -5.791 5.720 -2.212 112 HZ3 LYS 13 HZ3 LYS 13 -4.832 6.980 -2.828 113 H ASN 14 HN ASN 14 -3.945 7.739 -9.068 114 HA ASN 14 HA ASN 14 -5.598 8.283 -11.315 115 HB2 ASN 14 HB2 ASN 14 -4.161 10.420 -11.029 116 HB3 ASN 14 HB1 ASN 14 -2.825 9.432 -11.613 117 HD21 ASN 14 HD21 ASN 14 -2.621 10.448 -13.692 118 HD22 ASN 14 HD22 ASN 14 -3.840 10.368 -14.870 119 H LEU 15 HN LEU 15 -3.686 7.828 -13.368 120 HA LEU 15 HA LEU 15 -2.636 6.110 -14.455 121 HB2 LEU 15 HB2 LEU 15 -1.641 5.353 -11.700 122 HB3 LEU 15 HB1 LEU 15 -0.940 4.874 -13.241 123 HG LEU 15 HG LEU 15 -1.173 7.726 -12.235 124 HD11 LEU 15 HD11 LEU 15 1.231 5.893 -12.508 125 HD12 LEU 15 HD12 LEU 15 0.487 6.395 -10.989 126 HD13 LEU 15 HD13 LEU 15 1.283 7.586 -12.019 127 HD21 LEU 15 HD21 LEU 15 -0.185 6.484 -14.803 128 HD22 LEU 15 HD22 LEU 15 0.533 7.988 -14.224 129 HD23 LEU 15 HD23 LEU 15 -1.191 7.915 -14.578 130 H LYS 16 HN LYS 16 -5.353 5.733 -13.277 131 HA LYS 16 HA LYS 16 -5.566 2.920 -13.852 132 HB2 LYS 16 HB2 LYS 16 -6.561 2.256 -11.711 133 HB3 LYS 16 HB1 LYS 16 -4.903 2.815 -11.484 134 HG2 LYS 16 HG2 LYS 16 -5.754 5.040 -10.810 135 HG3 LYS 16 HG1 LYS 16 -7.408 4.462 -11.007 136 HD2 LYS 16 HD2 LYS 16 -7.016 2.728 -9.300 137 HD3 LYS 16 HD1 LYS 16 -5.361 3.305 -9.096 138 HE2 LYS 16 HE2 LYS 16 -6.207 5.509 -8.398 139 HE3 LYS 16 HE1 LYS 16 -7.864 4.945 -8.606 140 HZ1 LYS 16 HZ1 LYS 16 -7.506 4.602 -6.375 141 HZ2 LYS 16 HZ2 LYS 16 -5.878 4.165 -6.580 142 HZ3 LYS 16 HZ3 LYS 16 -7.112 3.079 -7.008 143 H ASP 17 HN ASP 17 -6.712 5.979 -13.896 144 HA ASP 17 HA ASP 17 -9.493 5.704 -13.509 145 HB2 ASP 17 HB2 ASP 17 -7.861 7.601 -15.199 146 HB3 ASP 17 HB1 ASP 17 -9.612 7.723 -15.048 147 H ASN 18 HN ASN 18 -11.164 5.227 -14.895 148 HA ASN 18 HA ASN 18 -10.707 3.311 -16.910 149 HB2 ASN 18 HB2 ASN 18 -13.123 4.983 -16.221 150 HB3 ASN 18 HB1 ASN 18 -13.142 3.748 -17.477 151 HD21 ASN 18 HD21 ASN 18 -14.742 3.561 -15.071 152 HD22 ASN 18 HD22 ASN 18 -14.175 2.230 -14.182 153 H VAL 19 HN VAL 19 -11.294 6.798 -17.072 154 HA VAL 19 HA VAL 19 -11.556 6.932 -19.898 155 HB VAL 19 HB VAL 19 -10.978 9.378 -19.532 156 HG11 VAL 19 HG11 VAL 19 -13.130 8.304 -17.685 157 HG12 VAL 19 HG12 VAL 19 -13.313 8.393 -19.437 158 HG13 VAL 19 HG13 VAL 19 -13.097 9.869 -18.497 159 HG21 VAL 19 HG21 VAL 19 -10.682 10.184 -17.306 160 HG22 VAL 19 HG22 VAL 19 -9.583 8.814 -17.461 161 HG23 VAL 19 HG23 VAL 19 -11.115 8.625 -16.608 162 H GLU 20 HN GLU 20 -8.809 6.867 -17.737 163 HA GLU 20 HA GLU 20 -6.849 7.864 -19.511 164 HB2 GLU 20 HB2 GLU 20 -6.471 7.573 -17.084 165 HB3 GLU 20 HB1 GLU 20 -6.524 5.823 -17.294 166 HG2 GLU 20 HG2 GLU 20 -4.583 5.916 -18.789 167 HG3 GLU 20 HG1 GLU 20 -4.550 7.675 -18.666 168 H LEU 21 HN LEU 21 -8.106 4.600 -18.936 169 HA LEU 21 HA LEU 21 -6.310 3.239 -20.652 170 HB2 LEU 21 HB2 LEU 21 -9.103 2.564 -19.717 171 HB3 LEU 21 HB1 LEU 21 -8.136 1.474 -20.703 172 HG LEU 21 HG LEU 21 -7.211 2.597 -18.036 173 HD11 LEU 21 HD11 LEU 21 -7.806 0.429 -17.083 174 HD12 LEU 21 HD12 LEU 21 -8.389 -0.128 -18.651 175 HD13 LEU 21 HD13 LEU 21 -9.234 1.168 -17.806 176 HD21 LEU 21 HD21 LEU 21 -6.093 0.632 -20.031 177 HD22 LEU 21 HD22 LEU 21 -5.751 0.395 -18.320 178 HD23 LEU 21 HD23 LEU 21 -5.261 1.886 -19.113 179 H GLU 22 HN GLU 22 -9.444 4.774 -21.208 180 HA GLU 22 HA GLU 22 -9.840 3.887 -23.855 181 HB2 GLU 22 HB2 GLU 22 -11.601 4.952 -22.485 182 HB3 GLU 22 HB1 GLU 22 -10.736 6.486 -22.585 183 HG2 GLU 22 HG2 GLU 22 -10.975 6.494 -25.024 184 HG3 GLU 22 HG1 GLU 22 -11.770 4.923 -24.968 185 H ARG 23 HN ARG 23 -8.185 6.735 -22.545 186 HA ARG 23 HA ARG 23 -7.622 8.004 -24.989 187 HB2 ARG 23 HB2 ARG 23 -7.362 9.041 -22.723 188 HB3 ARG 23 HB1 ARG 23 -5.948 8.027 -22.461 189 HG2 ARG 23 HG2 ARG 23 -4.995 10.034 -23.210 190 HG3 ARG 23 HG1 ARG 23 -5.070 9.090 -24.690 191 HD2 ARG 23 HD2 ARG 23 -5.889 11.352 -25.109 192 HD3 ARG 23 HD1 ARG 23 -7.217 10.215 -25.272 193 HE ARG 23 HE ARG 23 -7.089 11.207 -22.607 194 HH11 ARG 23 HH11 ARG 23 -8.636 12.750 -21.984 195 HH12 ARG 23 HH12 ARG 23 -9.507 13.632 -23.193 196 HH21 ARG 23 HH21 ARG 23 -7.922 12.070 -25.853 197 HH22 ARG 23 HH22 ARG 23 -9.102 13.247 -25.384 198 H LEU 24 HN LEU 24 -5.811 5.590 -23.128 199 HA LEU 24 HA LEU 24 -3.512 5.520 -24.745 200 HB2 LEU 24 HB2 LEU 24 -3.598 4.499 -22.516 201 HB3 LEU 24 HB1 LEU 24 -4.768 3.316 -23.089 202 HG LEU 24 HG LEU 24 -3.098 2.438 -24.693 203 HD11 LEU 24 HD11 LEU 24 -1.471 4.716 -23.575 204 HD12 LEU 24 HD12 LEU 24 -1.670 4.211 -25.253 205 HD13 LEU 24 HD13 LEU 24 -0.657 3.266 -24.167 206 HD21 LEU 24 HD21 LEU 24 -3.279 1.560 -22.346 207 HD22 LEU 24 HD22 LEU 24 -1.963 2.642 -21.888 208 HD23 LEU 24 HD23 LEU 24 -1.678 1.348 -23.053 209 H LYS 25 HN LYS 25 -6.526 3.640 -24.882 210 HA LYS 25 HA LYS 25 -5.809 1.925 -26.990 211 HB2 LYS 25 HB2 LYS 25 -7.781 1.549 -25.598 212 HB3 LYS 25 HB1 LYS 25 -8.531 3.013 -26.229 213 HG2 LYS 25 HG2 LYS 25 -8.531 2.048 -28.498 214 HG3 LYS 25 HG1 LYS 25 -7.749 0.592 -27.880 215 HD2 LYS 25 HD2 LYS 25 -9.663 0.060 -26.518 216 HD3 LYS 25 HD1 LYS 25 -10.412 1.619 -26.872 217 HE2 LYS 25 HE2 LYS 25 -11.430 -0.097 -28.275 218 HE3 LYS 25 HE1 LYS 25 -10.482 1.005 -29.275 219 HZ1 LYS 25 HZ1 LYS 25 -9.112 -1.337 -28.207 220 HZ2 LYS 25 HZ2 LYS 25 -8.928 -0.560 -29.707 221 HZ3 LYS 25 HZ3 LYS 25 -10.238 -1.609 -29.445 222 H ASN 26 HN ASN 26 -7.482 5.070 -27.059 223 HA ASN 26 HA ASN 26 -7.487 5.137 -29.958 224 HB2 ASN 26 HB2 ASN 26 -9.334 6.130 -28.646 225 HB3 ASN 26 HB1 ASN 26 -8.203 7.289 -27.952 226 HD21 ASN 26 HD21 ASN 26 -8.305 9.268 -29.005 227 HD22 ASN 26 HD22 ASN 26 -8.619 9.478 -30.659 228 H GLU 27 HN GLU 27 -5.580 5.438 -30.931 229 HA GLU 27 HA GLU 27 -3.697 7.458 -29.840 230 HB2 GLU 27 HB2 GLU 27 -2.816 5.158 -29.959 231 HB3 GLU 27 HB1 GLU 27 -3.168 5.115 -31.685 232 HG2 GLU 27 HG2 GLU 27 -1.621 6.956 -32.086 233 HG3 GLU 27 HG1 GLU 27 -1.322 7.119 -30.355 234 H ARG 28 HN ARG 28 -3.390 9.261 -30.965 235 HA ARG 28 HA ARG 28 -3.543 10.832 -32.628 236 HB2 ARG 28 HB2 ARG 28 -2.911 8.364 -34.248 237 HB3 ARG 28 HB1 ARG 28 -2.949 9.991 -34.931 238 HG2 ARG 28 HG2 ARG 28 -1.199 10.731 -33.435 239 HG3 ARG 28 HG1 ARG 28 -1.242 9.204 -32.554 240 HD2 ARG 28 HD2 ARG 28 0.641 9.204 -34.115 241 HD3 ARG 28 HD1 ARG 28 -0.555 8.015 -34.623 242 HE ARG 28 HE ARG 28 -1.023 10.531 -35.887 243 HH11 ARG 28 HH11 ARG 28 -0.495 10.699 -38.089 244 HH12 ARG 28 HH12 ARG 28 0.574 9.540 -38.808 245 HH21 ARG 28 HH21 ARG 28 1.030 7.745 -35.875 246 HH22 ARG 28 HH22 ARG 28 1.437 7.869 -37.555 247 H HIS 29 HN HIS 29 -6.026 10.095 -31.761 248 HA HIS 29 HA HIS 29 -8.251 10.111 -32.349 249 HB2 HIS 29 HB2 HIS 29 -7.138 11.316 -34.894 250 HB3 HIS 29 HB1 HIS 29 -8.819 11.389 -34.368 251 HD2 HIS 29 HD2 HIS 29 -5.624 13.424 -33.947 252 HE1 HIS 29 HE1 HIS 29 -8.159 14.604 -30.783 253 HE2 HIS 29 HE2 HIS 29 -6.025 15.164 -32.040 254 H ASP 30 HN ASP 30 -7.070 7.650 -32.683 255 HA ASP 30 HA ASP 30 -7.336 6.487 -35.232 256 HB2 ASP 30 HB2 ASP 30 -6.153 5.470 -33.275 257 HB3 ASP 30 HB1 ASP 30 -7.728 5.116 -32.566 258 H HIS 31 HN HIS 31 -9.661 6.901 -32.592 259 HA HIS 31 HA HIS 31 -11.937 6.661 -32.494 260 HB2 HIS 31 HB2 HIS 31 -11.736 7.003 -35.493 261 HB3 HIS 31 HB1 HIS 31 -13.216 7.125 -34.543 262 HD2 HIS 31 HD2 HIS 31 -10.648 9.500 -35.883 263 HE1 HIS 31 HE1 HIS 31 -12.096 11.359 -32.380 264 HE2 HIS 31 HE2 HIS 31 -10.747 11.713 -34.502 265 H ASP 32 HN ASP 32 -10.574 4.265 -32.385 266 HA ASP 32 HA ASP 32 -11.398 2.307 -34.238 267 HB2 ASP 32 HB2 ASP 32 -10.616 2.140 -31.326 268 HB3 ASP 32 HB1 ASP 32 -11.007 0.715 -32.285 269 H GLU 33 HN GLU 33 -13.103 0.862 -34.243 270 HA GLU 33 HA GLU 33 -15.617 1.835 -33.398 271 HB2 GLU 33 HB2 GLU 33 -14.732 -0.882 -34.374 272 HB3 GLU 33 HB1 GLU 33 -16.412 -0.504 -33.991 273 HG2 GLU 33 HG2 GLU 33 -16.471 1.241 -35.663 274 HG3 GLU 33 HG1 GLU 33 -14.741 1.094 -35.953 275 H GLU 34 HN GLU 34 -13.401 -0.532 -32.005 276 HA GLU 34 HA GLU 34 -15.123 -1.525 -30.001 277 HB2 GLU 34 HB2 GLU 34 -12.114 -1.331 -30.150 278 HB3 GLU 34 HB1 GLU 34 -12.954 -2.095 -28.802 279 HG2 GLU 34 HG2 GLU 34 -13.974 -3.721 -30.271 280 HG3 GLU 34 HG1 GLU 34 -13.368 -2.890 -31.700 281 H ALA 35 HN ALA 35 -12.944 1.261 -30.077 282 HA ALA 35 HA ALA 35 -13.122 1.968 -27.356 283 HB1 ALA 35 HB1 ALA 35 -12.597 4.313 -28.255 284 HB2 ALA 35 HB2 ALA 35 -12.588 3.571 -29.855 285 HB3 ALA 35 HB3 ALA 35 -11.436 3.040 -28.630 286 H GLU 36 HN GLU 36 -15.151 2.776 -30.140 287 HA GLU 36 HA GLU 36 -16.806 4.675 -28.875 288 HB2 GLU 36 HB2 GLU 36 -16.732 4.329 -31.323 289 HB3 GLU 36 HB1 GLU 36 -17.505 2.759 -31.115 290 HG2 GLU 36 HG2 GLU 36 -19.480 3.829 -30.137 291 HG3 GLU 36 HG1 GLU 36 -18.704 5.407 -30.254 292 H ARG 37 HN ARG 37 -17.047 1.150 -29.159 293 HA ARG 37 HA ARG 37 -19.587 0.882 -27.937 294 HB2 ARG 37 HB2 ARG 37 -17.264 -1.034 -28.196 295 HB3 ARG 37 HB1 ARG 37 -18.801 -1.484 -27.459 296 HG2 ARG 37 HG2 ARG 37 -19.996 -0.981 -29.514 297 HG3 ARG 37 HG1 ARG 37 -18.529 -0.354 -30.263 298 HD2 ARG 37 HD2 ARG 37 -18.931 -2.639 -31.031 299 HD3 ARG 37 HD1 ARG 37 -17.479 -2.591 -30.035 300 HE ARG 37 HE ARG 37 -19.774 -3.196 -28.451 301 HH11 ARG 37 HH11 ARG 37 -20.005 -5.339 -27.734 302 HH12 ARG 37 HH12 ARG 37 -19.118 -6.607 -28.514 303 HH21 ARG 37 HH21 ARG 37 -17.565 -4.490 -30.779 304 HH22 ARG 37 HH22 ARG 37 -17.737 -6.126 -30.238 305 H LYS 38 HN LYS 38 -16.303 0.951 -26.625 306 HA LYS 38 HA LYS 38 -16.944 0.251 -23.967 307 HB2 LYS 38 HB2 LYS 38 -14.697 1.912 -25.123 308 HB3 LYS 38 HB1 LYS 38 -14.796 1.463 -23.419 309 HG2 LYS 38 HG2 LYS 38 -14.844 -0.922 -24.042 310 HG3 LYS 38 HG1 LYS 38 -14.745 -0.480 -25.747 311 HD2 LYS 38 HD2 LYS 38 -12.574 0.630 -25.329 312 HD3 LYS 38 HD1 LYS 38 -12.666 0.156 -23.632 313 HE2 LYS 38 HE2 LYS 38 -12.660 -1.772 -25.973 314 HE3 LYS 38 HE1 LYS 38 -11.263 -1.410 -24.960 315 HZ1 LYS 38 HZ1 LYS 38 -13.207 -2.007 -23.166 316 HZ2 LYS 38 HZ2 LYS 38 -11.988 -3.069 -23.689 317 HZ3 LYS 38 HZ3 LYS 38 -13.520 -3.100 -24.425 318 H ALA 39 HN ALA 39 -16.878 3.363 -25.649 319 HA ALA 39 HA ALA 39 -17.275 5.026 -23.413 320 HB1 ALA 39 HB1 ALA 39 -16.607 5.948 -25.559 321 HB2 ALA 39 HB2 ALA 39 -18.140 6.669 -25.073 322 HB3 ALA 39 HB3 ALA 39 -18.112 5.401 -26.298 323 H LEU 40 HN LEU 40 -19.553 3.332 -25.523 324 HA LEU 40 HA LEU 40 -21.922 4.468 -24.465 325 HB2 LEU 40 HB2 LEU 40 -21.397 1.833 -25.849 326 HB3 LEU 40 HB1 LEU 40 -23.010 2.365 -25.385 327 HG LEU 40 HG LEU 40 -21.147 3.986 -27.155 328 HD11 LEU 40 HD11 LEU 40 -23.457 2.184 -27.935 329 HD12 LEU 40 HD12 LEU 40 -21.751 1.834 -28.214 330 HD13 LEU 40 HD13 LEU 40 -22.519 3.195 -29.034 331 HD21 LEU 40 HD21 LEU 40 -22.720 5.518 -26.349 332 HD22 LEU 40 HD22 LEU 40 -23.985 4.301 -26.183 333 HD23 LEU 40 HD23 LEU 40 -23.556 4.918 -27.777 334 H GLU 41 HN GLU 41 -20.012 1.641 -23.555 335 HA GLU 41 HA GLU 41 -21.809 0.615 -21.621 336 HB2 GLU 41 HB2 GLU 41 -18.818 0.344 -21.944 337 HB3 GLU 41 HB1 GLU 41 -19.722 -0.483 -20.677 338 HG2 GLU 41 HG2 GLU 41 -21.063 -1.662 -22.307 339 HG3 GLU 41 HG1 GLU 41 -20.378 -0.721 -23.629 340 H ASP 42 HN ASP 42 -19.186 2.975 -21.435 341 HA ASP 42 HA ASP 42 -19.119 3.270 -18.636 342 HB2 ASP 42 HB2 ASP 42 -17.393 4.167 -20.171 343 HB3 ASP 42 HB1 ASP 42 -18.551 5.363 -20.749 344 H LYS 43 HN LYS 43 -21.020 4.939 -21.125 345 HA LYS 43 HA LYS 43 -22.265 6.823 -19.446 346 HB2 LYS 43 HB2 LYS 43 -22.329 6.968 -21.902 347 HB3 LYS 43 HB1 LYS 43 -23.337 5.522 -21.956 348 HG2 LYS 43 HG2 LYS 43 -25.135 6.626 -20.807 349 HG3 LYS 43 HG1 LYS 43 -24.115 8.007 -20.415 350 HD2 LYS 43 HD2 LYS 43 -25.495 8.681 -22.258 351 HD3 LYS 43 HD1 LYS 43 -23.882 8.409 -22.913 352 HE2 LYS 43 HE2 LYS 43 -24.532 6.237 -23.772 353 HE3 LYS 43 HE1 LYS 43 -26.094 6.335 -22.960 354 HZ1 LYS 43 HZ1 LYS 43 -26.548 6.980 -25.123 355 HZ2 LYS 43 HZ2 LYS 43 -25.109 7.870 -25.278 356 HZ3 LYS 43 HZ3 LYS 43 -26.378 8.466 -24.321 357 H LEU 44 HN LEU 44 -23.243 3.541 -20.397 358 HA LEU 44 HA LEU 44 -25.737 3.522 -19.097 359 HB2 LEU 44 HB2 LEU 44 -25.094 1.826 -20.748 360 HB3 LEU 44 HB1 LEU 44 -23.843 1.225 -19.663 361 HG LEU 44 HG LEU 44 -25.574 0.613 -18.002 362 HD11 LEU 44 HD11 LEU 44 -28.000 0.615 -19.024 363 HD12 LEU 44 HD12 LEU 44 -27.373 1.905 -20.050 364 HD13 LEU 44 HD13 LEU 44 -27.372 2.091 -18.296 365 HD21 LEU 44 HD21 LEU 44 -24.864 -1.025 -19.709 366 HD22 LEU 44 HD22 LEU 44 -26.126 -0.441 -20.794 367 HD23 LEU 44 HD23 LEU 44 -26.562 -1.247 -19.287 368 H ALA 45 HN ALA 45 -22.506 2.552 -17.982 369 HA ALA 45 HA ALA 45 -23.270 1.610 -15.440 370 HB1 ALA 45 HB1 ALA 45 -20.637 2.973 -15.981 371 HB2 ALA 45 HB2 ALA 45 -21.005 1.387 -16.659 372 HB3 ALA 45 HB3 ALA 45 -20.976 1.612 -14.911 373 H ASP 46 HN ASP 46 -22.385 4.835 -16.591 374 HA ASP 46 HA ASP 46 -22.545 6.915 -15.617 375 HB2 ASP 46 HB2 ASP 46 -24.953 6.147 -15.635 376 HB3 ASP 46 HB1 ASP 46 -24.733 5.662 -13.954 377 H LYS 47 HN LYS 47 -20.611 5.137 -14.455 378 HA LYS 47 HA LYS 47 -20.769 5.647 -11.557 379 HB2 LYS 47 HB2 LYS 47 -18.739 4.075 -13.165 380 HB3 LYS 47 HB1 LYS 47 -18.816 4.168 -11.409 381 HG2 LYS 47 HG2 LYS 47 -21.087 3.113 -13.119 382 HG3 LYS 47 HG1 LYS 47 -19.852 2.081 -12.407 383 HD2 LYS 47 HD2 LYS 47 -20.493 3.094 -10.150 384 HD3 LYS 47 HD1 LYS 47 -21.896 3.784 -10.965 385 HE2 LYS 47 HE2 LYS 47 -21.211 0.836 -10.945 386 HE3 LYS 47 HE1 LYS 47 -22.410 1.597 -9.899 387 HZ1 LYS 47 HZ1 LYS 47 -23.198 2.498 -12.265 388 HZ2 LYS 47 HZ2 LYS 47 -23.774 1.051 -11.587 389 HZ3 LYS 47 HZ3 LYS 47 -22.530 1.013 -12.744 390 H GLN 48 HN GLN 48 -19.782 7.263 -14.232 391 HA GLN 48 HA GLN 48 -17.198 8.190 -13.536 392 HB2 GLN 48 HB2 GLN 48 -19.391 9.414 -15.223 393 HB3 GLN 48 HB1 GLN 48 -17.804 10.154 -15.031 394 HG2 GLN 48 HG2 GLN 48 -18.284 7.350 -16.092 395 HG3 GLN 48 HG1 GLN 48 -17.959 8.762 -17.090 396 HE21 GLN 48 HE21 GLN 48 -15.840 10.015 -16.192 397 HE22 GLN 48 HE22 GLN 48 -14.516 8.996 -15.891 398 H GLU 49 HN GLU 49 -20.443 9.349 -12.744 399 HA GLU 49 HA GLU 49 -19.408 10.711 -10.417 400 HB2 GLU 49 HB2 GLU 49 -20.228 12.944 -11.026 401 HB3 GLU 49 HB1 GLU 49 -19.030 12.395 -12.194 402 HG2 GLU 49 HG2 GLU 49 -20.871 11.648 -13.694 403 HG3 GLU 49 HG1 GLU 49 -22.041 12.295 -12.546 404 H HIS 50 HN HIS 50 -21.383 11.842 -9.207 405 HA HIS 50 HA HIS 50 -23.990 10.808 -9.935 406 HB2 HIS 50 HB2 HIS 50 -24.316 9.513 -7.898 407 HB3 HIS 50 HB1 HIS 50 -22.929 8.878 -8.781 408 HD2 HIS 50 HD2 HIS 50 -23.725 10.414 -5.324 409 HE1 HIS 50 HE1 HIS 50 -19.520 10.165 -5.611 410 HE2 HIS 50 HE2 HIS 50 -21.462 10.614 -4.036 411 H LEU 51 HN LEU 51 -25.668 11.556 -8.401 412 HA LEU 51 HA LEU 51 -24.941 14.190 -7.274 413 HB2 LEU 51 HB2 LEU 51 -26.711 14.166 -8.985 414 HB3 LEU 51 HB1 LEU 51 -27.636 13.018 -8.021 415 HG LEU 51 HG LEU 51 -27.789 14.690 -6.192 416 HD11 LEU 51 HD11 LEU 51 -25.913 16.087 -6.358 417 HD12 LEU 51 HD12 LEU 51 -27.179 17.118 -7.013 418 HD13 LEU 51 HD13 LEU 51 -26.077 16.274 -8.103 419 HD21 LEU 51 HD21 LEU 51 -29.363 16.187 -7.327 420 HD22 LEU 51 HD22 LEU 51 -29.532 14.550 -7.960 421 HD23 LEU 51 HD23 LEU 51 -28.661 15.769 -8.890 422 H ASP 52 HN ASP 52 -24.683 14.292 -5.134 423 HA ASP 52 HA ASP 52 -25.629 12.157 -3.402 424 HB2 ASP 52 HB2 ASP 52 -23.397 13.235 -3.132 425 HB3 ASP 52 HB1 ASP 52 -24.212 14.732 -2.687 426 H GLY 53 HN GLY 53 -27.990 12.979 -4.212 427 HA2 GLY 53 HA2 GLY 53 -29.067 15.344 -3.135 428 HA3 GLY 53 HA1 GLY 53 -29.997 13.921 -3.597 429 H ALA 54 HN ALA 54 -28.764 12.063 -1.772 430 HA ALA 54 HA ALA 54 -29.118 11.261 0.350 431 HB1 ALA 54 HB1 ALA 54 -28.303 12.601 2.129 432 HB2 ALA 54 HB2 ALA 54 -28.690 14.098 1.282 433 HB3 ALA 54 HB3 ALA 54 -27.362 13.083 0.718 434 H LEU 55 HN LEU 55 -31.395 12.428 -1.193 435 HA LEU 55 HA LEU 55 -33.155 13.813 0.513 436 HB2 LEU 55 HB2 LEU 55 -33.508 13.658 -1.910 437 HB3 LEU 55 HB1 LEU 55 -33.776 11.923 -1.772 438 HG LEU 55 HG LEU 55 -35.755 12.340 -0.345 439 HD11 LEU 55 HD11 LEU 55 -36.560 14.844 -0.439 440 HD12 LEU 55 HD12 LEU 55 -34.848 15.196 -0.672 441 HD13 LEU 55 HD13 LEU 55 -35.389 14.362 0.784 442 HD21 LEU 55 HD21 LEU 55 -35.895 14.017 -2.863 443 HD22 LEU 55 HD22 LEU 55 -37.202 13.108 -2.105 444 HD23 LEU 55 HD23 LEU 55 -35.869 12.253 -2.879 445 H ARG 56 HN ARG 56 -32.715 10.345 -0.101 446 HA ARG 56 HA ARG 56 -34.814 9.405 1.532 447 HB2 ARG 56 HB2 ARG 56 -32.186 8.166 0.700 448 HB3 ARG 56 HB1 ARG 56 -33.427 7.291 1.596 449 HG2 ARG 56 HG2 ARG 56 -35.056 7.895 -0.238 450 HG3 ARG 56 HG1 ARG 56 -33.685 8.526 -1.156 451 HD2 ARG 56 HD2 ARG 56 -33.849 5.707 -0.076 452 HD3 ARG 56 HD1 ARG 56 -34.270 6.153 -1.727 453 HE ARG 56 HE ARG 56 -31.589 6.021 -0.583 454 HH11 ARG 56 HH11 ARG 56 -29.905 6.244 -2.090 455 HH12 ARG 56 HH12 ARG 56 -30.253 6.788 -3.697 456 HH21 ARG 56 HH21 ARG 56 -33.660 7.106 -3.136 457 HH22 ARG 56 HH22 ARG 56 -32.379 7.276 -4.289 458 H TYR 57 HN TYR 57 -31.419 10.106 2.199 459 HA TYR 57 HA TYR 57 -31.231 9.126 4.803 460 HB2 TYR 57 HB2 TYR 57 -29.273 9.903 3.588 461 HB3 TYR 57 HB1 TYR 57 -29.900 11.552 3.571 462 HD1 TYR 57 HD1 TYR 57 -28.797 8.803 5.842 463 HD2 TYR 57 HD2 TYR 57 -29.543 13.012 5.408 464 HE1 TYR 57 HE1 TYR 57 -27.767 9.216 8.060 465 HE2 TYR 57 HE2 TYR 57 -28.513 13.424 7.625 466 HH TYR 57 HH TYR 57 -28.062 11.174 9.887 Start of MODEL 6 1 H1 GLY 1 HT1 GLY 1 -36.166 44.113 -21.469 2 H2 GLY 1 HT2 GLY 1 -34.681 43.546 -22.070 3 H3 GLY 1 HT3 GLY 1 -35.935 42.452 -21.724 4 HA2 GLY 1 HA2 GLY 1 -36.922 42.753 -23.683 5 HA3 GLY 1 HA1 GLY 1 -36.711 44.502 -23.581 6 H SER 2 HN SER 2 -35.123 45.446 -24.749 7 HA SER 2 HA SER 2 -33.768 43.997 -26.762 8 HB2 SER 2 HB2 SER 2 -32.624 46.098 -27.237 9 HB3 SER 2 HB1 SER 2 -34.330 46.404 -26.928 10 HG SER 2 HG SER 2 -32.163 47.311 -25.618 11 H LYS 3 HN LYS 3 -32.983 44.705 -23.473 12 HA LYS 3 HA LYS 3 -30.152 44.418 -23.650 13 HB2 LYS 3 HB2 LYS 3 -32.076 44.130 -21.336 14 HB3 LYS 3 HB1 LYS 3 -30.322 44.050 -21.167 15 HG2 LYS 3 HG2 LYS 3 -30.123 46.307 -22.149 16 HG3 LYS 3 HG1 LYS 3 -31.877 46.389 -22.313 17 HD2 LYS 3 HD2 LYS 3 -32.113 46.136 -19.862 18 HD3 LYS 3 HD1 LYS 3 -30.356 46.091 -19.705 19 HE2 LYS 3 HE2 LYS 3 -31.932 48.398 -20.886 20 HE3 LYS 3 HE1 LYS 3 -31.269 48.358 -19.253 21 HZ1 LYS 3 HZ1 LYS 3 -29.063 48.141 -20.165 22 HZ2 LYS 3 HZ2 LYS 3 -29.815 49.516 -20.822 23 HZ3 LYS 3 HZ3 LYS 3 -29.675 48.095 -21.745 24 H THR 4 HN THR 4 -32.779 42.193 -23.624 25 HA THR 4 HA THR 4 -31.547 39.913 -22.532 26 HB THR 4 HB THR 4 -33.687 40.105 -24.662 27 HG1 THR 4 HG1 THR 4 -34.511 41.003 -22.888 28 HG21 THR 4 HG21 THR 4 -32.665 37.824 -22.962 29 HG22 THR 4 HG22 THR 4 -32.822 37.884 -24.718 30 HG23 THR 4 HG23 THR 4 -34.264 37.804 -23.705 31 H ILE 5 HN ILE 5 -31.617 41.154 -25.855 32 HA ILE 5 HA ILE 5 -30.519 39.023 -27.212 33 HB ILE 5 HB ILE 5 -31.322 41.308 -28.106 34 HG12 ILE 5 HG12 ILE 5 -29.762 41.114 -30.102 35 HG13 ILE 5 HG11 ILE 5 -28.865 39.899 -29.197 36 HG21 ILE 5 HG21 ILE 5 -29.758 43.055 -28.353 37 HG22 ILE 5 HG22 ILE 5 -28.391 42.011 -27.961 38 HG23 ILE 5 HG23 ILE 5 -29.513 42.505 -26.695 39 HD11 ILE 5 HD11 ILE 5 -31.828 39.508 -29.448 40 HD12 ILE 5 HD12 ILE 5 -30.532 38.312 -29.408 41 HD13 ILE 5 HD13 ILE 5 -30.837 39.231 -30.878 42 H GLN 6 HN GLN 6 -29.038 40.908 -24.784 43 HA GLN 6 HA GLN 6 -26.319 40.722 -25.546 44 HB2 GLN 6 HB2 GLN 6 -27.623 40.962 -22.831 45 HB3 GLN 6 HB1 GLN 6 -25.878 40.975 -23.065 46 HG2 GLN 6 HG2 GLN 6 -26.002 42.948 -24.447 47 HG3 GLN 6 HG1 GLN 6 -27.760 42.885 -24.478 48 HE21 GLN 6 HE21 GLN 6 -26.023 45.085 -23.426 49 HE22 GLN 6 HE22 GLN 6 -26.462 45.272 -21.797 50 H GLU 7 HN GLU 7 -28.458 38.533 -23.804 51 HA GLU 7 HA GLU 7 -26.518 36.697 -22.907 52 HB2 GLU 7 HB2 GLU 7 -29.444 36.360 -23.571 53 HB3 GLU 7 HB1 GLU 7 -28.458 35.053 -22.918 54 HG2 GLU 7 HG2 GLU 7 -27.973 36.322 -20.920 55 HG3 GLU 7 HG1 GLU 7 -28.741 37.761 -21.584 56 H LYS 8 HN LYS 8 -28.252 36.953 -25.984 57 HA LYS 8 HA LYS 8 -27.487 34.482 -27.084 58 HB2 LYS 8 HB2 LYS 8 -29.192 35.959 -28.099 59 HB3 LYS 8 HB1 LYS 8 -27.922 37.106 -28.523 60 HG2 LYS 8 HG2 LYS 8 -26.847 35.477 -29.967 61 HG3 LYS 8 HG1 LYS 8 -27.954 34.216 -29.435 62 HD2 LYS 8 HD2 LYS 8 -28.810 34.916 -31.532 63 HD3 LYS 8 HD1 LYS 8 -29.837 35.718 -30.344 64 HE2 LYS 8 HE2 LYS 8 -28.591 37.796 -30.599 65 HE3 LYS 8 HE1 LYS 8 -27.424 37.007 -31.657 66 HZ1 LYS 8 HZ1 LYS 8 -28.795 37.874 -33.213 67 HZ2 LYS 8 HZ2 LYS 8 -30.160 37.861 -32.201 68 HZ3 LYS 8 HZ3 LYS 8 -29.637 36.426 -32.948 69 H GLU 9 HN GLU 9 -25.881 37.650 -27.138 70 HA GLU 9 HA GLU 9 -23.727 36.942 -28.809 71 HB2 GLU 9 HB2 GLU 9 -24.299 39.274 -28.219 72 HB3 GLU 9 HB1 GLU 9 -23.778 38.971 -26.561 73 HG2 GLU 9 HG2 GLU 9 -21.505 38.477 -27.337 74 HG3 GLU 9 HG1 GLU 9 -22.013 38.692 -29.012 75 H GLN 10 HN GLN 10 -24.134 36.772 -25.290 76 HA GLN 10 HA GLN 10 -21.509 35.957 -24.656 77 HB2 GLN 10 HB2 GLN 10 -23.169 36.761 -22.992 78 HB3 GLN 10 HB1 GLN 10 -24.075 35.261 -23.206 79 HG2 GLN 10 HG2 GLN 10 -22.147 33.955 -22.449 80 HG3 GLN 10 HG1 GLN 10 -21.181 35.422 -22.310 81 HE21 GLN 10 HE21 GLN 10 -21.307 34.094 -19.973 82 HE22 GLN 10 HE22 GLN 10 -22.427 34.786 -18.902 83 H GLU 11 HN GLU 11 -24.411 34.122 -25.520 84 HA GLU 11 HA GLU 11 -23.384 31.543 -25.025 85 HB2 GLU 11 HB2 GLU 11 -25.519 32.532 -26.922 86 HB3 GLU 11 HB1 GLU 11 -25.159 30.823 -26.680 87 HG2 GLU 11 HG2 GLU 11 -25.686 30.985 -24.320 88 HG3 GLU 11 HG1 GLU 11 -25.875 32.733 -24.440 89 H LEU 12 HN LEU 12 -23.269 33.624 -27.888 90 HA LEU 12 HA LEU 12 -21.650 31.613 -29.323 91 HB2 LEU 12 HB2 LEU 12 -23.563 32.580 -30.530 92 HB3 LEU 12 HB1 LEU 12 -22.920 34.199 -30.269 93 HG LEU 12 HG LEU 12 -20.895 33.596 -31.573 94 HD11 LEU 12 HD11 LEU 12 -21.239 31.400 -32.986 95 HD12 LEU 12 HD12 LEU 12 -22.285 30.922 -31.651 96 HD13 LEU 12 HD13 LEU 12 -20.584 31.283 -31.355 97 HD21 LEU 12 HD21 LEU 12 -22.011 33.484 -33.775 98 HD22 LEU 12 HD22 LEU 12 -22.837 34.615 -32.700 99 HD23 LEU 12 HD23 LEU 12 -23.517 33.013 -32.986 100 H LYS 13 HN LYS 13 -19.508 31.778 -29.149 101 HA LYS 13 HA LYS 13 -18.188 34.341 -29.426 102 HB2 LYS 13 HB2 LYS 13 -16.951 34.211 -27.318 103 HB3 LYS 13 HB1 LYS 13 -18.685 34.295 -27.006 104 HG2 LYS 13 HG2 LYS 13 -18.736 31.817 -26.762 105 HG3 LYS 13 HG1 LYS 13 -16.987 31.778 -26.992 106 HD2 LYS 13 HD2 LYS 13 -16.725 33.271 -25.018 107 HD3 LYS 13 HD1 LYS 13 -18.468 33.199 -24.762 108 HE2 LYS 13 HE2 LYS 13 -16.614 30.799 -24.782 109 HE3 LYS 13 HE1 LYS 13 -17.266 31.565 -23.334 110 HZ1 LYS 13 HZ1 LYS 13 -18.464 29.622 -24.935 111 HZ2 LYS 13 HZ2 LYS 13 -19.371 31.048 -25.116 112 HZ3 LYS 13 HZ3 LYS 13 -19.111 30.393 -23.569 113 H ASN 14 HN ASN 14 -15.945 34.146 -29.870 114 HA ASN 14 HA ASN 14 -15.188 31.472 -30.856 115 HB2 ASN 14 HB2 ASN 14 -13.536 32.632 -32.196 116 HB3 ASN 14 HB1 ASN 14 -15.103 33.408 -32.411 117 HD21 ASN 14 HD21 ASN 14 -13.471 35.244 -33.097 118 HD22 ASN 14 HD22 ASN 14 -12.972 36.289 -31.857 119 H LEU 15 HN LEU 15 -14.896 33.006 -28.035 120 HA LEU 15 HA LEU 15 -12.115 32.952 -27.479 121 HB2 LEU 15 HB2 LEU 15 -14.531 32.787 -25.675 122 HB3 LEU 15 HB1 LEU 15 -12.882 32.841 -25.063 123 HG LEU 15 HG LEU 15 -14.061 34.941 -26.915 124 HD11 LEU 15 HD11 LEU 15 -13.905 34.785 -23.903 125 HD12 LEU 15 HD12 LEU 15 -15.310 35.134 -24.909 126 HD13 LEU 15 HD13 LEU 15 -14.023 36.327 -24.750 127 HD21 LEU 15 HD21 LEU 15 -11.748 35.194 -27.116 128 HD22 LEU 15 HD22 LEU 15 -11.427 34.586 -25.492 129 HD23 LEU 15 HD23 LEU 15 -12.054 36.217 -25.718 130 H LYS 16 HN LYS 16 -14.673 30.541 -27.173 131 HA LYS 16 HA LYS 16 -13.457 28.576 -25.701 132 HB2 LYS 16 HB2 LYS 16 -14.844 26.971 -26.846 133 HB3 LYS 16 HB1 LYS 16 -15.760 28.466 -26.687 134 HG2 LYS 16 HG2 LYS 16 -15.106 29.073 -29.024 135 HG3 LYS 16 HG1 LYS 16 -14.293 27.517 -29.171 136 HD2 LYS 16 HD2 LYS 16 -16.442 26.374 -28.664 137 HD3 LYS 16 HD1 LYS 16 -17.241 27.946 -28.629 138 HE2 LYS 16 HE2 LYS 16 -15.734 26.813 -31.004 139 HE3 LYS 16 HE1 LYS 16 -17.489 26.837 -30.837 140 HZ1 LYS 16 HZ1 LYS 16 -17.168 29.335 -30.476 141 HZ2 LYS 16 HZ2 LYS 16 -17.027 28.732 -32.058 142 HZ3 LYS 16 HZ3 LYS 16 -15.633 29.107 -31.161 143 H ASP 17 HN ASP 17 -12.164 26.754 -26.179 144 HA ASP 17 HA ASP 17 -9.913 27.278 -27.801 145 HB2 ASP 17 HB2 ASP 17 -10.940 24.749 -26.509 146 HB3 ASP 17 HB1 ASP 17 -9.418 24.820 -27.394 147 H ASN 18 HN ASN 18 -9.295 26.518 -29.800 148 HA ASN 18 HA ASN 18 -11.473 25.636 -31.562 149 HB2 ASN 18 HB2 ASN 18 -8.654 26.549 -32.184 150 HB3 ASN 18 HB1 ASN 18 -9.895 26.173 -33.377 151 HD21 ASN 18 HD21 ASN 18 -12.133 27.429 -32.666 152 HD22 ASN 18 HD22 ASN 18 -11.895 29.084 -32.371 153 H VAL 19 HN VAL 19 -9.336 24.141 -29.615 154 HA VAL 19 HA VAL 19 -8.065 22.222 -31.242 155 HB VAL 19 HB VAL 19 -8.957 22.126 -28.352 156 HG11 VAL 19 HG11 VAL 19 -8.778 19.838 -29.019 157 HG12 VAL 19 HG12 VAL 19 -7.243 20.228 -28.243 158 HG13 VAL 19 HG13 VAL 19 -7.351 20.163 -30.003 159 HG21 VAL 19 HG21 VAL 19 -6.636 22.610 -27.880 160 HG22 VAL 19 HG22 VAL 19 -7.197 23.791 -29.065 161 HG23 VAL 19 HG23 VAL 19 -6.202 22.429 -29.582 162 H GLU 20 HN GLU 20 -11.204 22.182 -29.572 163 HA GLU 20 HA GLU 20 -11.947 19.556 -30.272 164 HB2 GLU 20 HB2 GLU 20 -13.099 20.894 -28.541 165 HB3 GLU 20 HB1 GLU 20 -13.733 21.955 -29.798 166 HG2 GLU 20 HG2 GLU 20 -14.928 20.075 -30.823 167 HG3 GLU 20 HG1 GLU 20 -14.247 18.971 -29.629 168 H LEU 21 HN LEU 21 -12.449 22.662 -31.904 169 HA LEU 21 HA LEU 21 -14.052 21.674 -34.019 170 HB2 LEU 21 HB2 LEU 21 -12.246 24.089 -33.822 171 HB3 LEU 21 HB1 LEU 21 -13.246 23.755 -35.231 172 HG LEU 21 HG LEU 21 -14.344 23.997 -32.410 173 HD11 LEU 21 HD11 LEU 21 -13.458 26.146 -32.965 174 HD12 LEU 21 HD12 LEU 21 -15.189 26.234 -33.287 175 HD13 LEU 21 HD13 LEU 21 -14.052 26.039 -34.621 176 HD21 LEU 21 HD21 LEU 21 -15.988 22.851 -33.617 177 HD22 LEU 21 HD22 LEU 21 -15.549 23.607 -35.146 178 HD23 LEU 21 HD23 LEU 21 -16.453 24.517 -33.939 179 H GLU 22 HN GLU 22 -10.559 22.010 -33.620 180 HA GLU 22 HA GLU 22 -9.808 21.348 -36.255 181 HB2 GLU 22 HB2 GLU 22 -8.286 22.327 -34.541 182 HB3 GLU 22 HB1 GLU 22 -8.283 20.779 -33.699 183 HG2 GLU 22 HG2 GLU 22 -7.540 20.961 -36.623 184 HG3 GLU 22 HG1 GLU 22 -6.348 21.265 -35.363 185 H ARG 23 HN ARG 23 -10.400 19.343 -33.394 186 HA ARG 23 HA ARG 23 -9.573 16.878 -34.468 187 HB2 ARG 23 HB2 ARG 23 -10.027 17.237 -32.070 188 HB3 ARG 23 HB1 ARG 23 -11.745 17.412 -32.426 189 HG2 ARG 23 HG2 ARG 23 -11.830 15.122 -33.295 190 HG3 ARG 23 HG1 ARG 23 -10.094 14.941 -33.034 191 HD2 ARG 23 HD2 ARG 23 -11.318 13.914 -31.184 192 HD3 ARG 23 HD1 ARG 23 -10.442 15.329 -30.608 193 HE ARG 23 HE ARG 23 -12.485 16.382 -30.208 194 HH11 ARG 23 HH11 ARG 23 -14.751 16.377 -30.049 195 HH12 ARG 23 HH12 ARG 23 -15.666 15.126 -30.824 196 HH21 ARG 23 HH21 ARG 23 -12.876 13.514 -32.108 197 HH22 ARG 23 HH22 ARG 23 -14.604 13.506 -31.989 198 H LEU 24 HN LEU 24 -12.740 18.487 -34.478 199 HA LEU 24 HA LEU 24 -14.188 16.426 -35.732 200 HB2 LEU 24 HB2 LEU 24 -15.276 18.324 -34.623 201 HB3 LEU 24 HB1 LEU 24 -14.624 19.424 -35.835 202 HG LEU 24 HG LEU 24 -15.893 18.238 -37.598 203 HD11 LEU 24 HD11 LEU 24 -16.142 16.012 -36.900 204 HD12 LEU 24 HD12 LEU 24 -17.755 16.657 -36.614 205 HD13 LEU 24 HD13 LEU 24 -16.631 16.470 -35.267 206 HD21 LEU 24 HD21 LEU 24 -18.198 18.871 -36.749 207 HD22 LEU 24 HD22 LEU 24 -16.978 20.136 -36.591 208 HD23 LEU 24 HD23 LEU 24 -17.453 19.189 -35.182 209 H LYS 25 HN LYS 25 -12.429 19.209 -37.072 210 HA LYS 25 HA LYS 25 -13.071 18.611 -39.795 211 HB2 LYS 25 HB2 LYS 25 -10.918 20.339 -38.552 212 HB3 LYS 25 HB1 LYS 25 -11.224 20.228 -40.286 213 HG2 LYS 25 HG2 LYS 25 -13.450 21.098 -40.039 214 HG3 LYS 25 HG1 LYS 25 -13.376 20.952 -38.285 215 HD2 LYS 25 HD2 LYS 25 -13.028 23.266 -38.756 216 HD3 LYS 25 HD1 LYS 25 -11.441 22.616 -38.358 217 HE2 LYS 25 HE2 LYS 25 -11.343 24.074 -40.350 218 HE3 LYS 25 HE1 LYS 25 -10.911 22.421 -40.763 219 HZ1 LYS 25 HZ1 LYS 25 -12.913 22.068 -41.821 220 HZ2 LYS 25 HZ2 LYS 25 -12.599 23.690 -42.217 221 HZ3 LYS 25 HZ3 LYS 25 -13.707 23.313 -40.985 222 H ASN 26 HN ASN 26 -11.853 17.579 -41.354 223 HA ASN 26 HA ASN 26 -10.461 15.946 -42.177 224 HB2 ASN 26 HB2 ASN 26 -8.537 17.235 -40.226 225 HB3 ASN 26 HB1 ASN 26 -8.087 16.155 -41.543 226 HD21 ASN 26 HD21 ASN 26 -7.710 19.230 -40.976 227 HD22 ASN 26 HD22 ASN 26 -8.146 19.934 -42.458 228 H GLU 27 HN GLU 27 -12.188 15.104 -40.122 229 HA GLU 27 HA GLU 27 -10.867 13.644 -38.080 230 HB2 GLU 27 HB2 GLU 27 -13.017 12.508 -37.781 231 HB3 GLU 27 HB1 GLU 27 -13.258 14.244 -37.975 232 HG2 GLU 27 HG2 GLU 27 -13.731 13.870 -40.397 233 HG3 GLU 27 HG1 GLU 27 -13.601 12.132 -40.126 234 H ARG 28 HN ARG 28 -10.526 11.383 -37.903 235 HA ARG 28 HA ARG 28 -10.732 9.714 -40.277 236 HB2 ARG 28 HB2 ARG 28 -8.355 9.192 -40.387 237 HB3 ARG 28 HB1 ARG 28 -8.592 10.924 -40.615 238 HG2 ARG 28 HG2 ARG 28 -8.164 11.212 -38.137 239 HG3 ARG 28 HG1 ARG 28 -7.689 9.513 -38.092 240 HD2 ARG 28 HD2 ARG 28 -6.431 11.617 -39.874 241 HD3 ARG 28 HD1 ARG 28 -5.736 11.032 -38.366 242 HE ARG 28 HE ARG 28 -5.860 9.594 -40.903 243 HH11 ARG 28 HH11 ARG 28 -4.661 7.668 -40.956 244 HH12 ARG 28 HH12 ARG 28 -4.043 6.995 -39.484 245 HH21 ARG 28 HH21 ARG 28 -5.344 9.508 -37.481 246 HH22 ARG 28 HH22 ARG 28 -4.428 8.039 -37.517 247 H HIS 29 HN HIS 29 -10.123 7.470 -39.826 248 HA HIS 29 HA HIS 29 -9.723 6.687 -37.057 249 HB2 HIS 29 HB2 HIS 29 -11.780 5.390 -36.881 250 HB3 HIS 29 HB1 HIS 29 -12.173 7.083 -37.180 251 HD2 HIS 29 HD2 HIS 29 -12.734 3.631 -38.824 252 HE1 HIS 29 HE1 HIS 29 -13.991 6.535 -41.621 253 HE2 HIS 29 HE2 HIS 29 -13.977 4.053 -41.082 254 H ASP 30 HN ASP 30 -9.513 4.312 -36.850 255 HA ASP 30 HA ASP 30 -9.078 2.841 -39.350 256 HB2 ASP 30 HB2 ASP 30 -6.917 3.930 -38.889 257 HB3 ASP 30 HB1 ASP 30 -6.904 3.218 -37.276 258 H HIS 31 HN HIS 31 -8.903 2.802 -35.797 259 HA HIS 31 HA HIS 31 -10.350 0.257 -35.768 260 HB2 HIS 31 HB2 HIS 31 -7.838 -0.216 -35.837 261 HB3 HIS 31 HB1 HIS 31 -7.758 0.525 -34.239 262 HD2 HIS 31 HD2 HIS 31 -8.843 -2.831 -35.863 263 HE1 HIS 31 HE1 HIS 31 -9.865 -3.039 -31.772 264 HE2 HIS 31 HE2 HIS 31 -9.667 -4.373 -33.924 265 H ASP 32 HN ASP 32 -10.922 3.022 -34.997 266 HA ASP 32 HA ASP 32 -10.923 2.991 -32.068 267 HB2 ASP 32 HB2 ASP 32 -11.819 5.241 -32.246 268 HB3 ASP 32 HB1 ASP 32 -10.424 5.083 -33.309 269 H GLU 33 HN GLU 33 -12.712 1.461 -34.278 270 HA GLU 33 HA GLU 33 -15.389 2.128 -33.701 271 HB2 GLU 33 HB2 GLU 33 -14.700 0.716 -35.612 272 HB3 GLU 33 HB1 GLU 33 -14.247 -0.565 -34.489 273 HG2 GLU 33 HG2 GLU 33 -16.560 -0.711 -33.682 274 HG3 GLU 33 HG1 GLU 33 -17.028 0.617 -34.744 275 H GLU 34 HN GLU 34 -13.173 -0.205 -32.217 276 HA GLU 34 HA GLU 34 -15.009 -1.354 -30.403 277 HB2 GLU 34 HB2 GLU 34 -11.997 -1.056 -30.298 278 HB3 GLU 34 HB1 GLU 34 -12.923 -1.979 -29.119 279 HG2 GLU 34 HG2 GLU 34 -12.275 -3.612 -30.683 280 HG3 GLU 34 HG1 GLU 34 -13.918 -3.223 -31.175 281 H ALA 35 HN ALA 35 -12.944 1.490 -30.209 282 HA ALA 35 HA ALA 35 -13.198 2.040 -27.474 283 HB1 ALA 35 HB1 ALA 35 -12.514 4.296 -28.027 284 HB2 ALA 35 HB2 ALA 35 -12.964 4.058 -29.716 285 HB3 ALA 35 HB3 ALA 35 -11.607 3.165 -29.030 286 H GLU 36 HN GLU 36 -15.307 2.859 -30.199 287 HA GLU 36 HA GLU 36 -16.997 4.668 -28.879 288 HB2 GLU 36 HB2 GLU 36 -17.014 4.305 -31.320 289 HB3 GLU 36 HB1 GLU 36 -17.711 2.705 -31.070 290 HG2 GLU 36 HG2 GLU 36 -19.690 3.699 -30.022 291 HG3 GLU 36 HG1 GLU 36 -18.987 5.307 -30.177 292 H ARG 37 HN ARG 37 -17.183 1.119 -29.146 293 HA ARG 37 HA ARG 37 -19.640 0.822 -27.780 294 HB2 ARG 37 HB2 ARG 37 -17.305 -1.009 -28.295 295 HB3 ARG 37 HB1 ARG 37 -18.624 -1.530 -27.248 296 HG2 ARG 37 HG2 ARG 37 -19.067 -2.270 -29.530 297 HG3 ARG 37 HG1 ARG 37 -20.235 -1.027 -29.086 298 HD2 ARG 37 HD2 ARG 37 -19.070 0.643 -30.343 299 HD3 ARG 37 HD1 ARG 37 -17.673 -0.407 -30.561 300 HE ARG 37 HE ARG 37 -19.828 -1.741 -31.698 301 HH11 ARG 37 HH11 ARG 37 -20.245 -1.587 -33.925 302 HH12 ARG 37 HH12 ARG 37 -19.652 -0.227 -34.819 303 HH21 ARG 37 HH21 ARG 37 -18.154 1.263 -32.070 304 HH22 ARG 37 HH22 ARG 37 -18.468 1.387 -33.768 305 H LYS 38 HN LYS 38 -16.295 0.976 -26.642 306 HA LYS 38 HA LYS 38 -16.752 0.293 -23.954 307 HB2 LYS 38 HB2 LYS 38 -14.502 0.428 -24.939 308 HB3 LYS 38 HB1 LYS 38 -14.682 2.174 -25.102 309 HG2 LYS 38 HG2 LYS 38 -14.791 2.474 -22.720 310 HG3 LYS 38 HG1 LYS 38 -14.934 0.739 -22.450 311 HD2 LYS 38 HD2 LYS 38 -12.660 1.317 -21.954 312 HD3 LYS 38 HD1 LYS 38 -12.639 0.494 -23.512 313 HE2 LYS 38 HE2 LYS 38 -12.471 2.602 -24.696 314 HE3 LYS 38 HE1 LYS 38 -12.710 3.509 -23.202 315 HZ1 LYS 38 HZ1 LYS 38 -10.620 1.837 -22.666 316 HZ2 LYS 38 HZ2 LYS 38 -10.510 3.494 -23.029 317 HZ3 LYS 38 HZ3 LYS 38 -10.330 2.337 -24.260 318 H ALA 39 HN ALA 39 -16.805 3.446 -25.595 319 HA ALA 39 HA ALA 39 -17.247 5.034 -23.310 320 HB1 ALA 39 HB1 ALA 39 -16.623 5.835 -25.634 321 HB2 ALA 39 HB2 ALA 39 -17.880 6.772 -24.824 322 HB3 ALA 39 HB3 ALA 39 -18.315 5.610 -26.078 323 H LEU 40 HN LEU 40 -19.481 3.356 -25.481 324 HA LEU 40 HA LEU 40 -21.881 4.410 -24.456 325 HB2 LEU 40 HB2 LEU 40 -21.773 3.165 -26.569 326 HB3 LEU 40 HB1 LEU 40 -21.343 1.697 -25.695 327 HG LEU 40 HG LEU 40 -23.514 1.764 -24.509 328 HD11 LEU 40 HD11 LEU 40 -24.161 4.013 -24.362 329 HD12 LEU 40 HD12 LEU 40 -25.227 3.418 -25.630 330 HD13 LEU 40 HD13 LEU 40 -23.784 4.339 -26.055 331 HD21 LEU 40 HD21 LEU 40 -23.629 1.938 -27.533 332 HD22 LEU 40 HD22 LEU 40 -24.954 1.342 -26.534 333 HD23 LEU 40 HD23 LEU 40 -23.413 0.484 -26.560 334 H GLU 41 HN GLU 41 -20.006 1.533 -23.550 335 HA GLU 41 HA GLU 41 -21.785 0.534 -21.609 336 HB2 GLU 41 HB2 GLU 41 -19.891 -0.758 -22.533 337 HB3 GLU 41 HB1 GLU 41 -18.766 0.306 -21.691 338 HG2 GLU 41 HG2 GLU 41 -19.703 -0.366 -19.528 339 HG3 GLU 41 HG1 GLU 41 -20.897 -1.376 -20.342 340 H ASP 42 HN ASP 42 -19.086 2.827 -21.364 341 HA ASP 42 HA ASP 42 -19.101 3.124 -18.565 342 HB2 ASP 42 HB2 ASP 42 -17.289 3.946 -20.039 343 HB3 ASP 42 HB1 ASP 42 -18.376 5.189 -20.655 344 H LYS 43 HN LYS 43 -20.847 4.872 -21.112 345 HA LYS 43 HA LYS 43 -22.081 6.779 -19.430 346 HB2 LYS 43 HB2 LYS 43 -22.871 5.647 -22.112 347 HB3 LYS 43 HB1 LYS 43 -23.783 6.928 -21.315 348 HG2 LYS 43 HG2 LYS 43 -21.624 8.251 -21.177 349 HG3 LYS 43 HG1 LYS 43 -20.884 7.029 -22.206 350 HD2 LYS 43 HD2 LYS 43 -23.392 8.534 -22.986 351 HD3 LYS 43 HD1 LYS 43 -21.773 9.080 -23.416 352 HE2 LYS 43 HE2 LYS 43 -21.390 6.844 -24.513 353 HE3 LYS 43 HE1 LYS 43 -23.090 6.472 -24.227 354 HZ1 LYS 43 HZ1 LYS 43 -22.724 9.041 -25.418 355 HZ2 LYS 43 HZ2 LYS 43 -23.717 7.752 -25.905 356 HZ3 LYS 43 HZ3 LYS 43 -22.088 7.798 -26.381 357 H LEU 44 HN LEU 44 -23.039 3.532 -20.446 358 HA LEU 44 HA LEU 44 -25.650 3.552 -19.399 359 HB2 LEU 44 HB2 LEU 44 -24.852 1.815 -20.937 360 HB3 LEU 44 HB1 LEU 44 -23.720 1.237 -19.717 361 HG LEU 44 HG LEU 44 -25.614 0.668 -18.226 362 HD11 LEU 44 HD11 LEU 44 -27.189 1.919 -20.473 363 HD12 LEU 44 HD12 LEU 44 -27.364 2.145 -18.733 364 HD13 LEU 44 HD13 LEU 44 -27.924 0.655 -19.484 365 HD21 LEU 44 HD21 LEU 44 -25.961 -0.457 -21.021 366 HD22 LEU 44 HD22 LEU 44 -26.428 -1.240 -19.512 367 HD23 LEU 44 HD23 LEU 44 -24.723 -0.979 -19.879 368 H ALA 45 HN ALA 45 -22.553 2.599 -17.939 369 HA ALA 45 HA ALA 45 -23.576 1.718 -15.467 370 HB1 ALA 45 HB1 ALA 45 -21.209 1.432 -16.407 371 HB2 ALA 45 HB2 ALA 45 -21.342 1.783 -14.684 372 HB3 ALA 45 HB3 ALA 45 -20.898 3.063 -15.813 373 H ASP 46 HN ASP 46 -22.566 4.916 -16.595 374 HA ASP 46 HA ASP 46 -22.816 7.017 -15.686 375 HB2 ASP 46 HB2 ASP 46 -25.213 6.254 -15.929 376 HB3 ASP 46 HB1 ASP 46 -25.164 5.801 -14.226 377 H LYS 47 HN LYS 47 -21.018 5.253 -14.302 378 HA LYS 47 HA LYS 47 -20.858 6.659 -11.794 379 HB2 LYS 47 HB2 LYS 47 -20.904 4.661 -10.361 380 HB3 LYS 47 HB1 LYS 47 -22.448 4.891 -11.178 381 HG2 LYS 47 HG2 LYS 47 -21.780 3.241 -12.896 382 HG3 LYS 47 HG1 LYS 47 -20.249 2.995 -12.057 383 HD2 LYS 47 HD2 LYS 47 -21.466 2.240 -10.048 384 HD3 LYS 47 HD1 LYS 47 -22.999 2.481 -10.888 385 HE2 LYS 47 HE2 LYS 47 -22.335 0.823 -12.587 386 HE3 LYS 47 HE1 LYS 47 -20.798 0.582 -11.755 387 HZ1 LYS 47 HZ1 LYS 47 -22.782 0.306 -9.846 388 HZ2 LYS 47 HZ2 LYS 47 -21.803 -0.918 -10.502 389 HZ3 LYS 47 HZ3 LYS 47 -23.315 -0.572 -11.195 390 H GLN 48 HN GLN 48 -19.553 5.044 -14.378 391 HA GLN 48 HA GLN 48 -17.003 4.372 -13.077 392 HB2 GLN 48 HB2 GLN 48 -17.946 4.005 -15.933 393 HB3 GLN 48 HB1 GLN 48 -16.399 3.452 -15.293 394 HG2 GLN 48 HG2 GLN 48 -19.124 2.573 -14.291 395 HG3 GLN 48 HG1 GLN 48 -18.071 1.626 -15.335 396 HE21 GLN 48 HE21 GLN 48 -19.006 1.701 -12.216 397 HE22 GLN 48 HE22 GLN 48 -17.572 1.216 -11.449 398 H GLU 49 HN GLU 49 -18.381 7.110 -14.167 399 HA GLU 49 HA GLU 49 -16.452 8.208 -15.921 400 HB2 GLU 49 HB2 GLU 49 -18.425 9.509 -14.039 401 HB3 GLU 49 HB1 GLU 49 -17.387 10.428 -15.129 402 HG2 GLU 49 HG2 GLU 49 -19.251 8.227 -16.066 403 HG3 GLU 49 HG1 GLU 49 -19.689 9.932 -16.048 404 H HIS 50 HN HIS 50 -16.716 8.231 -12.380 405 HA HIS 50 HA HIS 50 -14.489 9.974 -11.982 406 HB2 HIS 50 HB2 HIS 50 -14.653 9.344 -9.640 407 HB3 HIS 50 HB1 HIS 50 -16.268 9.628 -10.289 408 HD2 HIS 50 HD2 HIS 50 -17.949 7.381 -10.282 409 HE1 HIS 50 HE1 HIS 50 -15.108 4.626 -8.812 410 HE2 HIS 50 HE2 HIS 50 -17.558 4.958 -9.392 411 H LEU 51 HN LEU 51 -14.766 6.607 -12.686 412 HA LEU 51 HA LEU 51 -12.394 5.663 -11.482 413 HB2 LEU 51 HB2 LEU 51 -14.122 4.153 -12.363 414 HB3 LEU 51 HB1 LEU 51 -13.773 4.697 -14.000 415 HG LEU 51 HG LEU 51 -11.464 3.832 -13.801 416 HD11 LEU 51 HD11 LEU 51 -11.174 2.203 -11.748 417 HD12 LEU 51 HD12 LEU 51 -12.396 3.230 -10.998 418 HD13 LEU 51 HD13 LEU 51 -10.867 3.925 -11.538 419 HD21 LEU 51 HD21 LEU 51 -13.564 1.785 -13.023 420 HD22 LEU 51 HD22 LEU 51 -12.044 1.454 -13.855 421 HD23 LEU 51 HD23 LEU 51 -13.303 2.391 -14.659 422 H ASP 52 HN ASP 52 -13.029 7.059 -14.679 423 HA ASP 52 HA ASP 52 -10.457 6.710 -15.762 424 HB2 ASP 52 HB2 ASP 52 -12.614 8.750 -16.306 425 HB3 ASP 52 HB1 ASP 52 -11.119 8.670 -17.234 426 H GLY 53 HN GLY 53 -11.842 9.310 -13.796 427 HA2 GLY 53 HA2 GLY 53 -9.701 11.129 -13.996 428 HA3 GLY 53 HA1 GLY 53 -10.857 11.064 -12.666 429 H ALA 54 HN ALA 54 -10.265 8.394 -11.774 430 HA ALA 54 HA ALA 54 -8.108 8.899 -10.028 431 HB1 ALA 54 HB1 ALA 54 -9.108 6.152 -10.775 432 HB2 ALA 54 HB2 ALA 54 -10.024 7.235 -9.728 433 HB3 ALA 54 HB3 ALA 54 -8.423 6.682 -9.239 434 H LEU 55 HN LEU 55 -8.322 7.099 -13.067 435 HA LEU 55 HA LEU 55 -5.718 6.006 -13.035 436 HB2 LEU 55 HB2 LEU 55 -7.565 6.721 -15.319 437 HB3 LEU 55 HB1 LEU 55 -6.043 5.859 -15.534 438 HG LEU 55 HG LEU 55 -8.275 4.920 -13.707 439 HD11 LEU 55 HD11 LEU 55 -7.559 3.903 -16.471 440 HD12 LEU 55 HD12 LEU 55 -8.912 4.982 -16.136 441 HD13 LEU 55 HD13 LEU 55 -8.890 3.356 -15.452 442 HD21 LEU 55 HD21 LEU 55 -6.374 3.801 -12.940 443 HD22 LEU 55 HD22 LEU 55 -5.584 3.830 -14.516 444 HD23 LEU 55 HD23 LEU 55 -6.894 2.693 -14.206 445 H ARG 56 HN ARG 56 -6.996 9.071 -14.224 446 HA ARG 56 HA ARG 56 -5.980 11.055 -14.746 447 HB2 ARG 56 HB2 ARG 56 -4.670 10.549 -12.636 448 HB3 ARG 56 HB1 ARG 56 -3.409 9.889 -13.674 449 HG2 ARG 56 HG2 ARG 56 -3.243 12.035 -14.865 450 HG3 ARG 56 HG1 ARG 56 -4.511 12.706 -13.838 451 HD2 ARG 56 HD2 ARG 56 -3.111 12.315 -11.848 452 HD3 ARG 56 HD1 ARG 56 -1.845 11.640 -12.870 453 HE ARG 56 HE ARG 56 -1.279 13.805 -13.532 454 HH11 ARG 56 HH11 ARG 56 -1.429 16.064 -13.351 455 HH12 ARG 56 HH12 ARG 56 -2.795 16.775 -12.558 456 HH21 ARG 56 HH21 ARG 56 -4.302 13.733 -11.847 457 HH22 ARG 56 HH22 ARG 56 -4.420 15.455 -11.706 458 H TYR 57 HN TYR 57 -4.649 8.058 -15.841 459 HA TYR 57 HA TYR 57 -3.558 7.450 -17.768 460 HB2 TYR 57 HB2 TYR 57 -5.569 8.325 -18.817 461 HB3 TYR 57 HB1 TYR 57 -4.929 9.968 -18.741 462 HD1 TYR 57 HD1 TYR 57 -4.298 6.583 -20.182 463 HD2 TYR 57 HD2 TYR 57 -3.488 10.794 -20.436 464 HE1 TYR 57 HE1 TYR 57 -3.146 6.232 -22.349 465 HE2 TYR 57 HE2 TYR 57 -2.336 10.442 -22.605 466 HH TYR 57 HH TYR 57 -2.633 7.660 -24.410 Start of MODEL 7 1 H1 GLY 1 HT1 GLY 1 -17.048 28.591 -46.476 2 H2 GLY 1 HT2 GLY 1 -18.047 29.435 -45.392 3 H3 GLY 1 HT3 GLY 1 -18.149 29.742 -47.059 4 HA2 GLY 1 HA2 GLY 1 -19.944 28.388 -46.841 5 HA3 GLY 1 HA1 GLY 1 -18.686 27.192 -47.159 6 H SER 2 HN SER 2 -21.235 27.143 -45.514 7 HA SER 2 HA SER 2 -20.610 27.016 -42.767 8 HB2 SER 2 HB2 SER 2 -22.743 25.597 -44.375 9 HB3 SER 2 HB1 SER 2 -22.667 25.597 -42.616 10 HG SER 2 HG SER 2 -23.209 27.688 -44.404 11 H LYS 3 HN LYS 3 -20.507 24.580 -45.332 12 HA LYS 3 HA LYS 3 -19.584 22.476 -45.421 13 HB2 LYS 3 HB2 LYS 3 -17.826 23.677 -43.266 14 HB3 LYS 3 HB1 LYS 3 -17.495 22.166 -44.114 15 HG2 LYS 3 HG2 LYS 3 -17.474 23.377 -46.268 16 HG3 LYS 3 HG1 LYS 3 -17.790 24.889 -45.417 17 HD2 LYS 3 HD2 LYS 3 -15.686 24.640 -44.163 18 HD3 LYS 3 HD1 LYS 3 -15.370 23.113 -44.987 19 HE2 LYS 3 HE2 LYS 3 -14.124 24.918 -46.080 20 HE3 LYS 3 HE1 LYS 3 -15.377 24.313 -47.165 21 HZ1 LYS 3 HZ1 LYS 3 -16.492 26.328 -45.584 22 HZ2 LYS 3 HZ2 LYS 3 -16.219 26.338 -47.262 23 HZ3 LYS 3 HZ3 LYS 3 -15.025 26.918 -46.200 24 H THR 4 HN THR 4 -21.910 22.776 -43.750 25 HA THR 4 HA THR 4 -21.382 21.016 -41.448 26 HB THR 4 HB THR 4 -23.683 21.614 -40.790 27 HG1 THR 4 HG1 THR 4 -24.577 21.969 -42.804 28 HG21 THR 4 HG21 THR 4 -22.029 23.033 -39.867 29 HG22 THR 4 HG22 THR 4 -23.226 24.135 -40.548 30 HG23 THR 4 HG23 THR 4 -21.724 23.819 -41.416 31 H ILE 5 HN ILE 5 -21.923 20.602 -44.603 32 HA ILE 5 HA ILE 5 -24.163 18.897 -44.770 33 HB ILE 5 HB ILE 5 -21.658 19.081 -46.458 34 HG12 ILE 5 HG12 ILE 5 -24.490 20.002 -47.019 35 HG13 ILE 5 HG11 ILE 5 -23.265 21.050 -46.304 36 HG21 ILE 5 HG21 ILE 5 -22.527 16.898 -46.875 37 HG22 ILE 5 HG22 ILE 5 -23.179 17.905 -48.165 38 HG23 ILE 5 HG23 ILE 5 -24.195 17.464 -46.793 39 HD11 ILE 5 HD11 ILE 5 -21.817 20.737 -48.254 40 HD12 ILE 5 HD12 ILE 5 -23.399 21.321 -48.773 41 HD13 ILE 5 HD13 ILE 5 -22.981 19.618 -48.962 42 H GLN 6 HN GLN 6 -20.709 18.167 -44.221 43 HA GLN 6 HA GLN 6 -19.652 16.202 -43.641 44 HB2 GLN 6 HB2 GLN 6 -22.094 16.328 -41.893 45 HB3 GLN 6 HB1 GLN 6 -21.022 14.936 -41.785 46 HG2 GLN 6 HG2 GLN 6 -20.259 16.474 -40.133 47 HG3 GLN 6 HG1 GLN 6 -19.109 16.602 -41.457 48 HE21 GLN 6 HE21 GLN 6 -18.570 18.759 -41.777 49 HE22 GLN 6 HE22 GLN 6 -19.656 20.058 -41.666 50 H GLU 7 HN GLU 7 -21.174 16.035 -46.054 51 HA GLU 7 HA GLU 7 -22.029 14.492 -47.524 52 HB2 GLU 7 HB2 GLU 7 -20.692 12.558 -45.616 53 HB3 GLU 7 HB1 GLU 7 -21.188 12.201 -47.270 54 HG2 GLU 7 HG2 GLU 7 -19.215 14.372 -46.511 55 HG3 GLU 7 HG1 GLU 7 -18.758 12.767 -47.079 56 H LYS 8 HN LYS 8 -23.778 15.363 -45.432 57 HA LYS 8 HA LYS 8 -25.179 13.264 -44.181 58 HB2 LYS 8 HB2 LYS 8 -25.447 15.618 -43.529 59 HB3 LYS 8 HB1 LYS 8 -26.206 15.958 -45.084 60 HG2 LYS 8 HG2 LYS 8 -28.072 14.531 -44.581 61 HG3 LYS 8 HG1 LYS 8 -27.264 13.875 -43.161 62 HD2 LYS 8 HD2 LYS 8 -28.864 15.469 -42.357 63 HD3 LYS 8 HD1 LYS 8 -27.281 16.226 -42.198 64 HE2 LYS 8 HE2 LYS 8 -27.632 17.525 -44.215 65 HE3 LYS 8 HE1 LYS 8 -29.128 16.658 -44.563 66 HZ1 LYS 8 HZ1 LYS 8 -28.572 18.664 -42.487 67 HZ2 LYS 8 HZ2 LYS 8 -29.780 17.500 -42.214 68 HZ3 LYS 8 HZ3 LYS 8 -29.893 18.550 -43.546 69 H GLU 9 HN GLU 9 -25.642 14.846 -47.319 70 HA GLU 9 HA GLU 9 -28.029 13.515 -48.032 71 HB2 GLU 9 HB2 GLU 9 -25.848 14.768 -49.702 72 HB3 GLU 9 HB1 GLU 9 -27.307 14.071 -50.406 73 HG2 GLU 9 HG2 GLU 9 -28.714 15.611 -49.185 74 HG3 GLU 9 HG1 GLU 9 -27.342 16.217 -48.262 75 H GLN 10 HN GLN 10 -24.625 12.656 -48.493 76 HA GLN 10 HA GLN 10 -25.029 10.431 -50.174 77 HB2 GLN 10 HB2 GLN 10 -22.822 11.526 -49.712 78 HB3 GLN 10 HB1 GLN 10 -22.837 10.780 -48.115 79 HG2 GLN 10 HG2 GLN 10 -23.173 9.112 -50.614 80 HG3 GLN 10 HG1 GLN 10 -21.574 9.546 -50.015 81 HE21 GLN 10 HE21 GLN 10 -22.883 6.832 -50.079 82 HE22 GLN 10 HE22 GLN 10 -22.870 6.296 -48.468 83 H GLU 11 HN GLU 11 -24.978 10.745 -46.648 84 HA GLU 11 HA GLU 11 -25.104 8.001 -46.016 85 HB2 GLU 11 HB2 GLU 11 -24.582 9.769 -44.366 86 HB3 GLU 11 HB1 GLU 11 -26.245 10.345 -44.473 87 HG2 GLU 11 HG2 GLU 11 -27.075 8.183 -43.663 88 HG3 GLU 11 HG1 GLU 11 -25.431 7.550 -43.622 89 H LEU 12 HN LEU 12 -27.638 10.400 -46.632 90 HA LEU 12 HA LEU 12 -29.841 8.730 -46.029 91 HB2 LEU 12 HB2 LEU 12 -29.582 11.153 -47.818 92 HB3 LEU 12 HB1 LEU 12 -31.118 10.348 -47.515 93 HG LEU 12 HG LEU 12 -29.322 11.429 -45.316 94 HD11 LEU 12 HD11 LEU 12 -31.081 13.248 -45.193 95 HD12 LEU 12 HD12 LEU 12 -31.679 12.672 -46.750 96 HD13 LEU 12 HD13 LEU 12 -30.043 13.313 -46.618 97 HD21 LEU 12 HD21 LEU 12 -31.719 11.350 -44.171 98 HD22 LEU 12 HD22 LEU 12 -30.738 9.893 -44.259 99 HD23 LEU 12 HD23 LEU 12 -32.048 10.141 -45.412 100 H LYS 13 HN LYS 13 -28.024 9.304 -49.006 101 HA LYS 13 HA LYS 13 -29.751 7.676 -50.630 102 HB2 LYS 13 HB2 LYS 13 -26.973 8.781 -51.081 103 HB3 LYS 13 HB1 LYS 13 -27.853 7.841 -52.286 104 HG2 LYS 13 HG2 LYS 13 -29.694 9.485 -52.230 105 HG3 LYS 13 HG1 LYS 13 -28.812 10.433 -51.033 106 HD2 LYS 13 HD2 LYS 13 -26.976 10.776 -52.622 107 HD3 LYS 13 HD1 LYS 13 -27.808 9.783 -53.818 108 HE2 LYS 13 HE2 LYS 13 -28.206 12.157 -54.285 109 HE3 LYS 13 HE1 LYS 13 -29.710 11.382 -53.789 110 HZ1 LYS 13 HZ1 LYS 13 -29.158 12.159 -51.481 111 HZ2 LYS 13 HZ2 LYS 13 -29.563 13.384 -52.587 112 HZ3 LYS 13 HZ3 LYS 13 -27.938 13.115 -52.168 113 H ASN 14 HN ASN 14 -29.536 5.571 -51.227 114 HA ASN 14 HA ASN 14 -27.395 3.987 -49.908 115 HB2 ASN 14 HB2 ASN 14 -28.987 2.157 -49.727 116 HB3 ASN 14 HB1 ASN 14 -29.651 3.592 -48.949 117 HD21 ASN 14 HD21 ASN 14 -31.754 2.270 -49.420 118 HD22 ASN 14 HD22 ASN 14 -32.494 2.544 -50.923 119 H LEU 15 HN LEU 15 -27.755 5.263 -52.688 120 HA LEU 15 HA LEU 15 -27.676 2.856 -54.383 121 HB2 LEU 15 HB2 LEU 15 -29.096 4.723 -55.112 122 HB3 LEU 15 HB1 LEU 15 -27.707 5.805 -55.087 123 HG LEU 15 HG LEU 15 -26.611 4.431 -56.833 124 HD11 LEU 15 HD11 LEU 15 -28.282 2.789 -58.023 125 HD12 LEU 15 HD12 LEU 15 -29.097 2.763 -56.460 126 HD13 LEU 15 HD13 LEU 15 -27.420 2.236 -56.590 127 HD21 LEU 15 HD21 LEU 15 -28.109 6.351 -57.410 128 HD22 LEU 15 HD22 LEU 15 -29.443 5.211 -57.585 129 HD23 LEU 15 HD23 LEU 15 -28.054 5.117 -58.669 130 H LYS 16 HN LYS 16 -25.758 1.945 -54.745 131 HA LYS 16 HA LYS 16 -23.478 1.647 -54.906 132 HB2 LYS 16 HB2 LYS 16 -23.641 4.379 -56.204 133 HB3 LYS 16 HB1 LYS 16 -22.326 3.222 -56.384 134 HG2 LYS 16 HG2 LYS 16 -25.188 2.615 -57.167 135 HG3 LYS 16 HG1 LYS 16 -23.994 3.248 -58.294 136 HD2 LYS 16 HD2 LYS 16 -22.529 1.253 -57.657 137 HD3 LYS 16 HD1 LYS 16 -23.949 0.590 -56.848 138 HE2 LYS 16 HE2 LYS 16 -23.875 1.412 -59.760 139 HE3 LYS 16 HE1 LYS 16 -23.713 -0.246 -59.181 140 HZ1 LYS 16 HZ1 LYS 16 -26.057 1.190 -59.645 141 HZ2 LYS 16 HZ2 LYS 16 -25.957 0.924 -57.969 142 HZ3 LYS 16 HZ3 LYS 16 -25.903 -0.388 -59.045 143 H ASP 17 HN ASP 17 -24.326 2.656 -52.415 144 HA ASP 17 HA ASP 17 -22.460 4.776 -51.666 145 HB2 ASP 17 HB2 ASP 17 -23.497 4.635 -49.476 146 HB3 ASP 17 HB1 ASP 17 -24.754 4.683 -50.710 147 H ASN 18 HN ASN 18 -22.125 1.586 -52.260 148 HA ASN 18 HA ASN 18 -20.768 0.575 -50.002 149 HB2 ASN 18 HB2 ASN 18 -20.621 -0.124 -52.935 150 HB3 ASN 18 HB1 ASN 18 -19.733 -1.008 -51.696 151 HD21 ASN 18 HD21 ASN 18 -21.826 -2.219 -53.290 152 HD22 ASN 18 HD22 ASN 18 -23.102 -2.617 -52.244 153 H VAL 19 HN VAL 19 -19.643 2.386 -52.825 154 HA VAL 19 HA VAL 19 -16.867 2.179 -52.174 155 HB VAL 19 HB VAL 19 -16.643 4.082 -53.810 156 HG11 VAL 19 HG11 VAL 19 -17.089 2.727 -55.711 157 HG12 VAL 19 HG12 VAL 19 -18.418 1.893 -54.908 158 HG13 VAL 19 HG13 VAL 19 -16.754 1.581 -54.416 159 HG21 VAL 19 HG21 VAL 19 -18.867 5.093 -53.287 160 HG22 VAL 19 HG22 VAL 19 -19.641 3.712 -54.065 161 HG23 VAL 19 HG23 VAL 19 -18.636 4.809 -55.013 162 H GLU 20 HN GLU 20 -19.463 4.334 -51.286 163 HA GLU 20 HA GLU 20 -17.887 6.469 -50.283 164 HB2 GLU 20 HB2 GLU 20 -20.693 5.557 -49.626 165 HB3 GLU 20 HB1 GLU 20 -19.962 7.004 -48.932 166 HG2 GLU 20 HG2 GLU 20 -20.169 6.515 -51.917 167 HG3 GLU 20 HG1 GLU 20 -21.361 7.426 -50.997 168 H LEU 21 HN LEU 21 -19.125 3.492 -48.835 169 HA LEU 21 HA LEU 21 -18.362 4.060 -46.165 170 HB2 LEU 21 HB2 LEU 21 -18.780 1.450 -47.629 171 HB3 LEU 21 HB1 LEU 21 -18.416 1.534 -45.909 172 HG LEU 21 HG LEU 21 -20.767 2.960 -47.204 173 HD11 LEU 21 HD11 LEU 21 -20.706 0.332 -45.693 174 HD12 LEU 21 HD12 LEU 21 -20.970 0.506 -47.427 175 HD13 LEU 21 HD13 LEU 21 -22.152 1.148 -46.288 176 HD21 LEU 21 HD21 LEU 21 -21.503 2.746 -44.662 177 HD22 LEU 21 HD22 LEU 21 -20.432 4.049 -45.161 178 HD23 LEU 21 HD23 LEU 21 -19.767 2.617 -44.379 179 H GLU 22 HN GLU 22 -16.668 2.545 -48.869 180 HA GLU 22 HA GLU 22 -14.384 1.689 -47.448 181 HB2 GLU 22 HB2 GLU 22 -14.792 2.446 -50.344 182 HB3 GLU 22 HB1 GLU 22 -13.279 1.784 -49.721 183 HG2 GLU 22 HG2 GLU 22 -14.396 -0.240 -48.993 184 HG3 GLU 22 HG1 GLU 22 -15.970 0.430 -49.414 185 H ARG 23 HN ARG 23 -15.183 4.748 -49.036 186 HA ARG 23 HA ARG 23 -12.660 5.976 -48.829 187 HB2 ARG 23 HB2 ARG 23 -14.500 6.875 -50.202 188 HB3 ARG 23 HB1 ARG 23 -15.400 7.267 -48.736 189 HG2 ARG 23 HG2 ARG 23 -13.659 8.817 -48.026 190 HG3 ARG 23 HG1 ARG 23 -12.645 8.353 -49.394 191 HD2 ARG 23 HD2 ARG 23 -14.324 9.222 -50.956 192 HD3 ARG 23 HD1 ARG 23 -15.385 9.632 -49.612 193 HE ARG 23 HE ARG 23 -14.054 11.499 -49.186 194 HH11 ARG 23 HH11 ARG 23 -12.382 12.941 -49.720 195 HH12 ARG 23 HH12 ARG 23 -11.166 12.464 -50.857 196 HH21 ARG 23 HH21 ARG 23 -12.523 9.319 -51.394 197 HH22 ARG 23 HH22 ARG 23 -11.245 10.415 -51.805 198 H LEU 24 HN LEU 24 -15.420 5.921 -46.592 199 HA LEU 24 HA LEU 24 -14.350 7.664 -44.660 200 HB2 LEU 24 HB2 LEU 24 -16.714 7.003 -44.684 201 HB3 LEU 24 HB1 LEU 24 -16.266 5.342 -44.307 202 HG LEU 24 HG LEU 24 -15.302 6.089 -42.152 203 HD11 LEU 24 HD11 LEU 24 -14.570 8.298 -42.444 204 HD12 LEU 24 HD12 LEU 24 -16.043 8.531 -41.506 205 HD13 LEU 24 HD13 LEU 24 -16.059 8.794 -43.251 206 HD21 LEU 24 HD21 LEU 24 -18.095 7.212 -42.478 207 HD22 LEU 24 HD22 LEU 24 -17.392 6.468 -41.043 208 HD23 LEU 24 HD23 LEU 24 -17.760 5.481 -42.458 209 H LYS 25 HN LYS 25 -14.155 4.132 -44.992 210 HA LYS 25 HA LYS 25 -12.718 3.637 -42.612 211 HB2 LYS 25 HB2 LYS 25 -13.850 1.873 -43.928 212 HB3 LYS 25 HB1 LYS 25 -12.659 2.082 -45.211 213 HG2 LYS 25 HG2 LYS 25 -10.854 1.451 -43.661 214 HG3 LYS 25 HG1 LYS 25 -12.028 1.275 -42.355 215 HD2 LYS 25 HD2 LYS 25 -13.179 -0.500 -43.623 216 HD3 LYS 25 HD1 LYS 25 -12.010 -0.324 -44.933 217 HE2 LYS 25 HE2 LYS 25 -10.185 -0.943 -43.397 218 HE3 LYS 25 HE1 LYS 25 -11.344 -1.110 -42.079 219 HZ1 LYS 25 HZ1 LYS 25 -11.222 -2.715 -44.572 220 HZ2 LYS 25 HZ2 LYS 25 -12.500 -2.795 -43.456 221 HZ3 LYS 25 HZ3 LYS 25 -10.932 -3.255 -42.991 222 H ASN 26 HN ASN 26 -10.641 3.931 -42.080 223 HA ASN 26 HA ASN 26 -8.644 4.399 -44.215 224 HB2 ASN 26 HB2 ASN 26 -9.546 6.549 -43.108 225 HB3 ASN 26 HB1 ASN 26 -8.676 6.019 -41.670 226 HD21 ASN 26 HD21 ASN 26 -7.014 7.641 -41.750 227 HD22 ASN 26 HD22 ASN 26 -5.872 7.714 -43.006 228 H GLU 27 HN GLU 27 -9.356 3.509 -40.879 229 HA GLU 27 HA GLU 27 -6.847 1.931 -40.805 230 HB2 GLU 27 HB2 GLU 27 -7.991 3.654 -38.594 231 HB3 GLU 27 HB1 GLU 27 -6.671 2.502 -38.383 232 HG2 GLU 27 HG2 GLU 27 -5.332 3.709 -40.054 233 HG3 GLU 27 HG1 GLU 27 -6.653 4.847 -40.307 234 H ARG 28 HN ARG 28 -6.958 -0.014 -39.686 235 HA ARG 28 HA ARG 28 -9.443 -1.350 -39.701 236 HB2 ARG 28 HB2 ARG 28 -6.799 -2.025 -38.392 237 HB3 ARG 28 HB1 ARG 28 -8.177 -3.121 -38.397 238 HG2 ARG 28 HG2 ARG 28 -7.144 -1.961 -40.983 239 HG3 ARG 28 HG1 ARG 28 -6.367 -3.369 -40.265 240 HD2 ARG 28 HD2 ARG 28 -9.305 -3.170 -41.017 241 HD3 ARG 28 HD1 ARG 28 -8.072 -4.052 -41.903 242 HE ARG 28 HE ARG 28 -9.335 -4.869 -39.418 243 HH11 ARG 28 HH11 ARG 28 -8.770 -6.948 -38.698 244 HH12 ARG 28 HH12 ARG 28 -7.418 -7.768 -39.407 245 HH21 ARG 28 HH21 ARG 28 -6.655 -5.182 -41.587 246 HH22 ARG 28 HH22 ARG 28 -6.221 -6.767 -41.042 247 H HIS 29 HN HIS 29 -7.582 0.176 -37.118 248 HA HIS 29 HA HIS 29 -9.121 -0.698 -34.935 249 HB2 HIS 29 HB2 HIS 29 -6.953 0.377 -34.632 250 HB3 HIS 29 HB1 HIS 29 -7.582 1.885 -35.293 251 HD2 HIS 29 HD2 HIS 29 -8.706 3.535 -33.375 252 HE1 HIS 29 HE1 HIS 29 -9.173 0.654 -30.323 253 HE2 HIS 29 HE2 HIS 29 -9.420 3.117 -30.898 254 H ASP 30 HN ASP 30 -9.419 2.217 -36.957 255 HA ASP 30 HA ASP 30 -11.598 3.367 -35.592 256 HB2 ASP 30 HB2 ASP 30 -10.671 3.576 -38.458 257 HB3 ASP 30 HB1 ASP 30 -12.013 4.520 -37.814 258 H HIS 31 HN HIS 31 -11.443 1.020 -38.230 259 HA HIS 31 HA HIS 31 -14.182 0.937 -38.865 260 HB2 HIS 31 HB2 HIS 31 -12.422 -0.081 -40.264 261 HB3 HIS 31 HB1 HIS 31 -12.151 -1.303 -39.023 262 HD2 HIS 31 HD2 HIS 31 -14.827 -0.412 -41.756 263 HE1 HIS 31 HE1 HIS 31 -15.917 -4.096 -40.006 264 HE2 HIS 31 HE2 HIS 31 -16.444 -2.459 -41.875 265 H ASP 32 HN ASP 32 -12.275 -0.943 -36.534 266 HA ASP 32 HA ASP 32 -14.314 -2.677 -35.685 267 HB2 ASP 32 HB2 ASP 32 -11.858 -1.625 -34.276 268 HB3 ASP 32 HB1 ASP 32 -12.916 -2.854 -33.581 269 H GLU 33 HN GLU 33 -13.408 0.563 -34.603 270 HA GLU 33 HA GLU 33 -14.461 2.082 -33.235 271 HB2 GLU 33 HB2 GLU 33 -16.906 0.439 -33.948 272 HB3 GLU 33 HB1 GLU 33 -16.922 2.045 -33.223 273 HG2 GLU 33 HG2 GLU 33 -15.716 2.939 -35.188 274 HG3 GLU 33 HG1 GLU 33 -15.735 1.334 -35.918 275 H GLU 34 HN GLU 34 -13.288 -0.296 -32.038 276 HA GLU 34 HA GLU 34 -14.940 -1.441 -30.061 277 HB2 GLU 34 HB2 GLU 34 -12.740 -2.360 -30.718 278 HB3 GLU 34 HB1 GLU 34 -11.949 -0.968 -29.980 279 HG2 GLU 34 HG2 GLU 34 -12.872 -1.570 -27.790 280 HG3 GLU 34 HG1 GLU 34 -13.742 -2.923 -28.509 281 H ALA 35 HN ALA 35 -12.876 1.441 -30.037 282 HA ALA 35 HA ALA 35 -13.128 2.076 -27.307 283 HB1 ALA 35 HB1 ALA 35 -12.828 4.024 -29.601 284 HB2 ALA 35 HB2 ALA 35 -11.495 3.110 -28.896 285 HB3 ALA 35 HB3 ALA 35 -12.371 4.288 -27.919 286 H GLU 36 HN GLU 36 -15.139 2.904 -30.101 287 HA GLU 36 HA GLU 36 -16.851 4.733 -28.815 288 HB2 GLU 36 HB2 GLU 36 -16.747 4.438 -31.268 289 HB3 GLU 36 HB1 GLU 36 -17.489 2.848 -31.095 290 HG2 GLU 36 HG2 GLU 36 -19.495 3.856 -30.113 291 HG3 GLU 36 HG1 GLU 36 -18.752 5.453 -30.195 292 H ARG 37 HN ARG 37 -17.012 1.210 -29.173 293 HA ARG 37 HA ARG 37 -19.548 0.861 -27.976 294 HB2 ARG 37 HB2 ARG 37 -17.170 -0.988 -28.235 295 HB3 ARG 37 HB1 ARG 37 -18.703 -1.498 -27.534 296 HG2 ARG 37 HG2 ARG 37 -18.665 -0.194 -30.254 297 HG3 ARG 37 HG1 ARG 37 -18.257 -1.899 -30.096 298 HD2 ARG 37 HD2 ARG 37 -20.422 -2.298 -28.957 299 HD3 ARG 37 HD1 ARG 37 -20.838 -0.602 -29.162 300 HE ARG 37 HE ARG 37 -20.190 -1.643 -31.688 301 HH11 ARG 37 HH11 ARG 37 -21.865 -2.242 -33.098 302 HH12 ARG 37 HH12 ARG 37 -23.442 -2.585 -32.466 303 HH21 ARG 37 HH21 ARG 37 -22.543 -1.977 -29.172 304 HH22 ARG 37 HH22 ARG 37 -23.825 -2.435 -30.242 305 H LYS 38 HN LYS 38 -16.282 0.987 -26.640 306 HA LYS 38 HA LYS 38 -16.925 0.231 -24.000 307 HB2 LYS 38 HB2 LYS 38 -14.720 1.979 -25.110 308 HB3 LYS 38 HB1 LYS 38 -14.810 1.501 -23.418 309 HG2 LYS 38 HG2 LYS 38 -14.909 -0.581 -25.600 310 HG3 LYS 38 HG1 LYS 38 -13.364 0.065 -25.056 311 HD2 LYS 38 HD2 LYS 38 -13.990 -0.570 -22.706 312 HD3 LYS 38 HD1 LYS 38 -15.432 -1.356 -23.346 313 HE2 LYS 38 HE2 LYS 38 -14.030 -2.821 -24.740 314 HE3 LYS 38 HE1 LYS 38 -12.580 -2.036 -24.112 315 HZ1 LYS 38 HZ1 LYS 38 -14.251 -2.861 -21.985 316 HZ2 LYS 38 HZ2 LYS 38 -12.648 -3.311 -22.321 317 HZ3 LYS 38 HZ3 LYS 38 -13.939 -4.177 -23.010 318 H ALA 39 HN ALA 39 -16.929 3.364 -25.632 319 HA ALA 39 HA ALA 39 -17.385 4.983 -23.374 320 HB1 ALA 39 HB1 ALA 39 -18.132 6.674 -24.951 321 HB2 ALA 39 HB2 ALA 39 -18.358 5.451 -26.202 322 HB3 ALA 39 HB3 ALA 39 -16.735 5.832 -25.623 323 H LEU 40 HN LEU 40 -19.606 3.260 -25.524 324 HA LEU 40 HA LEU 40 -22.013 4.322 -24.528 325 HB2 LEU 40 HB2 LEU 40 -21.895 3.035 -26.612 326 HB3 LEU 40 HB1 LEU 40 -21.458 1.589 -25.709 327 HG LEU 40 HG LEU 40 -23.632 1.664 -24.527 328 HD11 LEU 40 HD11 LEU 40 -25.353 3.286 -25.680 329 HD12 LEU 40 HD12 LEU 40 -23.917 4.207 -26.124 330 HD13 LEU 40 HD13 LEU 40 -24.289 3.913 -24.425 331 HD21 LEU 40 HD21 LEU 40 -25.072 1.236 -26.575 332 HD22 LEU 40 HD22 LEU 40 -23.561 0.329 -26.523 333 HD23 LEU 40 HD23 LEU 40 -23.699 1.754 -27.553 334 H GLU 41 HN GLU 41 -20.132 1.471 -23.558 335 HA GLU 41 HA GLU 41 -21.928 0.563 -21.565 336 HB2 GLU 41 HB2 GLU 41 -18.956 0.156 -21.925 337 HB3 GLU 41 HB1 GLU 41 -19.886 -0.620 -20.644 338 HG2 GLU 41 HG2 GLU 41 -20.586 -0.855 -23.586 339 HG3 GLU 41 HG1 GLU 41 -19.597 -2.028 -22.723 340 H ASP 42 HN ASP 42 -19.201 2.811 -21.482 341 HA ASP 42 HA ASP 42 -19.059 3.154 -18.692 342 HB2 ASP 42 HB2 ASP 42 -17.330 3.947 -20.275 343 HB3 ASP 42 HB1 ASP 42 -18.449 5.180 -20.855 344 H LYS 43 HN LYS 43 -20.939 4.867 -21.169 345 HA LYS 43 HA LYS 43 -22.081 6.794 -19.439 346 HB2 LYS 43 HB2 LYS 43 -23.015 5.661 -22.079 347 HB3 LYS 43 HB1 LYS 43 -23.865 6.953 -21.234 348 HG2 LYS 43 HG2 LYS 43 -21.817 8.334 -21.273 349 HG3 LYS 43 HG1 LYS 43 -20.964 7.049 -22.127 350 HD2 LYS 43 HD2 LYS 43 -22.587 7.207 -23.985 351 HD3 LYS 43 HD1 LYS 43 -23.414 8.515 -23.138 352 HE2 LYS 43 HE2 LYS 43 -20.508 8.574 -24.001 353 HE3 LYS 43 HE1 LYS 43 -21.831 9.373 -24.852 354 HZ1 LYS 43 HZ1 LYS 43 -21.238 11.080 -23.533 355 HZ2 LYS 43 HZ2 LYS 43 -20.532 10.084 -22.352 356 HZ3 LYS 43 HZ3 LYS 43 -22.217 10.291 -22.396 357 H LEU 44 HN LEU 44 -23.092 3.543 -20.388 358 HA LEU 44 HA LEU 44 -25.647 3.570 -19.208 359 HB2 LEU 44 HB2 LEU 44 -24.928 1.823 -20.775 360 HB3 LEU 44 HB1 LEU 44 -23.739 1.251 -19.610 361 HG LEU 44 HG LEU 44 -25.556 0.699 -18.021 362 HD11 LEU 44 HD11 LEU 44 -27.330 2.173 -18.449 363 HD12 LEU 44 HD12 LEU 44 -27.927 0.680 -19.166 364 HD13 LEU 44 HD13 LEU 44 -27.241 1.937 -20.195 365 HD21 LEU 44 HD21 LEU 44 -24.826 -1.058 -19.512 366 HD22 LEU 44 HD22 LEU 44 -25.823 -0.427 -20.822 367 HD23 LEU 44 HD23 LEU 44 -26.584 -1.146 -19.403 368 H ALA 45 HN ALA 45 -22.472 2.647 -17.918 369 HA ALA 45 HA ALA 45 -23.336 1.768 -15.386 370 HB1 ALA 45 HB1 ALA 45 -20.704 3.142 -15.941 371 HB2 ALA 45 HB2 ALA 45 -21.033 1.479 -16.428 372 HB3 ALA 45 HB3 ALA 45 -21.054 1.919 -14.720 373 H ASP 46 HN ASP 46 -22.459 4.973 -16.599 374 HA ASP 46 HA ASP 46 -22.482 6.347 -14.141 375 HB2 ASP 46 HB2 ASP 46 -23.041 7.255 -16.966 376 HB3 ASP 46 HB1 ASP 46 -22.991 8.364 -15.596 377 H LYS 47 HN LYS 47 -25.073 5.574 -16.427 378 HA LYS 47 HA LYS 47 -27.063 6.974 -14.811 379 HB2 LYS 47 HB2 LYS 47 -27.279 5.331 -17.345 380 HB3 LYS 47 HB1 LYS 47 -28.645 6.115 -16.551 381 HG2 LYS 47 HG2 LYS 47 -27.532 8.305 -16.791 382 HG3 LYS 47 HG1 LYS 47 -26.169 7.524 -17.591 383 HD2 LYS 47 HD2 LYS 47 -27.666 6.729 -19.381 384 HD3 LYS 47 HD1 LYS 47 -29.033 7.510 -18.586 385 HE2 LYS 47 HE2 LYS 47 -27.931 9.702 -18.828 386 HE3 LYS 47 HE1 LYS 47 -26.558 8.926 -19.617 387 HZ1 LYS 47 HZ1 LYS 47 -29.170 8.330 -20.736 388 HZ2 LYS 47 HZ2 LYS 47 -27.693 8.638 -21.519 389 HZ3 LYS 47 HZ3 LYS 47 -28.635 9.926 -20.937 390 H GLN 48 HN GLN 48 -27.337 5.916 -12.899 391 HA GLN 48 HA GLN 48 -27.310 3.120 -12.545 392 HB2 GLN 48 HB2 GLN 48 -27.041 4.801 -10.717 393 HB3 GLN 48 HB1 GLN 48 -28.756 5.182 -10.863 394 HG2 GLN 48 HG2 GLN 48 -28.424 3.582 -9.044 395 HG3 GLN 48 HG1 GLN 48 -29.301 2.807 -10.359 396 HE21 GLN 48 HE21 GLN 48 -28.541 0.713 -10.654 397 HE22 GLN 48 HE22 GLN 48 -26.915 0.241 -10.531 398 H GLU 49 HN GLU 49 -29.957 5.401 -13.143 399 HA GLU 49 HA GLU 49 -31.578 3.425 -14.399 400 HB2 GLU 49 HB2 GLU 49 -31.733 2.868 -11.880 401 HB3 GLU 49 HB1 GLU 49 -32.691 4.341 -11.747 402 HG2 GLU 49 HG2 GLU 49 -34.264 3.476 -13.443 403 HG3 GLU 49 HG1 GLU 49 -33.300 2.009 -13.591 404 H HIS 50 HN HIS 50 -30.681 6.026 -15.081 405 HA HIS 50 HA HIS 50 -32.557 8.065 -14.539 406 HB2 HIS 50 HB2 HIS 50 -30.631 7.639 -16.827 407 HB3 HIS 50 HB1 HIS 50 -31.627 9.086 -16.670 408 HD2 HIS 50 HD2 HIS 50 -30.688 8.198 -13.151 409 HE1 HIS 50 HE1 HIS 50 -27.522 10.647 -14.494 410 HE2 HIS 50 HE2 HIS 50 -28.597 9.596 -12.448 411 H LEU 51 HN LEU 51 -32.384 5.624 -17.101 412 HA LEU 51 HA LEU 51 -33.928 4.952 -18.681 413 HB2 LEU 51 HB2 LEU 51 -35.909 6.102 -16.703 414 HB3 LEU 51 HB1 LEU 51 -36.246 4.908 -17.956 415 HG LEU 51 HG LEU 51 -34.313 4.504 -15.656 416 HD11 LEU 51 HD11 LEU 51 -37.132 3.499 -16.125 417 HD12 LEU 51 HD12 LEU 51 -36.609 4.607 -14.859 418 HD13 LEU 51 HD13 LEU 51 -36.068 2.928 -14.839 419 HD21 LEU 51 HD21 LEU 51 -35.204 2.808 -17.992 420 HD22 LEU 51 HD22 LEU 51 -34.694 2.042 -16.489 421 HD23 LEU 51 HD23 LEU 51 -33.574 3.071 -17.375 422 H ASP 52 HN ASP 52 -33.145 7.993 -18.189 423 HA ASP 52 HA ASP 52 -35.163 9.580 -19.331 424 HB2 ASP 52 HB2 ASP 52 -33.178 10.487 -18.164 425 HB3 ASP 52 HB1 ASP 52 -32.166 9.970 -19.513 426 H GLY 53 HN GLY 53 -32.463 7.822 -20.834 427 HA2 GLY 53 HA2 GLY 53 -32.307 6.958 -22.984 428 HA3 GLY 53 HA1 GLY 53 -33.926 7.571 -23.307 429 H ALA 54 HN ALA 54 -31.787 9.888 -21.989 430 HA ALA 54 HA ALA 54 -31.966 11.616 -24.199 431 HB1 ALA 54 HB1 ALA 54 -31.448 12.281 -21.830 432 HB2 ALA 54 HB2 ALA 54 -30.392 13.015 -23.037 433 HB3 ALA 54 HB3 ALA 54 -29.817 11.654 -22.073 434 H LEU 55 HN LEU 55 -29.450 9.327 -23.216 435 HA LEU 55 HA LEU 55 -27.496 10.070 -25.095 436 HB2 LEU 55 HB2 LEU 55 -27.009 8.601 -23.197 437 HB3 LEU 55 HB1 LEU 55 -28.055 7.356 -23.873 438 HG LEU 55 HG LEU 55 -26.581 7.192 -25.856 439 HD11 LEU 55 HD11 LEU 55 -25.169 9.454 -24.451 440 HD12 LEU 55 HD12 LEU 55 -25.589 9.296 -26.157 441 HD13 LEU 55 HD13 LEU 55 -24.256 8.360 -25.491 442 HD21 LEU 55 HD21 LEU 55 -25.182 6.970 -23.175 443 HD22 LEU 55 HD22 LEU 55 -24.608 6.227 -24.667 444 HD23 LEU 55 HD23 LEU 55 -26.143 5.718 -23.964 445 H ARG 56 HN ARG 56 -30.111 7.659 -25.292 446 HA ARG 56 HA ARG 56 -29.481 6.699 -27.871 447 HB2 ARG 56 HB2 ARG 56 -32.081 6.799 -26.336 448 HB3 ARG 56 HB1 ARG 56 -31.907 5.990 -27.895 449 HG2 ARG 56 HG2 ARG 56 -30.228 4.493 -27.002 450 HG3 ARG 56 HG1 ARG 56 -30.183 5.381 -25.478 451 HD2 ARG 56 HD2 ARG 56 -32.669 4.035 -26.549 452 HD3 ARG 56 HD1 ARG 56 -31.562 3.264 -25.417 453 HE ARG 56 HE ARG 56 -32.278 5.750 -24.340 454 HH11 ARG 56 HH11 ARG 56 -33.903 5.853 -22.753 455 HH12 ARG 56 HH12 ARG 56 -35.063 4.572 -22.625 456 HH21 ARG 56 HH21 ARG 56 -33.714 2.733 -25.237 457 HH22 ARG 56 HH22 ARG 56 -34.956 2.807 -24.032 458 H TYR 57 HN TYR 57 -31.563 9.332 -26.761 459 HA TYR 57 HA TYR 57 -32.109 10.129 -29.550 460 HB2 TYR 57 HB2 TYR 57 -33.351 10.879 -26.900 461 HB3 TYR 57 HB1 TYR 57 -33.720 11.721 -28.401 462 HD1 TYR 57 HD1 TYR 57 -34.060 8.569 -26.542 463 HD2 TYR 57 HD2 TYR 57 -34.910 10.600 -30.229 464 HE1 TYR 57 HE1 TYR 57 -35.673 6.787 -27.150 465 HE2 TYR 57 HE2 TYR 57 -36.522 8.817 -30.839 466 HH TYR 57 HH TYR 57 -37.022 6.536 -30.317 Start of MODEL 8 1 H1 GLY 1 HT1 GLY 1 11.731 37.833 -38.793 2 H2 GLY 1 HT2 GLY 1 10.657 37.077 -39.871 3 H3 GLY 1 HT3 GLY 1 11.687 36.141 -38.895 4 HA2 GLY 1 HA2 GLY 1 10.518 36.643 -36.946 5 HA3 GLY 1 HA1 GLY 1 9.654 37.958 -37.746 6 H SER 2 HN SER 2 9.281 36.398 -40.216 7 HA SER 2 HA SER 2 6.764 35.248 -39.641 8 HB2 SER 2 HB2 SER 2 6.783 34.512 -41.966 9 HB3 SER 2 HB1 SER 2 7.396 36.159 -41.856 10 HG SER 2 HG SER 2 8.969 33.792 -41.946 11 H LYS 3 HN LYS 3 9.977 33.976 -39.564 12 HA LYS 3 HA LYS 3 9.438 31.235 -39.937 13 HB2 LYS 3 HB2 LYS 3 11.591 30.847 -38.868 14 HB3 LYS 3 HB1 LYS 3 11.711 32.220 -39.965 15 HG2 LYS 3 HG2 LYS 3 11.391 33.760 -38.036 16 HG3 LYS 3 HG1 LYS 3 11.359 32.368 -36.953 17 HD2 LYS 3 HD2 LYS 3 13.626 31.744 -37.644 18 HD3 LYS 3 HD1 LYS 3 13.667 33.094 -38.778 19 HE2 LYS 3 HE2 LYS 3 14.830 33.718 -36.715 20 HE3 LYS 3 HE1 LYS 3 13.351 34.666 -36.873 21 HZ1 LYS 3 HZ1 LYS 3 13.942 33.432 -34.654 22 HZ2 LYS 3 HZ2 LYS 3 13.215 32.115 -35.443 23 HZ3 LYS 3 HZ3 LYS 3 12.337 33.547 -35.191 24 H THR 4 HN THR 4 8.732 33.355 -37.330 25 HA THR 4 HA THR 4 8.469 31.220 -35.354 26 HB THR 4 HB THR 4 7.800 33.054 -33.846 27 HG1 THR 4 HG1 THR 4 6.829 34.536 -35.048 28 HG21 THR 4 HG21 THR 4 9.946 34.006 -33.642 29 HG22 THR 4 HG22 THR 4 10.229 33.958 -35.381 30 HG23 THR 4 HG23 THR 4 10.246 32.464 -34.442 31 H ILE 5 HN ILE 5 6.644 32.239 -37.890 32 HA ILE 5 HA ILE 5 4.068 32.580 -36.839 33 HB ILE 5 HB ILE 5 4.779 32.983 -39.229 34 HG12 ILE 5 HG12 ILE 5 2.357 31.182 -38.967 35 HG13 ILE 5 HG11 ILE 5 2.377 32.855 -38.409 36 HG21 ILE 5 HG21 ILE 5 4.820 31.149 -40.779 37 HG22 ILE 5 HG22 ILE 5 4.277 30.013 -39.547 38 HG23 ILE 5 HG23 ILE 5 5.892 30.711 -39.452 39 HD11 ILE 5 HD11 ILE 5 2.832 33.665 -40.641 40 HD12 ILE 5 HD12 ILE 5 1.453 32.570 -40.734 41 HD13 ILE 5 HD13 ILE 5 3.052 32.023 -41.242 42 H GLN 6 HN GLN 6 6.030 29.756 -37.121 43 HA GLN 6 HA GLN 6 3.998 27.778 -37.136 44 HB2 GLN 6 HB2 GLN 6 6.860 27.727 -36.153 45 HB3 GLN 6 HB1 GLN 6 5.818 26.306 -36.146 46 HG2 GLN 6 HG2 GLN 6 6.495 27.941 -38.615 47 HG3 GLN 6 HG1 GLN 6 7.256 26.416 -38.176 48 HE21 GLN 6 HE21 GLN 6 5.414 24.625 -37.644 49 HE22 GLN 6 HE22 GLN 6 4.187 24.536 -38.813 50 H GLU 7 HN GLU 7 5.644 29.517 -34.551 51 HA GLU 7 HA GLU 7 4.622 28.057 -32.364 52 HB2 GLU 7 HB2 GLU 7 5.563 30.915 -32.612 53 HB3 GLU 7 HB1 GLU 7 5.059 30.205 -31.078 54 HG2 GLU 7 HG2 GLU 7 6.786 28.519 -31.212 55 HG3 GLU 7 HG1 GLU 7 7.213 29.009 -32.847 56 H LYS 8 HN LYS 8 3.338 30.749 -34.213 57 HA LYS 8 HA LYS 8 1.198 31.486 -32.568 58 HB2 LYS 8 HB2 LYS 8 2.036 32.696 -34.595 59 HB3 LYS 8 HB1 LYS 8 1.211 31.498 -35.593 60 HG2 LYS 8 HG2 LYS 8 -0.910 32.088 -34.263 61 HG3 LYS 8 HG1 LYS 8 -0.016 33.479 -33.664 62 HD2 LYS 8 HD2 LYS 8 -0.536 32.849 -36.585 63 HD3 LYS 8 HD1 LYS 8 -1.382 34.068 -35.638 64 HE2 LYS 8 HE2 LYS 8 1.570 34.049 -36.332 65 HE3 LYS 8 HE1 LYS 8 0.349 35.158 -36.940 66 HZ1 LYS 8 HZ1 LYS 8 0.101 35.323 -34.234 67 HZ2 LYS 8 HZ2 LYS 8 0.882 36.449 -35.237 68 HZ3 LYS 8 HZ3 LYS 8 1.777 35.228 -34.467 69 H GLU 9 HN GLU 9 1.457 28.930 -35.006 70 HA GLU 9 HA GLU 9 -1.270 28.255 -35.150 71 HB2 GLU 9 HB2 GLU 9 1.220 26.610 -35.598 72 HB3 GLU 9 HB1 GLU 9 -0.402 25.971 -35.860 73 HG2 GLU 9 HG2 GLU 9 -0.871 27.652 -37.529 74 HG3 GLU 9 HG1 GLU 9 0.632 28.501 -37.176 75 H GLN 10 HN GLN 10 1.267 27.034 -32.941 76 HA GLN 10 HA GLN 10 -0.414 25.120 -31.678 77 HB2 GLN 10 HB2 GLN 10 2.106 26.510 -30.752 78 HB3 GLN 10 HB1 GLN 10 1.268 25.308 -29.773 79 HG2 GLN 10 HG2 GLN 10 2.936 24.095 -30.959 80 HG3 GLN 10 HG1 GLN 10 1.434 23.751 -31.809 81 HE21 GLN 10 HE21 GLN 10 1.940 23.681 -34.007 82 HE22 GLN 10 HE22 GLN 10 2.896 24.828 -34.815 83 H GLU 11 HN GLU 11 0.268 28.522 -31.034 84 HA GLU 11 HA GLU 11 -1.072 28.706 -28.560 85 HB2 GLU 11 HB2 GLU 11 -0.508 30.756 -30.705 86 HB3 GLU 11 HB1 GLU 11 -1.242 31.160 -29.152 87 HG2 GLU 11 HG2 GLU 11 0.693 30.328 -27.953 88 HG3 GLU 11 HG1 GLU 11 1.406 29.719 -29.445 89 H LEU 12 HN LEU 12 -2.209 29.048 -31.894 90 HA LEU 12 HA LEU 12 -4.809 29.978 -31.283 91 HB2 LEU 12 HB2 LEU 12 -3.716 28.484 -33.668 92 HB3 LEU 12 HB1 LEU 12 -5.378 29.059 -33.581 93 HG LEU 12 HG LEU 12 -2.954 30.858 -33.233 94 HD11 LEU 12 HD11 LEU 12 -4.618 30.206 -35.675 95 HD12 LEU 12 HD12 LEU 12 -2.875 30.025 -35.478 96 HD13 LEU 12 HD13 LEU 12 -3.589 31.634 -35.565 97 HD21 LEU 12 HD21 LEU 12 -4.878 32.540 -33.972 98 HD22 LEU 12 HD22 LEU 12 -4.729 32.046 -32.291 99 HD23 LEU 12 HD23 LEU 12 -5.936 31.285 -33.326 100 H LYS 13 HN LYS 13 -3.520 26.693 -31.689 101 HA LYS 13 HA LYS 13 -5.954 25.652 -30.363 102 HB2 LYS 13 HB2 LYS 13 -4.673 24.540 -32.870 103 HB3 LYS 13 HB1 LYS 13 -5.914 23.714 -31.927 104 HG2 LYS 13 HG2 LYS 13 -7.452 25.613 -32.286 105 HG3 LYS 13 HG1 LYS 13 -6.214 26.431 -33.241 106 HD2 LYS 13 HD2 LYS 13 -6.214 24.578 -34.858 107 HD3 LYS 13 HD1 LYS 13 -7.425 23.729 -33.897 108 HE2 LYS 13 HE2 LYS 13 -8.516 24.907 -35.748 109 HE3 LYS 13 HE1 LYS 13 -8.983 25.641 -34.214 110 HZ1 LYS 13 HZ1 LYS 13 -7.611 27.455 -34.568 111 HZ2 LYS 13 HZ2 LYS 13 -8.250 27.163 -36.114 112 HZ3 LYS 13 HZ3 LYS 13 -6.672 26.661 -35.736 113 H ASN 14 HN ASN 14 -5.621 23.945 -28.987 114 HA ASN 14 HA ASN 14 -3.055 23.608 -27.866 115 HB2 ASN 14 HB2 ASN 14 -5.592 21.988 -27.637 116 HB3 ASN 14 HB1 ASN 14 -4.134 21.618 -26.718 117 HD21 ASN 14 HD21 ASN 14 -6.605 22.449 -25.460 118 HD22 ASN 14 HD22 ASN 14 -6.327 23.958 -24.733 119 H LEU 15 HN LEU 15 -4.890 21.689 -30.205 120 HA LEU 15 HA LEU 15 -2.505 20.586 -31.324 121 HB2 LEU 15 HB2 LEU 15 -3.232 18.160 -30.829 122 HB3 LEU 15 HB1 LEU 15 -2.415 19.052 -29.550 123 HG LEU 15 HG LEU 15 -4.650 19.640 -28.588 124 HD11 LEU 15 HD11 LEU 15 -5.561 17.978 -30.932 125 HD12 LEU 15 HD12 LEU 15 -6.207 19.506 -30.334 126 HD13 LEU 15 HD13 LEU 15 -6.525 18.016 -29.454 127 HD21 LEU 15 HD21 LEU 15 -5.032 17.457 -27.599 128 HD22 LEU 15 HD22 LEU 15 -3.298 17.652 -27.853 129 HD23 LEU 15 HD23 LEU 15 -4.243 16.658 -28.960 130 H LYS 16 HN LYS 16 -3.122 18.772 -32.945 131 HA LYS 16 HA LYS 16 -5.023 19.855 -34.743 132 HB2 LYS 16 HB2 LYS 16 -3.066 18.517 -35.457 133 HB3 LYS 16 HB1 LYS 16 -3.799 17.091 -34.720 134 HG2 LYS 16 HG2 LYS 16 -5.647 17.139 -36.246 135 HG3 LYS 16 HG1 LYS 16 -5.204 18.741 -36.831 136 HD2 LYS 16 HD2 LYS 16 -4.483 17.167 -38.499 137 HD3 LYS 16 HD1 LYS 16 -3.036 17.731 -37.668 138 HE2 LYS 16 HE2 LYS 16 -2.938 15.710 -36.334 139 HE3 LYS 16 HE1 LYS 16 -4.503 15.176 -36.947 140 HZ1 LYS 16 HZ1 LYS 16 -3.030 15.644 -39.188 141 HZ2 LYS 16 HZ2 LYS 16 -3.337 14.122 -38.500 142 HZ3 LYS 16 HZ3 LYS 16 -1.904 14.953 -38.125 143 H ASP 17 HN ASP 17 -7.149 19.532 -34.957 144 HA ASP 17 HA ASP 17 -8.410 17.192 -33.650 145 HB2 ASP 17 HB2 ASP 17 -8.604 19.283 -32.238 146 HB3 ASP 17 HB1 ASP 17 -9.547 19.992 -33.547 147 H ASN 18 HN ASN 18 -8.048 19.215 -36.337 148 HA ASN 18 HA ASN 18 -10.591 19.058 -37.547 149 HB2 ASN 18 HB2 ASN 18 -7.812 19.365 -38.687 150 HB3 ASN 18 HB1 ASN 18 -9.262 19.401 -39.689 151 HD21 ASN 18 HD21 ASN 18 -7.276 21.278 -37.555 152 HD22 ASN 18 HD22 ASN 18 -8.261 22.660 -37.518 153 H VAL 19 HN VAL 19 -7.807 16.880 -37.615 154 HA VAL 19 HA VAL 19 -8.555 15.168 -39.655 155 HB VAL 19 HB VAL 19 -6.407 15.107 -38.313 156 HG11 VAL 19 HG11 VAL 19 -7.997 13.296 -36.476 157 HG12 VAL 19 HG12 VAL 19 -7.613 14.969 -36.074 158 HG13 VAL 19 HG13 VAL 19 -6.317 13.800 -36.302 159 HG21 VAL 19 HG21 VAL 19 -6.137 12.674 -38.629 160 HG22 VAL 19 HG22 VAL 19 -7.002 13.394 -39.987 161 HG23 VAL 19 HG23 VAL 19 -7.888 12.495 -38.755 162 H GLU 20 HN GLU 20 -10.047 15.573 -36.560 163 HA GLU 20 HA GLU 20 -11.271 13.030 -36.315 164 HB2 GLU 20 HB2 GLU 20 -12.058 15.748 -35.262 165 HB3 GLU 20 HB1 GLU 20 -12.961 14.281 -34.893 166 HG2 GLU 20 HG2 GLU 20 -11.015 13.268 -33.864 167 HG3 GLU 20 HG1 GLU 20 -9.993 14.611 -34.366 168 H LEU 21 HN LEU 21 -12.241 16.000 -37.966 169 HA LEU 21 HA LEU 21 -14.854 15.170 -38.677 170 HB2 LEU 21 HB2 LEU 21 -12.960 17.153 -39.946 171 HB3 LEU 21 HB1 LEU 21 -14.604 16.900 -40.520 172 HG LEU 21 HG LEU 21 -13.916 17.652 -37.657 173 HD11 LEU 21 HD11 LEU 21 -13.232 19.446 -39.172 174 HD12 LEU 21 HD12 LEU 21 -14.687 19.924 -38.298 175 HD13 LEU 21 HD13 LEU 21 -14.801 19.392 -39.975 176 HD21 LEU 21 HD21 LEU 21 -16.075 16.763 -37.553 177 HD22 LEU 21 HD22 LEU 21 -16.471 17.239 -39.202 178 HD23 LEU 21 HD23 LEU 21 -16.439 18.446 -37.919 179 H GLU 22 HN GLU 22 -11.713 14.793 -40.247 180 HA GLU 22 HA GLU 22 -12.629 13.722 -42.689 181 HB2 GLU 22 HB2 GLU 22 -10.310 14.522 -42.272 182 HB3 GLU 22 HB1 GLU 22 -10.033 13.112 -41.252 183 HG2 GLU 22 HG2 GLU 22 -11.009 12.806 -44.096 184 HG3 GLU 22 HG1 GLU 22 -9.294 12.987 -43.742 185 H ARG 23 HN ARG 23 -11.779 12.192 -39.609 186 HA ARG 23 HA ARG 23 -12.004 9.510 -40.430 187 HB2 ARG 23 HB2 ARG 23 -10.992 10.193 -38.290 188 HB3 ARG 23 HB1 ARG 23 -12.574 10.711 -37.709 189 HG2 ARG 23 HG2 ARG 23 -13.434 8.445 -37.860 190 HG3 ARG 23 HG1 ARG 23 -11.938 7.888 -38.610 191 HD2 ARG 23 HD2 ARG 23 -12.089 9.115 -35.846 192 HD3 ARG 23 HD1 ARG 23 -12.084 7.381 -36.153 193 HE ARG 23 HE ARG 23 -9.866 8.465 -37.471 194 HH11 ARG 23 HH11 ARG 23 -7.817 8.375 -36.494 195 HH12 ARG 23 HH12 ARG 23 -7.691 8.186 -34.777 196 HH21 ARG 23 HH21 ARG 23 -11.119 8.097 -34.266 197 HH22 ARG 23 HH22 ARG 23 -9.560 8.027 -33.515 198 H LEU 24 HN LEU 24 -14.404 11.759 -39.102 199 HA LEU 24 HA LEU 24 -16.549 9.944 -38.931 200 HB2 LEU 24 HB2 LEU 24 -16.569 12.135 -37.827 201 HB3 LEU 24 HB1 LEU 24 -16.592 12.937 -39.394 202 HG LEU 24 HG LEU 24 -18.772 11.882 -39.906 203 HD11 LEU 24 HD11 LEU 24 -18.854 9.846 -38.744 204 HD12 LEU 24 HD12 LEU 24 -19.922 10.854 -37.772 205 HD13 LEU 24 HD13 LEU 24 -18.265 10.562 -37.243 206 HD21 LEU 24 HD21 LEU 24 -20.098 13.115 -38.175 207 HD22 LEU 24 HD22 LEU 24 -18.782 14.075 -38.851 208 HD23 LEU 24 HD23 LEU 24 -18.611 13.346 -37.255 209 H LYS 25 HN LYS 25 -15.491 12.090 -41.553 210 HA LYS 25 HA LYS 25 -17.633 11.618 -43.314 211 HB2 LYS 25 HB2 LYS 25 -14.754 12.391 -43.802 212 HB3 LYS 25 HB1 LYS 25 -15.961 12.297 -45.084 213 HG2 LYS 25 HG2 LYS 25 -17.311 13.995 -44.061 214 HG3 LYS 25 HG1 LYS 25 -16.363 13.943 -42.577 215 HD2 LYS 25 HD2 LYS 25 -15.686 15.903 -43.823 216 HD3 LYS 25 HD1 LYS 25 -14.373 14.730 -43.902 217 HE2 LYS 25 HE2 LYS 25 -15.001 14.070 -46.138 218 HE3 LYS 25 HE1 LYS 25 -16.483 15.022 -46.059 219 HZ1 LYS 25 HZ1 LYS 25 -15.237 17.017 -46.017 220 HZ2 LYS 25 HZ2 LYS 25 -14.597 16.076 -47.280 221 HZ3 LYS 25 HZ3 LYS 25 -13.771 16.192 -45.799 222 H ASN 26 HN ASN 26 -14.557 9.906 -42.868 223 HA ASN 26 HA ASN 26 -15.319 7.932 -44.922 224 HB2 ASN 26 HB2 ASN 26 -12.754 8.437 -43.405 225 HB3 ASN 26 HB1 ASN 26 -12.991 7.060 -44.482 226 HD21 ASN 26 HD21 ASN 26 -11.035 9.132 -44.997 227 HD22 ASN 26 HD22 ASN 26 -11.510 9.946 -46.410 228 H GLU 27 HN GLU 27 -16.218 6.062 -44.385 229 HA GLU 27 HA GLU 27 -16.490 5.315 -41.583 230 HB2 GLU 27 HB2 GLU 27 -17.566 4.106 -44.139 231 HB3 GLU 27 HB1 GLU 27 -17.907 3.475 -42.527 232 HG2 GLU 27 HG2 GLU 27 -18.906 5.611 -41.870 233 HG3 GLU 27 HG1 GLU 27 -18.508 6.301 -43.444 234 H ARG 28 HN ARG 28 -14.305 4.693 -44.088 235 HA ARG 28 HA ARG 28 -13.686 1.972 -43.669 236 HB2 ARG 28 HB2 ARG 28 -12.014 4.285 -44.665 237 HB3 ARG 28 HB1 ARG 28 -11.444 2.615 -44.645 238 HG2 ARG 28 HG2 ARG 28 -13.347 1.938 -46.055 239 HG3 ARG 28 HG1 ARG 28 -13.934 3.601 -46.070 240 HD2 ARG 28 HD2 ARG 28 -11.845 4.333 -47.154 241 HD3 ARG 28 HD1 ARG 28 -11.249 2.677 -47.130 242 HE ARG 28 HE ARG 28 -13.744 2.710 -48.442 243 HH11 ARG 28 HH11 ARG 28 -13.790 2.659 -50.712 244 HH12 ARG 28 HH12 ARG 28 -12.389 3.136 -51.613 245 HH21 ARG 28 HH21 ARG 28 -10.495 3.845 -48.796 246 HH22 ARG 28 HH22 ARG 28 -10.523 3.808 -50.527 247 H HIS 29 HN HIS 29 -12.510 4.931 -42.122 248 HA HIS 29 HA HIS 29 -10.608 3.516 -40.466 249 HB2 HIS 29 HB2 HIS 29 -11.629 6.363 -40.363 250 HB3 HIS 29 HB1 HIS 29 -10.313 5.728 -39.377 251 HD2 HIS 29 HD2 HIS 29 -10.780 7.313 -42.819 252 HE1 HIS 29 HE1 HIS 29 -7.036 5.367 -42.943 253 HE2 HIS 29 HE2 HIS 29 -8.552 7.011 -44.147 254 H ASP 30 HN ASP 30 -10.753 3.160 -38.243 255 HA ASP 30 HA ASP 30 -11.812 2.501 -36.307 256 HB2 ASP 30 HB2 ASP 30 -12.119 5.039 -36.298 257 HB3 ASP 30 HB1 ASP 30 -13.761 4.737 -36.859 258 H HIS 31 HN HIS 31 -12.607 1.107 -38.659 259 HA HIS 31 HA HIS 31 -15.387 0.924 -39.030 260 HB2 HIS 31 HB2 HIS 31 -13.802 -0.062 -40.600 261 HB3 HIS 31 HB1 HIS 31 -13.255 -1.198 -39.367 262 HD2 HIS 31 HD2 HIS 31 -14.725 -3.542 -39.310 263 HE1 HIS 31 HE1 HIS 31 -18.066 -2.197 -41.512 264 HE2 HIS 31 HE2 HIS 31 -17.004 -4.214 -40.394 265 H ASP 32 HN ASP 32 -13.215 -0.881 -36.872 266 HA ASP 32 HA ASP 32 -15.123 -2.652 -35.817 267 HB2 ASP 32 HB2 ASP 32 -12.562 -1.533 -34.674 268 HB3 ASP 32 HB1 ASP 32 -13.523 -2.758 -33.848 269 H GLU 33 HN GLU 33 -14.198 0.620 -34.846 270 HA GLU 33 HA GLU 33 -15.153 2.122 -33.391 271 HB2 GLU 33 HB2 GLU 33 -17.613 0.413 -33.854 272 HB3 GLU 33 HB1 GLU 33 -17.600 2.024 -33.141 273 HG2 GLU 33 HG2 GLU 33 -16.608 2.927 -35.223 274 HG3 GLU 33 HG1 GLU 33 -16.670 1.315 -35.935 275 H GLU 34 HN GLU 34 -13.828 -0.253 -32.324 276 HA GLU 34 HA GLU 34 -15.253 -1.395 -30.175 277 HB2 GLU 34 HB2 GLU 34 -13.141 -2.319 -31.069 278 HB3 GLU 34 HB1 GLU 34 -12.272 -0.926 -30.427 279 HG2 GLU 34 HG2 GLU 34 -12.945 -1.522 -28.147 280 HG3 GLU 34 HG1 GLU 34 -13.894 -2.873 -28.761 281 H ALA 35 HN ALA 35 -13.205 1.491 -30.388 282 HA ALA 35 HA ALA 35 -13.139 2.124 -27.647 283 HB1 ALA 35 HB1 ALA 35 -11.682 3.185 -29.336 284 HB2 ALA 35 HB2 ALA 35 -12.543 4.385 -28.371 285 HB3 ALA 35 HB3 ALA 35 -13.083 4.017 -30.010 286 H GLU 36 HN GLU 36 -15.470 2.950 -30.182 287 HA GLU 36 HA GLU 36 -17.031 4.738 -28.636 288 HB2 GLU 36 HB2 GLU 36 -17.718 3.035 -31.035 289 HB3 GLU 36 HB1 GLU 36 -18.849 4.173 -30.306 290 HG2 GLU 36 HG2 GLU 36 -16.085 4.960 -31.275 291 HG3 GLU 36 HG1 GLU 36 -17.541 5.109 -32.255 292 H ARG 37 HN ARG 37 -17.145 1.237 -29.095 293 HA ARG 37 HA ARG 37 -19.573 0.731 -27.767 294 HB2 ARG 37 HB2 ARG 37 -18.343 -0.934 -29.144 295 HB3 ARG 37 HB1 ARG 37 -17.118 -1.037 -27.881 296 HG2 ARG 37 HG2 ARG 37 -18.843 -1.774 -26.268 297 HG3 ARG 37 HG1 ARG 37 -20.061 -1.686 -27.540 298 HD2 ARG 37 HD2 ARG 37 -17.592 -3.440 -27.620 299 HD3 ARG 37 HD1 ARG 37 -19.210 -3.999 -27.213 300 HE ARG 37 HE ARG 37 -18.222 -3.332 -29.862 301 HH11 ARG 37 HH11 ARG 37 -19.664 -3.768 -31.562 302 HH12 ARG 37 HH12 ARG 37 -21.326 -4.110 -31.214 303 HH21 ARG 37 HH21 ARG 37 -20.950 -3.788 -27.783 304 HH22 ARG 37 HH22 ARG 37 -22.054 -4.122 -29.075 305 H LYS 38 HN LYS 38 -16.238 0.925 -26.559 306 HA LYS 38 HA LYS 38 -16.765 0.203 -23.892 307 HB2 LYS 38 HB2 LYS 38 -14.491 0.326 -24.825 308 HB3 LYS 38 HB1 LYS 38 -14.649 2.078 -24.962 309 HG2 LYS 38 HG2 LYS 38 -14.808 2.339 -22.581 310 HG3 LYS 38 HG1 LYS 38 -14.977 0.601 -22.342 311 HD2 LYS 38 HD2 LYS 38 -12.709 1.145 -21.784 312 HD3 LYS 38 HD1 LYS 38 -12.661 0.347 -23.355 313 HE2 LYS 38 HE2 LYS 38 -12.443 2.472 -24.499 314 HE3 LYS 38 HE1 LYS 38 -12.704 3.356 -22.996 315 HZ1 LYS 38 HZ1 LYS 38 -10.681 2.170 -22.143 316 HZ2 LYS 38 HZ2 LYS 38 -10.394 3.312 -23.367 317 HZ3 LYS 38 HZ3 LYS 38 -10.396 1.652 -23.731 318 H ALA 39 HN ALA 39 -16.748 3.370 -25.498 319 HA ALA 39 HA ALA 39 -17.231 4.944 -23.213 320 HB1 ALA 39 HB1 ALA 39 -16.519 5.983 -25.274 321 HB2 ALA 39 HB2 ALA 39 -18.109 6.623 -24.856 322 HB3 ALA 39 HB3 ALA 39 -17.953 5.399 -26.116 323 H LEU 40 HN LEU 40 -19.420 3.293 -25.447 324 HA LEU 40 HA LEU 40 -21.840 4.362 -24.489 325 HB2 LEU 40 HB2 LEU 40 -21.682 3.102 -26.590 326 HB3 LEU 40 HB1 LEU 40 -21.284 1.639 -25.698 327 HG LEU 40 HG LEU 40 -23.485 1.725 -24.568 328 HD11 LEU 40 HD11 LEU 40 -24.124 3.978 -24.453 329 HD12 LEU 40 HD12 LEU 40 -25.159 3.380 -25.747 330 HD13 LEU 40 HD13 LEU 40 -23.699 4.290 -26.136 331 HD21 LEU 40 HD21 LEU 40 -24.795 1.035 -26.469 332 HD22 LEU 40 HD22 LEU 40 -23.125 0.570 -26.794 333 HD23 LEU 40 HD23 LEU 40 -23.808 1.999 -27.568 334 H GLU 41 HN GLU 41 -20.010 1.472 -23.521 335 HA GLU 41 HA GLU 41 -21.846 0.512 -21.609 336 HB2 GLU 41 HB2 GLU 41 -19.953 -0.818 -22.481 337 HB3 GLU 41 HB1 GLU 41 -18.829 0.239 -21.626 338 HG2 GLU 41 HG2 GLU 41 -19.824 -0.397 -19.477 339 HG3 GLU 41 HG1 GLU 41 -21.014 -1.398 -20.306 340 H ASP 42 HN ASP 42 -19.122 2.768 -21.342 341 HA ASP 42 HA ASP 42 -19.184 3.108 -18.548 342 HB2 ASP 42 HB2 ASP 42 -17.331 3.878 -20.001 343 HB3 ASP 42 HB1 ASP 42 -18.387 5.126 -20.658 344 H LYS 43 HN LYS 43 -20.858 4.831 -21.161 345 HA LYS 43 HA LYS 43 -22.077 6.816 -19.582 346 HB2 LYS 43 HB2 LYS 43 -21.976 6.850 -22.058 347 HB3 LYS 43 HB1 LYS 43 -23.143 5.534 -22.112 348 HG2 LYS 43 HG2 LYS 43 -24.765 6.964 -20.856 349 HG3 LYS 43 HG1 LYS 43 -23.604 8.288 -20.921 350 HD2 LYS 43 HD2 LYS 43 -24.607 6.897 -23.413 351 HD3 LYS 43 HD1 LYS 43 -25.439 8.284 -22.713 352 HE2 LYS 43 HE2 LYS 43 -23.254 9.555 -22.863 353 HE3 LYS 43 HE1 LYS 43 -22.602 8.199 -23.780 354 HZ1 LYS 43 HZ1 LYS 43 -24.896 8.627 -25.061 355 HZ2 LYS 43 HZ2 LYS 43 -23.414 9.323 -25.514 356 HZ3 LYS 43 HZ3 LYS 43 -24.520 10.209 -24.579 357 H LEU 44 HN LEU 44 -23.151 3.561 -20.503 358 HA LEU 44 HA LEU 44 -25.711 3.703 -19.300 359 HB2 LEU 44 HB2 LEU 44 -23.916 1.357 -19.939 360 HB3 LEU 44 HB1 LEU 44 -25.541 1.169 -19.290 361 HG LEU 44 HG LEU 44 -24.914 2.702 -21.835 362 HD11 LEU 44 HD11 LEU 44 -25.928 0.645 -22.937 363 HD12 LEU 44 HD12 LEU 44 -25.729 -0.176 -21.390 364 HD13 LEU 44 HD13 LEU 44 -24.316 0.423 -22.257 365 HD21 LEU 44 HD21 LEU 44 -27.028 3.450 -21.169 366 HD22 LEU 44 HD22 LEU 44 -27.434 1.934 -20.367 367 HD23 LEU 44 HD23 LEU 44 -27.472 2.042 -22.125 368 H ALA 45 HN ALA 45 -22.545 2.716 -18.080 369 HA ALA 45 HA ALA 45 -23.386 1.718 -15.581 370 HB1 ALA 45 HB1 ALA 45 -20.790 2.963 -16.494 371 HB2 ALA 45 HB2 ALA 45 -21.154 1.250 -16.289 372 HB3 ALA 45 HB3 ALA 45 -21.015 2.298 -14.877 373 H ASP 46 HN ASP 46 -22.542 4.977 -16.665 374 HA ASP 46 HA ASP 46 -22.578 6.252 -14.156 375 HB2 ASP 46 HB2 ASP 46 -21.694 7.282 -16.231 376 HB3 ASP 46 HB1 ASP 46 -23.340 7.411 -16.845 377 H LYS 47 HN LYS 47 -25.170 5.625 -16.499 378 HA LYS 47 HA LYS 47 -27.149 6.977 -14.880 379 HB2 LYS 47 HB2 LYS 47 -27.335 6.871 -17.348 380 HB3 LYS 47 HB1 LYS 47 -27.502 5.118 -17.247 381 HG2 LYS 47 HG2 LYS 47 -29.545 5.368 -15.906 382 HG3 LYS 47 HG1 LYS 47 -29.369 7.123 -15.944 383 HD2 LYS 47 HD2 LYS 47 -29.553 7.080 -18.410 384 HD3 LYS 47 HD1 LYS 47 -29.762 5.330 -18.357 385 HE2 LYS 47 HE2 LYS 47 -31.583 7.332 -16.990 386 HE3 LYS 47 HE1 LYS 47 -31.936 6.532 -18.521 387 HZ1 LYS 47 HZ1 LYS 47 -31.409 4.413 -17.096 388 HZ2 LYS 47 HZ2 LYS 47 -32.954 5.118 -17.079 389 HZ3 LYS 47 HZ3 LYS 47 -31.866 5.421 -15.813 390 H GLN 48 HN GLN 48 -27.534 6.077 -12.952 391 HA GLN 48 HA GLN 48 -27.975 4.489 -11.336 392 HB2 GLN 48 HB2 GLN 48 -29.746 3.627 -13.631 393 HB3 GLN 48 HB1 GLN 48 -29.863 2.949 -12.006 394 HG2 GLN 48 HG2 GLN 48 -30.370 5.108 -11.061 395 HG3 GLN 48 HG1 GLN 48 -30.045 5.911 -12.597 396 HE21 GLN 48 HE21 GLN 48 -32.613 5.861 -11.040 397 HE22 GLN 48 HE22 GLN 48 -33.768 5.207 -12.098 398 H GLU 49 HN GLU 49 -28.900 1.764 -12.890 399 HA GLU 49 HA GLU 49 -27.955 -0.330 -13.019 400 HB2 GLU 49 HB2 GLU 49 -25.787 1.345 -14.307 401 HB3 GLU 49 HB1 GLU 49 -25.862 -0.416 -14.379 402 HG2 GLU 49 HG2 GLU 49 -28.070 -0.289 -15.459 403 HG3 GLU 49 HG1 GLU 49 -28.017 1.471 -15.374 404 H HIS 50 HN HIS 50 -27.455 1.242 -10.570 405 HA HIS 50 HA HIS 50 -24.809 0.962 -9.661 406 HB2 HIS 50 HB2 HIS 50 -26.488 2.348 -8.515 407 HB3 HIS 50 HB1 HIS 50 -27.370 0.893 -8.050 408 HD2 HIS 50 HD2 HIS 50 -24.062 2.777 -7.078 409 HE1 HIS 50 HE1 HIS 50 -24.585 -0.433 -4.387 410 HE2 HIS 50 HE2 HIS 50 -23.197 1.631 -4.897 411 H LEU 51 HN LEU 51 -27.606 -1.216 -9.364 412 HA LEU 51 HA LEU 51 -26.287 -3.212 -7.853 413 HB2 LEU 51 HB2 LEU 51 -28.686 -3.333 -9.686 414 HB3 LEU 51 HB1 LEU 51 -28.125 -4.715 -8.755 415 HG LEU 51 HG LEU 51 -28.847 -2.037 -7.518 416 HD11 LEU 51 HD11 LEU 51 -30.793 -3.119 -8.628 417 HD12 LEU 51 HD12 LEU 51 -30.964 -3.067 -6.874 418 HD13 LEU 51 HD13 LEU 51 -30.503 -4.571 -7.672 419 HD21 LEU 51 HD21 LEU 51 -28.009 -4.729 -6.448 420 HD22 LEU 51 HD22 LEU 51 -29.116 -3.742 -5.498 421 HD23 LEU 51 HD23 LEU 51 -27.526 -3.118 -5.919 422 H ASP 52 HN ASP 52 -26.653 -2.716 -11.336 423 HA ASP 52 HA ASP 52 -25.439 -5.185 -12.070 424 HB2 ASP 52 HB2 ASP 52 -25.946 -2.618 -13.582 425 HB3 ASP 52 HB1 ASP 52 -25.189 -4.023 -14.327 426 H GLY 53 HN GLY 53 -23.261 -5.294 -13.300 427 HA2 GLY 53 HA2 GLY 53 -21.040 -4.694 -13.595 428 HA3 GLY 53 HA1 GLY 53 -21.362 -3.179 -12.757 429 H ALA 54 HN ALA 54 -22.637 -5.579 -10.874 430 HA ALA 54 HA ALA 54 -20.762 -5.276 -8.795 431 HB1 ALA 54 HB1 ALA 54 -23.033 -5.936 -8.302 432 HB2 ALA 54 HB2 ALA 54 -21.953 -7.224 -7.767 433 HB3 ALA 54 HB3 ALA 54 -22.862 -7.401 -9.267 434 H LEU 55 HN LEU 55 -21.167 -7.785 -11.257 435 HA LEU 55 HA LEU 55 -19.262 -9.604 -10.267 436 HB2 LEU 55 HB2 LEU 55 -20.885 -10.199 -12.008 437 HB3 LEU 55 HB1 LEU 55 -20.117 -9.076 -13.126 438 HG LEU 55 HG LEU 55 -18.021 -10.387 -13.009 439 HD11 LEU 55 HD11 LEU 55 -18.374 -12.764 -11.937 440 HD12 LEU 55 HD12 LEU 55 -19.626 -11.955 -10.995 441 HD13 LEU 55 HD13 LEU 55 -17.953 -11.406 -10.897 442 HD21 LEU 55 HD21 LEU 55 -20.393 -12.184 -13.581 443 HD22 LEU 55 HD22 LEU 55 -18.793 -12.260 -14.320 444 HD23 LEU 55 HD23 LEU 55 -19.862 -10.900 -14.665 445 H ARG 56 HN ARG 56 -18.959 -6.903 -12.554 446 HA ARG 56 HA ARG 56 -16.231 -7.279 -13.177 447 HB2 ARG 56 HB2 ARG 56 -17.977 -4.810 -13.202 448 HB3 ARG 56 HB1 ARG 56 -16.321 -4.835 -13.808 449 HG2 ARG 56 HG2 ARG 56 -16.903 -6.591 -15.414 450 HG3 ARG 56 HG1 ARG 56 -18.548 -6.648 -14.781 451 HD2 ARG 56 HD2 ARG 56 -18.490 -5.288 -16.816 452 HD3 ARG 56 HD1 ARG 56 -18.863 -4.274 -15.425 453 HE ARG 56 HE ARG 56 -16.813 -3.199 -15.709 454 HH11 ARG 56 HH11 ARG 56 -14.915 -2.767 -16.880 455 HH12 ARG 56 HH12 ARG 56 -14.378 -3.883 -18.091 456 HH21 ARG 56 HH21 ARG 56 -17.009 -6.088 -17.603 457 HH22 ARG 56 HH22 ARG 56 -15.563 -5.765 -18.501 458 H TYR 57 HN TYR 57 -17.850 -5.459 -10.611 459 HA TYR 57 HA TYR 57 -15.512 -4.204 -9.589 460 HB2 TYR 57 HB2 TYR 57 -17.719 -3.347 -9.039 461 HB3 TYR 57 HB1 TYR 57 -18.149 -4.868 -8.257 462 HD1 TYR 57 HD1 TYR 57 -15.764 -2.002 -8.101 463 HD2 TYR 57 HD2 TYR 57 -17.572 -5.279 -5.992 464 HE1 TYR 57 HE1 TYR 57 -14.764 -1.189 -5.982 465 HE2 TYR 57 HE2 TYR 57 -16.572 -4.465 -3.873 466 HH TYR 57 HH TYR 57 -14.240 -2.815 -3.457 Start of MODEL 9 1 H1 GLY 1 HT1 GLY 1 -13.124 28.869 -31.238 2 H2 GLY 1 HT2 GLY 1 -13.076 28.847 -29.539 3 H3 GLY 1 HT3 GLY 1 -13.882 27.614 -30.385 4 HA2 GLY 1 HA2 GLY 1 -11.258 27.713 -31.341 5 HA3 GLY 1 HA1 GLY 1 -11.203 27.697 -29.578 6 H SER 2 HN SER 2 -13.146 26.166 -32.161 7 HA SER 2 HA SER 2 -13.792 23.849 -30.690 8 HB2 SER 2 HB2 SER 2 -13.634 24.315 -33.674 9 HB3 SER 2 HB1 SER 2 -14.309 22.866 -32.935 10 HG SER 2 HG SER 2 -15.277 25.480 -33.009 11 H LYS 3 HN LYS 3 -11.133 24.580 -32.902 12 HA LYS 3 HA LYS 3 -10.019 21.988 -33.017 13 HB2 LYS 3 HB2 LYS 3 -8.792 24.729 -33.369 14 HB3 LYS 3 HB1 LYS 3 -7.909 23.233 -33.664 15 HG2 LYS 3 HG2 LYS 3 -10.576 23.682 -35.000 16 HG3 LYS 3 HG1 LYS 3 -9.127 24.430 -35.665 17 HD2 LYS 3 HD2 LYS 3 -8.045 22.185 -35.763 18 HD3 LYS 3 HD1 LYS 3 -9.548 21.460 -35.196 19 HE2 LYS 3 HE2 LYS 3 -9.438 21.322 -37.636 20 HE3 LYS 3 HE1 LYS 3 -10.731 22.422 -37.158 21 HZ1 LYS 3 HZ1 LYS 3 -9.235 23.243 -38.967 22 HZ2 LYS 3 HZ2 LYS 3 -7.989 23.334 -37.815 23 HZ3 LYS 3 HZ3 LYS 3 -9.385 24.285 -37.637 24 H THR 4 HN THR 4 -9.543 24.678 -30.783 25 HA THR 4 HA THR 4 -7.506 23.221 -29.280 26 HB THR 4 HB THR 4 -7.399 25.292 -27.938 27 HG1 THR 4 HG1 THR 4 -8.696 27.011 -28.511 28 HG21 THR 4 HG21 THR 4 -7.409 26.049 -30.855 29 HG22 THR 4 HG22 THR 4 -6.203 24.942 -30.202 30 HG23 THR 4 HG23 THR 4 -6.314 26.590 -29.584 31 H ILE 5 HN ILE 5 -10.709 22.883 -29.400 32 HA ILE 5 HA ILE 5 -11.682 23.251 -26.811 33 HB ILE 5 HB ILE 5 -13.017 22.600 -28.866 34 HG12 ILE 5 HG12 ILE 5 -13.512 20.849 -26.441 35 HG13 ILE 5 HG11 ILE 5 -13.878 22.575 -26.482 36 HG21 ILE 5 HG21 ILE 5 -11.481 20.630 -29.398 37 HG22 ILE 5 HG22 ILE 5 -13.209 20.294 -29.467 38 HG23 ILE 5 HG23 ILE 5 -12.267 19.780 -28.067 39 HD11 ILE 5 HD11 ILE 5 -15.340 22.199 -28.455 40 HD12 ILE 5 HD12 ILE 5 -15.886 21.290 -27.045 41 HD13 ILE 5 HD13 ILE 5 -15.017 20.469 -28.341 42 H GLN 6 HN GLN 6 -9.436 20.920 -28.017 43 HA GLN 6 HA GLN 6 -9.793 18.889 -26.071 44 HB2 GLN 6 HB2 GLN 6 -7.418 19.672 -27.763 45 HB3 GLN 6 HB1 GLN 6 -7.404 18.286 -26.674 46 HG2 GLN 6 HG2 GLN 6 -9.229 17.244 -27.864 47 HG3 GLN 6 HG1 GLN 6 -9.480 18.682 -28.851 48 HE21 GLN 6 HE21 GLN 6 -8.763 15.920 -29.770 49 HE22 GLN 6 HE22 GLN 6 -7.302 16.090 -30.618 50 H GLU 7 HN GLU 7 -7.814 21.815 -26.150 51 HA GLU 7 HA GLU 7 -6.336 21.307 -23.791 52 HB2 GLU 7 HB2 GLU 7 -7.085 23.888 -25.171 53 HB3 GLU 7 HB1 GLU 7 -6.038 23.823 -23.755 54 HG2 GLU 7 HG2 GLU 7 -5.499 22.258 -26.297 55 HG3 GLU 7 HG1 GLU 7 -4.808 23.844 -25.963 56 H LYS 8 HN LYS 8 -9.454 22.885 -24.346 57 HA LYS 8 HA LYS 8 -9.854 23.879 -21.745 58 HB2 LYS 8 HB2 LYS 8 -11.240 24.547 -23.666 59 HB3 LYS 8 HB1 LYS 8 -11.915 22.917 -23.735 60 HG2 LYS 8 HG2 LYS 8 -12.949 23.155 -21.586 61 HG3 LYS 8 HG1 LYS 8 -12.064 24.641 -21.254 62 HD2 LYS 8 HD2 LYS 8 -14.289 25.294 -21.870 63 HD3 LYS 8 HD1 LYS 8 -13.256 25.671 -23.246 64 HE2 LYS 8 HE2 LYS 8 -13.972 23.668 -24.409 65 HE3 LYS 8 HE1 LYS 8 -14.864 23.112 -22.994 66 HZ1 LYS 8 HZ1 LYS 8 -15.975 24.471 -24.979 67 HZ2 LYS 8 HZ2 LYS 8 -15.523 25.767 -23.976 68 HZ3 LYS 8 HZ3 LYS 8 -16.540 24.542 -23.382 69 H GLU 9 HN GLU 9 -10.693 20.749 -23.196 70 HA GLU 9 HA GLU 9 -12.070 19.705 -20.957 71 HB2 GLU 9 HB2 GLU 9 -10.626 18.360 -23.243 72 HB3 GLU 9 HB1 GLU 9 -11.495 17.461 -22.000 73 HG2 GLU 9 HG2 GLU 9 -13.576 18.549 -22.572 74 HG3 GLU 9 HG1 GLU 9 -12.759 19.653 -23.673 75 H GLN 10 HN GLN 10 -8.661 19.643 -21.890 76 HA GLN 10 HA GLN 10 -7.753 17.857 -19.906 77 HB2 GLN 10 HB2 GLN 10 -6.420 18.563 -21.879 78 HB3 GLN 10 HB1 GLN 10 -6.247 20.164 -21.160 79 HG2 GLN 10 HG2 GLN 10 -5.109 19.203 -19.217 80 HG3 GLN 10 HG1 GLN 10 -5.342 17.578 -19.861 81 HE21 GLN 10 HE21 GLN 10 -2.736 18.132 -19.436 82 HE22 GLN 10 HE22 GLN 10 -1.925 18.526 -20.875 83 H GLU 11 HN GLU 11 -8.203 21.365 -19.894 84 HA GLU 11 HA GLU 11 -6.964 21.913 -17.430 85 HB2 GLU 11 HB2 GLU 11 -9.179 23.321 -18.924 86 HB3 GLU 11 HB1 GLU 11 -8.450 23.961 -17.451 87 HG2 GLU 11 HG2 GLU 11 -6.261 24.023 -18.493 88 HG3 GLU 11 HG1 GLU 11 -6.879 23.214 -19.931 89 H LEU 12 HN LEU 12 -10.303 20.974 -18.197 90 HA LEU 12 HA LEU 12 -10.937 20.924 -15.301 91 HB2 LEU 12 HB2 LEU 12 -12.792 20.801 -17.690 92 HB3 LEU 12 HB1 LEU 12 -13.277 20.895 -15.998 93 HG LEU 12 HG LEU 12 -11.650 22.992 -17.469 94 HD11 LEU 12 HD11 LEU 12 -14.571 22.809 -16.699 95 HD12 LEU 12 HD12 LEU 12 -13.886 23.077 -18.302 96 HD13 LEU 12 HD13 LEU 12 -13.786 24.343 -17.078 97 HD21 LEU 12 HD21 LEU 12 -12.425 24.298 -15.308 98 HD22 LEU 12 HD22 LEU 12 -11.025 23.233 -15.220 99 HD23 LEU 12 HD23 LEU 12 -12.589 22.683 -14.617 100 H LYS 13 HN LYS 13 -11.452 19.078 -14.279 101 HA LYS 13 HA LYS 13 -12.191 16.682 -15.723 102 HB2 LYS 13 HB2 LYS 13 -10.334 15.312 -14.864 103 HB3 LYS 13 HB1 LYS 13 -9.750 16.589 -15.930 104 HG2 LYS 13 HG2 LYS 13 -9.202 17.977 -13.955 105 HG3 LYS 13 HG1 LYS 13 -9.754 16.676 -12.899 106 HD2 LYS 13 HD2 LYS 13 -8.049 15.170 -13.853 107 HD3 LYS 13 HD1 LYS 13 -7.498 16.465 -14.916 108 HE2 LYS 13 HE2 LYS 13 -6.917 17.837 -12.948 109 HE3 LYS 13 HE1 LYS 13 -7.461 16.539 -11.885 110 HZ1 LYS 13 HZ1 LYS 13 -5.808 15.105 -13.151 111 HZ2 LYS 13 HZ2 LYS 13 -5.173 16.237 -12.056 112 HZ3 LYS 13 HZ3 LYS 13 -5.148 16.559 -13.723 113 H ASN 14 HN ASN 14 -13.237 15.201 -14.446 114 HA ASN 14 HA ASN 14 -14.424 16.147 -12.066 115 HB2 ASN 14 HB2 ASN 14 -15.397 14.468 -13.666 116 HB3 ASN 14 HB1 ASN 14 -14.297 13.274 -12.980 117 HD21 ASN 14 HD21 ASN 14 -15.959 11.996 -11.953 118 HD22 ASN 14 HD22 ASN 14 -16.874 12.586 -10.652 119 H LEU 15 HN LEU 15 -11.791 13.817 -12.597 120 HA LEU 15 HA LEU 15 -11.442 13.548 -9.673 121 HB2 LEU 15 HB2 LEU 15 -10.184 11.983 -11.937 122 HB3 LEU 15 HB1 LEU 15 -10.024 11.634 -10.217 123 HG LEU 15 HG LEU 15 -12.635 11.637 -11.764 124 HD11 LEU 15 HD11 LEU 15 -11.148 9.284 -10.573 125 HD12 LEU 15 HD12 LEU 15 -10.978 9.771 -12.260 126 HD13 LEU 15 HD13 LEU 15 -12.545 9.244 -11.648 127 HD21 LEU 15 HD21 LEU 15 -13.299 10.372 -9.540 128 HD22 LEU 15 HD22 LEU 15 -13.265 12.132 -9.559 129 HD23 LEU 15 HD23 LEU 15 -11.918 11.233 -8.860 130 H LYS 16 HN LYS 16 -9.540 14.005 -8.648 131 HA LYS 16 HA LYS 16 -7.990 16.152 -9.635 132 HB2 LYS 16 HB2 LYS 16 -7.537 14.226 -7.350 133 HB3 LYS 16 HB1 LYS 16 -6.459 15.578 -7.695 134 HG2 LYS 16 HG2 LYS 16 -8.347 17.150 -7.460 135 HG3 LYS 16 HG1 LYS 16 -9.430 15.806 -7.111 136 HD2 LYS 16 HD2 LYS 16 -8.125 15.236 -5.117 137 HD3 LYS 16 HD1 LYS 16 -6.984 16.531 -5.476 138 HE2 LYS 16 HE2 LYS 16 -8.592 17.287 -3.790 139 HE3 LYS 16 HE1 LYS 16 -8.830 18.181 -5.289 140 HZ1 LYS 16 HZ1 LYS 16 -10.358 15.794 -5.288 141 HZ2 LYS 16 HZ2 LYS 16 -10.881 17.402 -5.457 142 HZ3 LYS 16 HZ3 LYS 16 -10.715 16.716 -3.911 143 H ASP 17 HN ASP 17 -7.443 12.662 -9.539 144 HA ASP 17 HA ASP 17 -4.756 12.668 -10.399 145 HB2 ASP 17 HB2 ASP 17 -6.963 10.623 -10.661 146 HB3 ASP 17 HB1 ASP 17 -5.310 10.319 -11.190 147 H ASN 18 HN ASN 18 -3.819 12.583 -12.409 148 HA ASN 18 HA ASN 18 -5.535 13.395 -14.678 149 HB2 ASN 18 HB2 ASN 18 -3.501 14.775 -13.880 150 HB3 ASN 18 HB1 ASN 18 -2.521 13.504 -14.610 151 HD21 ASN 18 HD21 ASN 18 -1.745 14.778 -16.395 152 HD22 ASN 18 HD22 ASN 18 -2.773 15.352 -17.618 153 H VAL 19 HN VAL 19 -5.069 10.596 -13.625 154 HA VAL 19 HA VAL 19 -3.437 9.228 -15.528 155 HB VAL 19 HB VAL 19 -4.605 7.189 -14.676 156 HG11 VAL 19 HG11 VAL 19 -3.530 7.210 -12.574 157 HG12 VAL 19 HG12 VAL 19 -3.807 8.936 -12.345 158 HG13 VAL 19 HG13 VAL 19 -2.618 8.382 -13.522 159 HG21 VAL 19 HG21 VAL 19 -6.804 8.086 -14.243 160 HG22 VAL 19 HG22 VAL 19 -6.153 9.267 -13.108 161 HG23 VAL 19 HG23 VAL 19 -6.134 7.551 -12.703 162 H GLU 20 HN GLU 20 -6.681 10.417 -15.532 163 HA GLU 20 HA GLU 20 -7.806 8.704 -17.487 164 HB2 GLU 20 HB2 GLU 20 -8.446 11.544 -16.683 165 HB3 GLU 20 HB1 GLU 20 -9.376 10.661 -17.893 166 HG2 GLU 20 HG2 GLU 20 -9.978 8.957 -16.289 167 HG3 GLU 20 HG1 GLU 20 -8.892 9.637 -15.079 168 H LEU 21 HN LEU 21 -5.957 11.709 -17.722 169 HA LEU 21 HA LEU 21 -6.259 12.125 -20.493 170 HB2 LEU 21 HB2 LEU 21 -5.378 13.848 -18.979 171 HB3 LEU 21 HB1 LEU 21 -3.948 12.864 -18.675 172 HG LEU 21 HG LEU 21 -3.340 13.006 -21.072 173 HD11 LEU 21 HD11 LEU 21 -4.678 14.889 -22.340 174 HD12 LEU 21 HD12 LEU 21 -5.963 14.488 -21.200 175 HD13 LEU 21 HD13 LEU 21 -5.327 13.253 -22.289 176 HD21 LEU 21 HD21 LEU 21 -2.823 15.456 -21.089 177 HD22 LEU 21 HD22 LEU 21 -2.433 14.680 -19.554 178 HD23 LEU 21 HD23 LEU 21 -3.894 15.655 -19.702 179 H GLU 22 HN GLU 22 -3.844 10.325 -18.624 180 HA GLU 22 HA GLU 22 -2.181 9.594 -20.781 181 HB2 GLU 22 HB2 GLU 22 -2.710 8.285 -18.109 182 HB3 GLU 22 HB1 GLU 22 -1.486 7.708 -19.240 183 HG2 GLU 22 HG2 GLU 22 -0.324 9.831 -19.160 184 HG3 GLU 22 HG1 GLU 22 -1.610 10.547 -18.191 185 H ARG 23 HN ARG 23 -5.062 8.081 -19.393 186 HA ARG 23 HA ARG 23 -4.967 5.653 -20.808 187 HB2 ARG 23 HB2 ARG 23 -6.492 6.079 -18.909 188 HB3 ARG 23 HB1 ARG 23 -7.408 7.207 -19.909 189 HG2 ARG 23 HG2 ARG 23 -7.965 5.409 -21.480 190 HG3 ARG 23 HG1 ARG 23 -6.987 4.272 -20.552 191 HD2 ARG 23 HD2 ARG 23 -8.448 4.612 -18.594 192 HD3 ARG 23 HD1 ARG 23 -9.426 5.748 -19.520 193 HE ARG 23 HE ARG 23 -9.438 2.851 -19.757 194 HH11 ARG 23 HH11 ARG 23 -11.021 2.011 -21.152 195 HH12 ARG 23 HH12 ARG 23 -11.864 3.070 -22.233 196 HH21 ARG 23 HH21 ARG 23 -10.179 5.913 -21.187 197 HH22 ARG 23 HH22 ARG 23 -11.387 5.280 -22.253 198 H LEU 24 HN LEU 24 -6.445 8.779 -21.635 199 HA LEU 24 HA LEU 24 -7.636 7.975 -24.057 200 HB2 LEU 24 HB2 LEU 24 -8.197 10.090 -22.947 201 HB3 LEU 24 HB1 LEU 24 -6.568 10.691 -23.243 202 HG LEU 24 HG LEU 24 -6.952 10.534 -25.684 203 HD11 LEU 24 HD11 LEU 24 -9.496 10.239 -26.288 204 HD12 LEU 24 HD12 LEU 24 -9.574 9.372 -24.755 205 HD13 LEU 24 HD13 LEU 24 -8.501 8.809 -26.036 206 HD21 LEU 24 HD21 LEU 24 -9.000 12.070 -24.064 207 HD22 LEU 24 HD22 LEU 24 -8.749 12.318 -25.793 208 HD23 LEU 24 HD23 LEU 24 -7.444 12.653 -24.653 209 H LYS 25 HN LYS 25 -4.439 9.343 -23.347 210 HA LYS 25 HA LYS 25 -3.566 9.385 -26.059 211 HB2 LYS 25 HB2 LYS 25 -2.548 10.813 -24.342 212 HB3 LYS 25 HB1 LYS 25 -1.976 9.388 -23.480 213 HG2 LYS 25 HG2 LYS 25 -0.165 10.361 -24.820 214 HG3 LYS 25 HG1 LYS 25 -0.586 8.769 -25.440 215 HD2 LYS 25 HD2 LYS 25 -1.682 9.652 -27.330 216 HD3 LYS 25 HD1 LYS 25 -1.873 11.244 -26.592 217 HE2 LYS 25 HE2 LYS 25 -0.108 11.291 -28.305 218 HE3 LYS 25 HE1 LYS 25 0.582 11.571 -26.707 219 HZ1 LYS 25 HZ1 LYS 25 1.622 9.831 -28.335 220 HZ2 LYS 25 HZ2 LYS 25 0.416 8.818 -27.699 221 HZ3 LYS 25 HZ3 LYS 25 1.564 9.529 -26.667 222 H ASN 26 HN ASN 26 -2.506 7.862 -27.252 223 HA ASN 26 HA ASN 26 -1.787 5.778 -27.902 224 HB2 ASN 26 HB2 ASN 26 -0.035 6.434 -26.164 225 HB3 ASN 26 HB1 ASN 26 -0.909 5.391 -25.043 226 HD21 ASN 26 HD21 ASN 26 0.705 3.724 -24.915 227 HD22 ASN 26 HD22 ASN 26 1.123 2.758 -26.246 228 H GLU 27 HN GLU 27 -4.422 5.721 -27.558 229 HA GLU 27 HA GLU 27 -5.562 4.087 -25.623 230 HB2 GLU 27 HB2 GLU 27 -6.314 4.278 -28.554 231 HB3 GLU 27 HB1 GLU 27 -7.332 3.622 -27.276 232 HG2 GLU 27 HG2 GLU 27 -8.132 5.803 -27.351 233 HG3 GLU 27 HG1 GLU 27 -6.881 5.974 -26.124 234 H ARG 28 HN ARG 28 -5.838 1.903 -25.369 235 HA ARG 28 HA ARG 28 -3.845 0.166 -26.356 236 HB2 ARG 28 HB2 ARG 28 -6.495 -0.371 -25.003 237 HB3 ARG 28 HB1 ARG 28 -5.326 -1.636 -25.383 238 HG2 ARG 28 HG2 ARG 28 -3.616 -0.474 -24.043 239 HG3 ARG 28 HG1 ARG 28 -4.771 0.807 -23.672 240 HD2 ARG 28 HD2 ARG 28 -6.244 -0.834 -22.570 241 HD3 ARG 28 HD1 ARG 28 -5.097 -2.118 -22.943 242 HE ARG 28 HE ARG 28 -3.741 -0.088 -21.533 243 HH11 ARG 28 HH11 ARG 28 -3.335 -0.375 -19.317 244 HH12 ARG 28 HH12 ARG 28 -4.279 -1.508 -18.409 245 HH21 ARG 28 HH21 ARG 28 -6.214 -2.474 -21.121 246 HH22 ARG 28 HH22 ARG 28 -5.908 -2.697 -19.430 247 H HIS 29 HN HIS 29 -7.195 0.737 -27.347 248 HA HIS 29 HA HIS 29 -6.979 -1.273 -29.482 249 HB2 HIS 29 HB2 HIS 29 -9.299 0.475 -28.622 250 HB3 HIS 29 HB1 HIS 29 -9.368 -0.797 -29.844 251 HD2 HIS 29 HD2 HIS 29 -9.814 -0.458 -26.071 252 HE1 HIS 29 HE1 HIS 29 -9.073 -4.555 -26.774 253 HE2 HIS 29 HE2 HIS 29 -9.842 -2.860 -25.047 254 H ASP 30 HN ASP 30 -6.587 -0.775 -31.542 255 HA ASP 30 HA ASP 30 -6.158 2.025 -32.272 256 HB2 ASP 30 HB2 ASP 30 -5.102 1.133 -34.268 257 HB3 ASP 30 HB1 ASP 30 -4.476 0.293 -32.850 258 H HIS 31 HN HIS 31 -8.819 0.212 -32.119 259 HA HIS 31 HA HIS 31 -9.928 1.058 -34.733 260 HB2 HIS 31 HB2 HIS 31 -10.980 -0.937 -32.713 261 HB3 HIS 31 HB1 HIS 31 -11.727 -0.553 -34.263 262 HD2 HIS 31 HD2 HIS 31 -9.120 -2.977 -32.890 263 HE1 HIS 31 HE1 HIS 31 -8.457 -2.818 -37.056 264 HE2 HIS 31 HE2 HIS 31 -7.891 -4.067 -34.919 265 H ASP 32 HN ASP 32 -11.153 2.806 -34.766 266 HA ASP 32 HA ASP 32 -11.889 4.276 -32.474 267 HB2 ASP 32 HB2 ASP 32 -11.620 5.257 -34.736 268 HB3 ASP 32 HB1 ASP 32 -13.084 4.422 -35.251 269 H GLU 33 HN GLU 33 -13.711 2.028 -34.521 270 HA GLU 33 HA GLU 33 -16.247 2.424 -33.376 271 HB2 GLU 33 HB2 GLU 33 -15.868 1.195 -35.484 272 HB3 GLU 33 HB1 GLU 33 -15.105 -0.111 -34.576 273 HG2 GLU 33 HG2 GLU 33 -17.186 -0.511 -33.346 274 HG3 GLU 33 HG1 GLU 33 -17.955 0.843 -34.172 275 H GLU 34 HN GLU 34 -13.629 0.180 -32.506 276 HA GLU 34 HA GLU 34 -15.024 -1.214 -30.490 277 HB2 GLU 34 HB2 GLU 34 -12.874 -1.975 -31.457 278 HB3 GLU 34 HB1 GLU 34 -12.056 -0.634 -30.654 279 HG2 GLU 34 HG2 GLU 34 -12.736 -1.488 -28.464 280 HG3 GLU 34 HG1 GLU 34 -13.643 -2.790 -29.231 281 H ALA 35 HN ALA 35 -13.032 1.718 -30.389 282 HA ALA 35 HA ALA 35 -13.061 2.098 -27.596 283 HB1 ALA 35 HB1 ALA 35 -12.617 4.510 -28.189 284 HB2 ALA 35 HB2 ALA 35 -12.820 4.060 -29.883 285 HB3 ALA 35 HB3 ALA 35 -11.512 3.354 -28.933 286 H GLU 36 HN GLU 36 -15.289 3.104 -30.144 287 HA GLU 36 HA GLU 36 -16.937 4.782 -28.598 288 HB2 GLU 36 HB2 GLU 36 -16.973 4.642 -31.086 289 HB3 GLU 36 HB1 GLU 36 -17.752 3.066 -30.957 290 HG2 GLU 36 HG2 GLU 36 -18.918 5.498 -29.590 291 HG3 GLU 36 HG1 GLU 36 -19.266 5.153 -31.281 292 H ARG 37 HN ARG 37 -17.019 1.291 -29.177 293 HA ARG 37 HA ARG 37 -19.490 0.733 -27.968 294 HB2 ARG 37 HB2 ARG 37 -18.242 -0.908 -29.314 295 HB3 ARG 37 HB1 ARG 37 -17.004 -0.996 -28.060 296 HG2 ARG 37 HG2 ARG 37 -18.600 -1.873 -26.461 297 HG3 ARG 37 HG1 ARG 37 -19.931 -1.630 -27.593 298 HD2 ARG 37 HD2 ARG 37 -18.952 -3.261 -29.135 299 HD3 ARG 37 HD1 ARG 37 -17.567 -3.467 -28.067 300 HE ARG 37 HE ARG 37 -19.823 -4.023 -26.538 301 HH11 ARG 37 HH11 ARG 37 -20.536 -6.162 -26.262 302 HH12 ARG 37 HH12 ARG 37 -20.096 -7.373 -27.419 303 HH21 ARG 37 HH21 ARG 37 -18.276 -5.188 -29.404 304 HH22 ARG 37 HH22 ARG 37 -18.816 -6.821 -29.199 305 H LYS 38 HN LYS 38 -16.216 0.881 -26.576 306 HA LYS 38 HA LYS 38 -16.933 0.114 -23.957 307 HB2 LYS 38 HB2 LYS 38 -14.654 1.795 -25.008 308 HB3 LYS 38 HB1 LYS 38 -14.805 1.327 -23.314 309 HG2 LYS 38 HG2 LYS 38 -14.835 -1.053 -23.972 310 HG3 LYS 38 HG1 LYS 38 -14.672 -0.584 -25.666 311 HD2 LYS 38 HD2 LYS 38 -12.510 0.461 -25.200 312 HD3 LYS 38 HD1 LYS 38 -12.677 0.090 -23.484 313 HE2 LYS 38 HE2 LYS 38 -11.243 -1.580 -24.562 314 HE3 LYS 38 HE1 LYS 38 -12.748 -2.331 -24.036 315 HZ1 LYS 38 HZ1 LYS 38 -11.700 -2.042 -26.669 316 HZ2 LYS 38 HZ2 LYS 38 -13.267 -1.397 -26.557 317 HZ3 LYS 38 HZ3 LYS 38 -12.979 -3.012 -26.120 318 H ALA 39 HN ALA 39 -16.829 3.263 -25.563 319 HA ALA 39 HA ALA 39 -17.294 4.876 -23.301 320 HB1 ALA 39 HB1 ALA 39 -18.140 5.353 -26.170 321 HB2 ALA 39 HB2 ALA 39 -16.573 5.776 -25.479 322 HB3 ALA 39 HB3 ALA 39 -18.035 6.579 -24.906 323 H LEU 40 HN LEU 40 -19.509 3.213 -25.504 324 HA LEU 40 HA LEU 40 -21.911 4.327 -24.559 325 HB2 LEU 40 HB2 LEU 40 -21.775 3.028 -26.638 326 HB3 LEU 40 HB1 LEU 40 -21.396 1.574 -25.717 327 HG LEU 40 HG LEU 40 -23.593 1.713 -24.585 328 HD11 LEU 40 HD11 LEU 40 -23.773 4.253 -26.200 329 HD12 LEU 40 HD12 LEU 40 -24.200 3.977 -24.511 330 HD13 LEU 40 HD13 LEU 40 -25.246 3.372 -25.791 331 HD21 LEU 40 HD21 LEU 40 -23.509 0.365 -26.572 332 HD22 LEU 40 HD22 LEU 40 -23.588 1.786 -27.613 333 HD23 LEU 40 HD23 LEU 40 -24.995 1.309 -26.665 334 H GLU 41 HN GLU 41 -20.111 1.444 -23.539 335 HA GLU 41 HA GLU 41 -21.966 0.573 -21.584 336 HB2 GLU 41 HB2 GLU 41 -18.990 0.127 -21.868 337 HB3 GLU 41 HB1 GLU 41 -19.962 -0.631 -20.608 338 HG2 GLU 41 HG2 GLU 41 -20.583 -0.872 -23.568 339 HG3 GLU 41 HG1 GLU 41 -19.636 -2.055 -22.670 340 H ASP 42 HN ASP 42 -19.214 2.784 -21.457 341 HA ASP 42 HA ASP 42 -19.125 3.154 -18.668 342 HB2 ASP 42 HB2 ASP 42 -17.357 3.912 -20.231 343 HB3 ASP 42 HB1 ASP 42 -18.451 5.153 -20.838 344 H LYS 43 HN LYS 43 -20.955 4.827 -21.199 345 HA LYS 43 HA LYS 43 -22.098 6.815 -19.547 346 HB2 LYS 43 HB2 LYS 43 -23.023 5.590 -22.149 347 HB3 LYS 43 HB1 LYS 43 -23.873 6.915 -21.355 348 HG2 LYS 43 HG2 LYS 43 -21.822 8.286 -21.433 349 HG3 LYS 43 HG1 LYS 43 -20.966 6.967 -22.231 350 HD2 LYS 43 HD2 LYS 43 -22.555 7.066 -24.113 351 HD3 LYS 43 HD1 LYS 43 -23.415 8.384 -23.319 352 HE2 LYS 43 HE2 LYS 43 -21.375 9.769 -23.394 353 HE3 LYS 43 HE1 LYS 43 -20.508 8.450 -24.182 354 HZ1 LYS 43 HZ1 LYS 43 -22.185 10.394 -25.340 355 HZ2 LYS 43 HZ2 LYS 43 -22.854 8.856 -25.611 356 HZ3 LYS 43 HZ3 LYS 43 -21.264 9.194 -26.108 357 H LEU 44 HN LEU 44 -23.125 3.538 -20.378 358 HA LEU 44 HA LEU 44 -25.684 3.643 -19.197 359 HB2 LEU 44 HB2 LEU 44 -24.990 1.861 -20.743 360 HB3 LEU 44 HB1 LEU 44 -23.824 1.279 -19.561 361 HG LEU 44 HG LEU 44 -25.678 0.808 -17.978 362 HD11 LEU 44 HD11 LEU 44 -27.417 2.296 -18.495 363 HD12 LEU 44 HD12 LEU 44 -28.024 0.784 -19.162 364 HD13 LEU 44 HD13 LEU 44 -27.301 1.990 -20.228 365 HD21 LEU 44 HD21 LEU 44 -26.071 -0.410 -20.729 366 HD22 LEU 44 HD22 LEU 44 -26.593 -1.120 -19.202 367 HD23 LEU 44 HD23 LEU 44 -24.873 -0.935 -19.547 368 H ALA 45 HN ALA 45 -22.524 2.679 -17.910 369 HA ALA 45 HA ALA 45 -23.381 1.816 -15.375 370 HB1 ALA 45 HB1 ALA 45 -20.717 3.108 -15.937 371 HB2 ALA 45 HB2 ALA 45 -21.109 1.473 -16.467 372 HB3 ALA 45 HB3 ALA 45 -21.096 1.863 -14.747 373 H ASP 46 HN ASP 46 -22.399 5.042 -16.503 374 HA ASP 46 HA ASP 46 -22.872 6.153 -13.822 375 HB2 ASP 46 HB2 ASP 46 -21.864 8.186 -14.672 376 HB3 ASP 46 HB1 ASP 46 -20.830 6.814 -15.057 377 H LYS 47 HN LYS 47 -24.997 5.194 -15.808 378 HA LYS 47 HA LYS 47 -26.418 7.328 -16.889 379 HB2 LYS 47 HB2 LYS 47 -28.352 5.903 -16.891 380 HB3 LYS 47 HB1 LYS 47 -26.950 4.882 -17.190 381 HG2 LYS 47 HG2 LYS 47 -26.927 4.253 -14.773 382 HG3 LYS 47 HG1 LYS 47 -28.378 5.223 -14.528 383 HD2 LYS 47 HD2 LYS 47 -29.544 3.840 -16.249 384 HD3 LYS 47 HD1 LYS 47 -28.114 2.812 -16.334 385 HE2 LYS 47 HE2 LYS 47 -29.726 3.335 -13.822 386 HE3 LYS 47 HE1 LYS 47 -29.822 1.872 -14.804 387 HZ1 LYS 47 HZ1 LYS 47 -28.336 1.495 -12.988 388 HZ2 LYS 47 HZ2 LYS 47 -27.439 2.888 -13.357 389 HZ3 LYS 47 HZ3 LYS 47 -27.423 1.560 -14.416 390 H GLN 48 HN GLN 48 -25.960 6.433 -13.586 391 HA GLN 48 HA GLN 48 -26.867 7.199 -11.607 392 HB2 GLN 48 HB2 GLN 48 -26.645 9.697 -13.301 393 HB3 GLN 48 HB1 GLN 48 -27.024 9.736 -11.582 394 HG2 GLN 48 HG2 GLN 48 -24.937 8.664 -11.021 395 HG3 GLN 48 HG1 GLN 48 -24.576 8.371 -12.721 396 HE21 GLN 48 HE21 GLN 48 -22.993 9.995 -10.753 397 HE22 GLN 48 HE22 GLN 48 -22.898 11.550 -11.424 398 H GLU 49 HN GLU 49 -28.678 9.379 -11.165 399 HA GLU 49 HA GLU 49 -31.152 8.058 -11.446 400 HB2 GLU 49 HB2 GLU 49 -30.580 9.762 -9.690 401 HB3 GLU 49 HB1 GLU 49 -30.708 11.009 -10.926 402 HG2 GLU 49 HG2 GLU 49 -32.977 9.068 -10.453 403 HG3 GLU 49 HG1 GLU 49 -32.796 10.506 -9.452 404 H HIS 50 HN HIS 50 -29.601 10.635 -13.312 405 HA HIS 50 HA HIS 50 -31.379 10.069 -15.549 406 HB2 HIS 50 HB2 HIS 50 -32.001 12.467 -15.818 407 HB3 HIS 50 HB1 HIS 50 -32.640 11.762 -14.335 408 HD2 HIS 50 HD2 HIS 50 -30.958 14.944 -15.230 409 HE1 HIS 50 HE1 HIS 50 -29.584 14.130 -11.325 410 HE2 HIS 50 HE2 HIS 50 -29.763 15.913 -13.123 411 H LEU 51 HN LEU 51 -30.633 11.433 -17.572 412 HA LEU 51 HA LEU 51 -27.679 11.502 -17.560 413 HB2 LEU 51 HB2 LEU 51 -29.792 11.039 -19.645 414 HB3 LEU 51 HB1 LEU 51 -28.201 11.594 -20.147 415 HG LEU 51 HG LEU 51 -28.523 9.097 -20.160 416 HD11 LEU 51 HD11 LEU 51 -26.315 8.669 -19.575 417 HD12 LEU 51 HD12 LEU 51 -26.365 9.713 -18.160 418 HD13 LEU 51 HD13 LEU 51 -26.265 10.417 -19.771 419 HD21 LEU 51 HD21 LEU 51 -28.347 9.311 -17.151 420 HD22 LEU 51 HD22 LEU 51 -28.641 7.871 -18.121 421 HD23 LEU 51 HD23 LEU 51 -29.877 9.118 -18.006 422 H ASP 52 HN ASP 52 -30.511 13.449 -18.048 423 HA ASP 52 HA ASP 52 -29.432 15.578 -19.506 424 HB2 ASP 52 HB2 ASP 52 -31.846 15.300 -19.027 425 HB3 ASP 52 HB1 ASP 52 -31.545 15.734 -17.345 426 H GLY 53 HN GLY 53 -29.379 14.939 -16.027 427 HA2 GLY 53 HA2 GLY 53 -28.314 17.411 -15.194 428 HA3 GLY 53 HA1 GLY 53 -28.157 15.891 -14.316 429 H ALA 54 HN ALA 54 -26.742 14.445 -16.379 430 HA ALA 54 HA ALA 54 -24.081 15.412 -15.843 431 HB1 ALA 54 HB1 ALA 54 -24.999 13.106 -17.574 432 HB2 ALA 54 HB2 ALA 54 -24.621 13.002 -15.854 433 HB3 ALA 54 HB3 ALA 54 -23.352 13.395 -17.014 434 H LEU 55 HN LEU 55 -26.328 16.297 -18.107 435 HA LEU 55 HA LEU 55 -24.895 16.361 -20.522 436 HB2 LEU 55 HB2 LEU 55 -27.313 16.807 -20.383 437 HB3 LEU 55 HB1 LEU 55 -26.989 18.301 -19.509 438 HG LEU 55 HG LEU 55 -25.753 19.185 -21.460 439 HD11 LEU 55 HD11 LEU 55 -24.851 17.353 -22.613 440 HD12 LEU 55 HD12 LEU 55 -26.202 17.790 -23.651 441 HD13 LEU 55 HD13 LEU 55 -26.353 16.432 -22.536 442 HD21 LEU 55 HD21 LEU 55 -28.151 19.639 -21.265 443 HD22 LEU 55 HD22 LEU 55 -28.526 18.120 -22.078 444 HD23 LEU 55 HD23 LEU 55 -27.722 19.417 -22.962 445 H ARG 56 HN ARG 56 -25.077 18.705 -17.860 446 HA ARG 56 HA ARG 56 -23.545 20.738 -19.055 447 HB2 ARG 56 HB2 ARG 56 -23.269 21.628 -16.823 448 HB3 ARG 56 HB1 ARG 56 -24.905 20.994 -16.973 449 HG2 ARG 56 HG2 ARG 56 -24.139 18.872 -15.894 450 HG3 ARG 56 HG1 ARG 56 -22.555 19.606 -15.645 451 HD2 ARG 56 HD2 ARG 56 -23.611 21.416 -14.331 452 HD3 ARG 56 HD1 ARG 56 -25.181 20.644 -14.547 453 HE ARG 56 HE ARG 56 -23.382 18.768 -13.441 454 HH11 ARG 56 HH11 ARG 56 -23.496 18.331 -11.214 455 HH12 ARG 56 HH12 ARG 56 -24.261 19.465 -10.152 456 HH21 ARG 56 HH21 ARG 56 -25.051 21.702 -12.681 457 HH22 ARG 56 HH22 ARG 56 -25.142 21.373 -10.983 458 H TYR 57 HN TYR 57 -22.647 17.670 -17.788 459 HA TYR 57 HA TYR 57 -19.858 18.158 -18.482 460 HB2 TYR 57 HB2 TYR 57 -19.885 18.863 -16.150 461 HB3 TYR 57 HB1 TYR 57 -20.698 17.371 -15.680 462 HD1 TYR 57 HD1 TYR 57 -17.571 18.721 -17.198 463 HD2 TYR 57 HD2 TYR 57 -19.464 15.380 -15.272 464 HE1 TYR 57 HE1 TYR 57 -15.374 17.594 -16.994 465 HE2 TYR 57 HE2 TYR 57 -17.266 14.253 -15.068 466 HH TYR 57 HH TYR 57 -14.993 14.403 -16.401 Start of MODEL 10 1 H1 GLY 1 HT1 GLY 1 20.405 -3.951 -45.298 2 H2 GLY 1 HT2 GLY 1 22.043 -4.399 -45.280 3 H3 GLY 1 HT3 GLY 1 20.857 -5.482 -44.728 4 HA2 GLY 1 HA2 GLY 1 21.201 -4.530 -47.520 5 HA3 GLY 1 HA1 GLY 1 21.591 -6.141 -46.914 6 H SER 2 HN SER 2 19.085 -5.545 -45.082 7 HA SER 2 HA SER 2 16.917 -5.888 -47.008 8 HB2 SER 2 HB2 SER 2 17.756 -8.181 -46.726 9 HB3 SER 2 HB1 SER 2 17.604 -8.030 -44.979 10 HG SER 2 HG SER 2 15.358 -7.376 -46.460 11 H LYS 3 HN LYS 3 14.889 -5.465 -46.142 12 HA LYS 3 HA LYS 3 14.779 -3.681 -43.964 13 HB2 LYS 3 HB2 LYS 3 12.621 -5.235 -45.401 14 HB3 LYS 3 HB1 LYS 3 12.282 -4.031 -44.157 15 HG2 LYS 3 HG2 LYS 3 13.487 -2.327 -45.474 16 HG3 LYS 3 HG1 LYS 3 13.822 -3.529 -46.721 17 HD2 LYS 3 HD2 LYS 3 11.420 -3.827 -47.115 18 HD3 LYS 3 HD1 LYS 3 11.051 -2.679 -45.827 19 HE2 LYS 3 HE2 LYS 3 10.920 -1.559 -48.003 20 HE3 LYS 3 HE1 LYS 3 12.276 -0.916 -47.077 21 HZ1 LYS 3 HZ1 LYS 3 13.189 -3.130 -48.507 22 HZ2 LYS 3 HZ2 LYS 3 13.616 -1.499 -48.718 23 HZ3 LYS 3 HZ3 LYS 3 12.316 -2.159 -49.591 24 H THR 4 HN THR 4 14.102 -7.142 -44.219 25 HA THR 4 HA THR 4 12.969 -7.519 -41.672 26 HB THR 4 HB THR 4 14.620 -9.434 -43.337 27 HG1 THR 4 HG1 THR 4 12.426 -10.172 -43.816 28 HG21 THR 4 HG21 THR 4 12.850 -9.805 -40.917 29 HG22 THR 4 HG22 THR 4 14.528 -10.310 -41.123 30 HG23 THR 4 HG23 THR 4 13.244 -11.131 -42.012 31 H ILE 5 HN ILE 5 16.356 -7.701 -42.756 32 HA ILE 5 HA ILE 5 17.462 -8.496 -40.288 33 HB ILE 5 HB ILE 5 18.649 -6.926 -42.587 34 HG12 ILE 5 HG12 ILE 5 19.064 -9.805 -41.728 35 HG13 ILE 5 HG11 ILE 5 17.877 -9.320 -42.940 36 HG21 ILE 5 HG21 ILE 5 20.845 -7.705 -41.523 37 HG22 ILE 5 HG22 ILE 5 19.906 -8.045 -40.070 38 HG23 ILE 5 HG23 ILE 5 20.007 -6.396 -40.690 39 HD11 ILE 5 HD11 ILE 5 20.885 -9.020 -43.073 40 HD12 ILE 5 HD12 ILE 5 19.797 -8.184 -44.180 41 HD13 ILE 5 HD13 ILE 5 19.845 -9.947 -44.152 42 H GLN 6 HN GLN 6 16.916 -5.269 -41.682 43 HA GLN 6 HA GLN 6 18.090 -3.780 -39.597 44 HB2 GLN 6 HB2 GLN 6 17.484 -2.846 -41.815 45 HB3 GLN 6 HB1 GLN 6 15.779 -2.979 -41.382 46 HG2 GLN 6 HG2 GLN 6 16.106 -1.459 -39.493 47 HG3 GLN 6 HG1 GLN 6 17.834 -1.375 -39.834 48 HE21 GLN 6 HE21 GLN 6 16.693 1.064 -39.870 49 HE22 GLN 6 HE22 GLN 6 16.405 1.612 -41.451 50 H GLU 7 HN GLU 7 14.782 -4.966 -40.066 51 HA GLU 7 HA GLU 7 13.648 -3.684 -37.807 52 HB2 GLU 7 HB2 GLU 7 12.838 -6.167 -39.326 53 HB3 GLU 7 HB1 GLU 7 11.893 -5.503 -37.995 54 HG2 GLU 7 HG2 GLU 7 12.693 -3.887 -40.433 55 HG3 GLU 7 HG1 GLU 7 11.157 -4.735 -40.290 56 H LYS 8 HN LYS 8 15.234 -6.813 -38.242 57 HA LYS 8 HA LYS 8 14.681 -7.897 -35.706 58 HB2 LYS 8 HB2 LYS 8 15.601 -9.227 -37.561 59 HB3 LYS 8 HB1 LYS 8 17.109 -8.319 -37.456 60 HG2 LYS 8 HG2 LYS 8 17.565 -9.160 -35.252 61 HG3 LYS 8 HG1 LYS 8 15.948 -9.848 -35.116 62 HD2 LYS 8 HD2 LYS 8 17.423 -11.672 -35.613 63 HD3 LYS 8 HD1 LYS 8 16.531 -11.331 -37.095 64 HE2 LYS 8 HE2 LYS 8 18.413 -10.114 -38.020 65 HE3 LYS 8 HE1 LYS 8 19.288 -10.220 -36.493 66 HZ1 LYS 8 HZ1 LYS 8 19.320 -12.624 -36.728 67 HZ2 LYS 8 HZ2 LYS 8 20.054 -11.878 -38.067 68 HZ3 LYS 8 HZ3 LYS 8 18.482 -12.512 -38.199 69 H GLU 9 HN GLU 9 17.373 -5.884 -36.847 70 HA GLU 9 HA GLU 9 18.835 -5.888 -34.423 71 HB2 GLU 9 HB2 GLU 9 18.757 -3.940 -36.729 72 HB3 GLU 9 HB1 GLU 9 19.841 -3.748 -35.354 73 HG2 GLU 9 HG2 GLU 9 20.906 -5.870 -35.809 74 HG3 GLU 9 HG1 GLU 9 19.724 -6.255 -37.057 75 H GLN 10 HN GLN 10 16.271 -3.794 -35.665 76 HA GLN 10 HA GLN 10 16.377 -1.830 -33.647 77 HB2 GLN 10 HB2 GLN 10 15.117 -1.619 -35.797 78 HB3 GLN 10 HB1 GLN 10 13.938 -2.771 -35.177 79 HG2 GLN 10 HG2 GLN 10 13.126 -0.497 -34.812 80 HG3 GLN 10 HG1 GLN 10 13.492 -1.248 -33.260 81 HE21 GLN 10 HE21 GLN 10 14.496 0.240 -31.910 82 HE22 GLN 10 HE22 GLN 10 15.636 1.395 -32.408 83 H GLU 11 HN GLU 11 14.633 -4.901 -33.870 84 HA GLU 11 HA GLU 11 13.079 -4.628 -31.534 85 HB2 GLU 11 HB2 GLU 11 12.669 -6.358 -33.247 86 HB3 GLU 11 HB1 GLU 11 14.178 -7.150 -32.805 87 HG2 GLU 11 HG2 GLU 11 12.296 -8.269 -31.709 88 HG3 GLU 11 HG1 GLU 11 13.306 -7.486 -30.499 89 H LEU 12 HN LEU 12 16.327 -5.937 -32.075 90 HA LEU 12 HA LEU 12 16.770 -6.858 -29.436 91 HB2 LEU 12 HB2 LEU 12 18.678 -5.986 -31.611 92 HB3 LEU 12 HB1 LEU 12 19.220 -6.642 -30.070 93 HG LEU 12 HG LEU 12 17.309 -8.090 -31.935 94 HD11 LEU 12 HD11 LEU 12 20.318 -8.251 -31.652 95 HD12 LEU 12 HD12 LEU 12 19.391 -7.881 -33.107 96 HD13 LEU 12 HD13 LEU 12 19.353 -9.508 -32.427 97 HD21 LEU 12 HD21 LEU 12 18.361 -10.053 -30.488 98 HD22 LEU 12 HD22 LEU 12 17.025 -9.107 -29.847 99 HD23 LEU 12 HD23 LEU 12 18.674 -8.760 -29.331 100 H LYS 13 HN LYS 13 17.324 -3.741 -31.001 101 HA LYS 13 HA LYS 13 18.629 -2.573 -28.723 102 HB2 LYS 13 HB2 LYS 13 17.397 -1.359 -31.204 103 HB3 LYS 13 HB1 LYS 13 18.222 -0.416 -29.963 104 HG2 LYS 13 HG2 LYS 13 20.271 -1.751 -30.304 105 HG3 LYS 13 HG1 LYS 13 19.452 -2.693 -31.550 106 HD2 LYS 13 HD2 LYS 13 19.096 -0.630 -32.868 107 HD3 LYS 13 HD1 LYS 13 19.950 0.296 -31.633 108 HE2 LYS 13 HE2 LYS 13 21.139 -2.008 -33.205 109 HE3 LYS 13 HE1 LYS 13 21.434 -0.301 -33.536 110 HZ1 LYS 13 HZ1 LYS 13 22.060 -1.702 -30.993 111 HZ2 LYS 13 HZ2 LYS 13 22.345 -0.058 -31.316 112 HZ3 LYS 13 HZ3 LYS 13 23.189 -1.256 -32.178 113 H ASN 14 HN ASN 14 17.799 -1.200 -27.178 114 HA ASN 14 HA ASN 14 14.902 -1.405 -26.730 115 HB2 ASN 14 HB2 ASN 14 16.704 -1.919 -24.959 116 HB3 ASN 14 HB1 ASN 14 16.916 -0.173 -24.853 117 HD21 ASN 14 HD21 ASN 14 15.973 0.077 -22.742 118 HD22 ASN 14 HD22 ASN 14 14.331 -0.229 -22.436 119 H LEU 15 HN LEU 15 16.587 0.534 -28.564 120 HA LEU 15 HA LEU 15 15.493 3.093 -27.572 121 HB2 LEU 15 HB2 LEU 15 17.883 3.084 -28.116 122 HB3 LEU 15 HB1 LEU 15 17.526 2.501 -29.740 123 HG LEU 15 HG LEU 15 16.255 4.573 -30.209 124 HD11 LEU 15 HD11 LEU 15 16.916 5.114 -27.317 125 HD12 LEU 15 HD12 LEU 15 15.384 5.329 -28.166 126 HD13 LEU 15 HD13 LEU 15 16.705 6.462 -28.435 127 HD21 LEU 15 HD21 LEU 15 18.164 6.035 -30.389 128 HD22 LEU 15 HD22 LEU 15 18.750 4.384 -30.588 129 HD23 LEU 15 HD23 LEU 15 18.980 5.222 -29.054 130 H LYS 16 HN LYS 16 13.658 3.815 -28.418 131 HA LYS 16 HA LYS 16 12.923 3.054 -31.193 132 HB2 LYS 16 HB2 LYS 16 11.039 3.295 -28.832 133 HB3 LYS 16 HB1 LYS 16 10.593 2.878 -30.483 134 HG2 LYS 16 HG2 LYS 16 12.528 1.240 -28.824 135 HG3 LYS 16 HG1 LYS 16 10.801 0.907 -28.900 136 HD2 LYS 16 HD2 LYS 16 11.055 0.762 -31.429 137 HD3 LYS 16 HD1 LYS 16 12.799 0.798 -31.173 138 HE2 LYS 16 HE2 LYS 16 12.041 -1.519 -31.328 139 HE3 LYS 16 HE1 LYS 16 12.616 -1.180 -29.696 140 HZ1 LYS 16 HZ1 LYS 16 10.148 -2.165 -30.407 141 HZ2 LYS 16 HZ2 LYS 16 9.861 -0.552 -29.956 142 HZ3 LYS 16 HZ3 LYS 16 10.621 -1.618 -28.873 143 H ASP 17 HN ASP 17 11.813 4.609 -32.378 144 HA ASP 17 HA ASP 17 12.472 7.302 -31.845 145 HB2 ASP 17 HB2 ASP 17 10.509 6.033 -33.758 146 HB3 ASP 17 HB1 ASP 17 10.807 7.769 -33.708 147 H ASN 18 HN ASN 18 11.278 9.015 -31.072 148 HA ASN 18 HA ASN 18 9.373 8.507 -29.061 149 HB2 ASN 18 HB2 ASN 18 10.832 10.552 -29.264 150 HB3 ASN 18 HB1 ASN 18 9.751 11.118 -30.536 151 HD21 ASN 18 HD21 ASN 18 8.862 12.901 -29.331 152 HD22 ASN 18 HD22 ASN 18 7.896 12.671 -27.954 153 H VAL 19 HN VAL 19 9.016 9.531 -32.434 154 HA VAL 19 HA VAL 19 6.239 10.011 -32.392 155 HB VAL 19 HB VAL 19 8.092 9.155 -34.625 156 HG11 VAL 19 HG11 VAL 19 5.167 9.927 -34.655 157 HG12 VAL 19 HG12 VAL 19 5.917 8.487 -35.346 158 HG13 VAL 19 HG13 VAL 19 6.194 10.064 -36.083 159 HG21 VAL 19 HG21 VAL 19 6.842 11.814 -33.863 160 HG22 VAL 19 HG22 VAL 19 7.875 11.538 -35.266 161 HG23 VAL 19 HG23 VAL 19 8.534 11.369 -33.639 162 H GLU 20 HN GLU 20 8.107 7.079 -33.133 163 HA GLU 20 HA GLU 20 5.929 5.427 -33.816 164 HB2 GLU 20 HB2 GLU 20 8.290 4.852 -34.274 165 HB3 GLU 20 HB1 GLU 20 8.563 4.639 -32.545 166 HG2 GLU 20 HG2 GLU 20 6.902 2.838 -32.474 167 HG3 GLU 20 HG1 GLU 20 6.546 3.077 -34.184 168 H LEU 21 HN LEU 21 7.493 6.104 -30.709 169 HA LEU 21 HA LEU 21 6.092 4.225 -29.157 170 HB2 LEU 21 HB2 LEU 21 8.088 5.397 -28.343 171 HB3 LEU 21 HB1 LEU 21 7.213 6.925 -28.360 172 HG LEU 21 HG LEU 21 5.631 6.039 -26.673 173 HD11 LEU 21 HD11 LEU 21 6.511 3.844 -25.519 174 HD12 LEU 21 HD12 LEU 21 7.276 3.544 -27.079 175 HD13 LEU 21 HD13 LEU 21 5.524 3.715 -26.972 176 HD21 LEU 21 HD21 LEU 21 7.511 7.240 -25.800 177 HD22 LEU 21 HD22 LEU 21 8.589 5.867 -26.050 178 HD23 LEU 21 HD23 LEU 21 7.345 5.796 -24.802 179 H GLU 22 HN GLU 22 5.356 7.606 -29.963 180 HA GLU 22 HA GLU 22 3.045 7.867 -28.376 181 HB2 GLU 22 HB2 GLU 22 4.209 9.775 -29.431 182 HB3 GLU 22 HB1 GLU 22 3.677 9.213 -31.015 183 HG2 GLU 22 HG2 GLU 22 1.332 9.487 -30.356 184 HG3 GLU 22 HG1 GLU 22 1.827 9.974 -28.735 185 H ARG 23 HN ARG 23 3.476 6.773 -31.726 186 HA ARG 23 HA ARG 23 0.732 6.451 -32.337 187 HB2 ARG 23 HB2 ARG 23 3.170 5.029 -33.437 188 HB3 ARG 23 HB1 ARG 23 1.561 4.936 -34.143 189 HG2 ARG 23 HG2 ARG 23 3.018 7.559 -33.732 190 HG3 ARG 23 HG1 ARG 23 3.152 6.620 -35.214 191 HD2 ARG 23 HD2 ARG 23 0.654 6.742 -35.446 192 HD3 ARG 23 HD1 ARG 23 0.615 7.821 -34.058 193 HE ARG 23 HE ARG 23 1.564 8.476 -36.725 194 HH11 ARG 23 HH11 ARG 23 2.042 10.672 -37.046 195 HH12 ARG 23 HH12 ARG 23 2.155 11.737 -35.684 196 HH21 ARG 23 HH21 ARG 23 1.461 9.263 -33.356 197 HH22 ARG 23 HH22 ARG 23 1.826 10.939 -33.596 198 H LEU 24 HN LEU 24 3.120 4.301 -30.892 199 HA LEU 24 HA LEU 24 1.617 1.931 -30.930 200 HB2 LEU 24 HB2 LEU 24 4.015 1.980 -30.422 201 HB3 LEU 24 HB1 LEU 24 3.693 2.852 -28.927 202 HG LEU 24 HG LEU 24 2.376 0.930 -28.086 203 HD11 LEU 24 HD11 LEU 24 2.994 -0.136 -30.838 204 HD12 LEU 24 HD12 LEU 24 1.469 -0.163 -29.953 205 HD13 LEU 24 HD13 LEU 24 2.769 -1.257 -29.496 206 HD21 LEU 24 HD21 LEU 24 4.316 -0.691 -27.943 207 HD22 LEU 24 HD22 LEU 24 4.714 0.970 -27.504 208 HD23 LEU 24 HD23 LEU 24 5.175 0.342 -29.086 209 H LYS 25 HN LYS 25 1.794 4.533 -28.525 210 HA LYS 25 HA LYS 25 0.441 5.079 -26.752 211 HB2 LYS 25 HB2 LYS 25 -1.618 3.427 -28.245 212 HB3 LYS 25 HB1 LYS 25 -1.940 4.601 -26.972 213 HG2 LYS 25 HG2 LYS 25 -1.064 6.409 -28.343 214 HG3 LYS 25 HG1 LYS 25 -0.563 5.267 -29.586 215 HD2 LYS 25 HD2 LYS 25 -2.616 6.208 -30.360 216 HD3 LYS 25 HD1 LYS 25 -3.014 4.593 -29.782 217 HE2 LYS 25 HE2 LYS 25 -3.904 5.474 -27.715 218 HE3 LYS 25 HE1 LYS 25 -3.308 7.090 -28.089 219 HZ1 LYS 25 HZ1 LYS 25 -4.780 6.536 -30.253 220 HZ2 LYS 25 HZ2 LYS 25 -5.364 7.370 -28.892 221 HZ3 LYS 25 HZ3 LYS 25 -5.653 5.703 -29.060 222 H ASN 26 HN ASN 26 -0.690 4.181 -24.847 223 HA ASN 26 HA ASN 26 0.461 1.590 -24.123 224 HB2 ASN 26 HB2 ASN 26 -0.155 2.170 -21.853 225 HB3 ASN 26 HB1 ASN 26 0.650 3.550 -22.599 226 HD21 ASN 26 HD21 ASN 26 -0.678 4.612 -20.690 227 HD22 ASN 26 HD22 ASN 26 -2.239 5.147 -21.090 228 H GLU 27 HN GLU 27 -2.201 2.409 -25.736 229 HA GLU 27 HA GLU 27 -3.748 0.129 -24.675 230 HB2 GLU 27 HB2 GLU 27 -4.734 2.187 -23.724 231 HB3 GLU 27 HB1 GLU 27 -4.911 2.849 -25.347 232 HG2 GLU 27 HG2 GLU 27 -7.036 1.885 -24.601 233 HG3 GLU 27 HG1 GLU 27 -6.396 0.941 -25.941 234 H ARG 28 HN ARG 28 -4.504 -1.172 -26.235 235 HA ARG 28 HA ARG 28 -4.616 -0.173 -29.024 236 HB2 ARG 28 HB2 ARG 28 -3.420 -2.793 -28.082 237 HB3 ARG 28 HB1 ARG 28 -3.681 -2.343 -29.768 238 HG2 ARG 28 HG2 ARG 28 -2.181 -0.429 -29.527 239 HG3 ARG 28 HG1 ARG 28 -1.973 -0.780 -27.811 240 HD2 ARG 28 HD2 ARG 28 -0.064 -1.674 -29.016 241 HD3 ARG 28 HD1 ARG 28 -1.042 -3.017 -28.431 242 HE ARG 28 HE ARG 28 -1.842 -2.292 -31.064 243 HH11 ARG 28 HH11 ARG 28 -1.204 -3.651 -32.769 244 HH12 ARG 28 HH12 ARG 28 0.106 -4.761 -32.540 245 HH21 ARG 28 HH21 ARG 28 0.683 -3.816 -29.255 246 HH22 ARG 28 HH22 ARG 28 1.174 -4.855 -30.551 247 H HIS 29 HN HIS 29 -6.177 -1.132 -30.333 248 HA HIS 29 HA HIS 29 -8.044 -3.043 -29.056 249 HB2 HIS 29 HB2 HIS 29 -8.844 -0.516 -30.524 250 HB3 HIS 29 HB1 HIS 29 -9.948 -1.747 -29.913 251 HD2 HIS 29 HD2 HIS 29 -8.291 1.452 -28.662 252 HE1 HIS 29 HE1 HIS 29 -9.486 -0.651 -25.202 253 HE2 HIS 29 HE2 HIS 29 -8.639 1.578 -26.077 254 H ASP 30 HN ASP 30 -9.071 -4.443 -30.465 255 HA ASP 30 HA ASP 30 -7.712 -5.125 -32.837 256 HB2 ASP 30 HB2 ASP 30 -10.433 -5.893 -31.774 257 HB3 ASP 30 HB1 ASP 30 -9.755 -6.574 -33.252 258 H HIS 31 HN HIS 31 -10.671 -3.270 -32.262 259 HA HIS 31 HA HIS 31 -10.524 -2.253 -35.037 260 HB2 HIS 31 HB2 HIS 31 -13.028 -3.220 -33.633 261 HB3 HIS 31 HB1 HIS 31 -12.992 -2.381 -35.185 262 HD2 HIS 31 HD2 HIS 31 -12.251 -3.983 -37.376 263 HE1 HIS 31 HE1 HIS 31 -11.544 -7.524 -35.191 264 HE2 HIS 31 HE2 HIS 31 -11.738 -6.538 -37.523 265 H ASP 32 HN ASP 32 -11.246 -0.143 -35.311 266 HA ASP 32 HA ASP 32 -10.892 1.615 -33.138 267 HB2 ASP 32 HB2 ASP 32 -12.120 1.998 -35.870 268 HB3 ASP 32 HB1 ASP 32 -11.902 3.319 -34.725 269 H GLU 33 HN GLU 33 -13.802 0.297 -34.651 270 HA GLU 33 HA GLU 33 -15.701 1.884 -33.320 271 HB2 GLU 33 HB2 GLU 33 -17.333 0.263 -33.970 272 HB3 GLU 33 HB1 GLU 33 -16.142 0.330 -35.265 273 HG2 GLU 33 HG2 GLU 33 -15.003 -1.670 -34.210 274 HG3 GLU 33 HG1 GLU 33 -16.361 -1.779 -33.096 275 H GLU 34 HN GLU 34 -13.694 -0.654 -32.154 276 HA GLU 34 HA GLU 34 -15.269 -1.635 -30.034 277 HB2 GLU 34 HB2 GLU 34 -13.147 -2.672 -30.838 278 HB3 GLU 34 HB1 GLU 34 -12.255 -1.344 -30.102 279 HG2 GLU 34 HG2 GLU 34 -14.197 -3.001 -28.483 280 HG3 GLU 34 HG1 GLU 34 -12.536 -3.531 -28.730 281 H ALA 35 HN ALA 35 -13.032 1.106 -30.232 282 HA ALA 35 HA ALA 35 -13.073 1.829 -27.510 283 HB1 ALA 35 HB1 ALA 35 -11.454 2.721 -29.162 284 HB2 ALA 35 HB2 ALA 35 -12.261 4.004 -28.262 285 HB3 ALA 35 HB3 ALA 35 -12.756 3.641 -29.915 286 H GLU 36 HN GLU 36 -15.181 2.702 -30.211 287 HA GLU 36 HA GLU 36 -16.710 4.658 -28.852 288 HB2 GLU 36 HB2 GLU 36 -17.340 2.887 -31.216 289 HB3 GLU 36 HB1 GLU 36 -18.460 4.107 -30.610 290 HG2 GLU 36 HG2 GLU 36 -16.864 5.874 -31.022 291 HG3 GLU 36 HG1 GLU 36 -15.601 4.714 -31.425 292 H ARG 37 HN ARG 37 -17.039 1.154 -29.150 293 HA ARG 37 HA ARG 37 -19.574 0.921 -27.920 294 HB2 ARG 37 HB2 ARG 37 -17.259 -1.009 -28.151 295 HB3 ARG 37 HB1 ARG 37 -18.799 -1.451 -27.421 296 HG2 ARG 37 HG2 ARG 37 -18.751 -0.221 -30.176 297 HG3 ARG 37 HG1 ARG 37 -18.393 -1.934 -29.977 298 HD2 ARG 37 HD2 ARG 37 -20.557 -2.234 -28.803 299 HD3 ARG 37 HD1 ARG 37 -20.922 -0.531 -29.051 300 HE ARG 37 HE ARG 37 -20.335 -1.663 -31.553 301 HH11 ARG 37 HH11 ARG 37 -22.044 -2.252 -32.928 302 HH12 ARG 37 HH12 ARG 37 -23.622 -2.526 -32.270 303 HH21 ARG 37 HH21 ARG 37 -22.670 -1.850 -29.006 304 HH22 ARG 37 HH22 ARG 37 -23.977 -2.299 -30.050 305 H LYS 38 HN LYS 38 -16.292 0.977 -26.614 306 HA LYS 38 HA LYS 38 -16.924 0.297 -23.954 307 HB2 LYS 38 HB2 LYS 38 -14.685 1.939 -25.149 308 HB3 LYS 38 HB1 LYS 38 -14.773 1.547 -23.435 309 HG2 LYS 38 HG2 LYS 38 -15.022 -0.675 -25.456 310 HG3 LYS 38 HG1 LYS 38 -13.425 -0.025 -25.099 311 HD2 LYS 38 HD2 LYS 38 -15.234 -0.806 -22.816 312 HD3 LYS 38 HD1 LYS 38 -14.359 -2.058 -23.693 313 HE2 LYS 38 HE2 LYS 38 -13.027 0.382 -22.480 314 HE3 LYS 38 HE1 LYS 38 -13.134 -1.183 -21.676 315 HZ1 LYS 38 HZ1 LYS 38 -12.105 -2.081 -23.815 316 HZ2 LYS 38 HZ2 LYS 38 -11.093 -1.237 -22.743 317 HZ3 LYS 38 HZ3 LYS 38 -11.679 -0.472 -24.142 318 H ALA 39 HN ALA 39 -16.863 3.406 -25.643 319 HA ALA 39 HA ALA 39 -17.244 5.072 -23.406 320 HB1 ALA 39 HB1 ALA 39 -17.801 6.782 -24.956 321 HB2 ALA 39 HB2 ALA 39 -18.360 5.617 -26.155 322 HB3 ALA 39 HB3 ALA 39 -16.639 5.752 -25.792 323 H LEU 40 HN LEU 40 -19.542 3.390 -25.504 324 HA LEU 40 HA LEU 40 -21.900 4.531 -24.423 325 HB2 LEU 40 HB2 LEU 40 -21.395 1.903 -25.827 326 HB3 LEU 40 HB1 LEU 40 -23.002 2.440 -25.350 327 HG LEU 40 HG LEU 40 -21.143 4.064 -27.121 328 HD11 LEU 40 HD11 LEU 40 -23.351 2.112 -27.810 329 HD12 LEU 40 HD12 LEU 40 -21.666 2.060 -28.329 330 HD13 LEU 40 HD13 LEU 40 -22.740 3.314 -28.946 331 HD21 LEU 40 HD21 LEU 40 -22.707 5.596 -26.296 332 HD22 LEU 40 HD22 LEU 40 -23.975 4.382 -26.133 333 HD23 LEU 40 HD23 LEU 40 -23.551 5.010 -27.724 334 H GLU 41 HN GLU 41 -19.993 1.694 -23.544 335 HA GLU 41 HA GLU 41 -21.761 0.606 -21.641 336 HB2 GLU 41 HB2 GLU 41 -19.804 -0.601 -22.547 337 HB3 GLU 41 HB1 GLU 41 -18.735 0.499 -21.678 338 HG2 GLU 41 HG2 GLU 41 -19.678 -0.232 -19.537 339 HG3 GLU 41 HG1 GLU 41 -20.819 -1.281 -20.377 340 H ASP 42 HN ASP 42 -19.166 3.008 -21.334 341 HA ASP 42 HA ASP 42 -19.234 3.269 -18.531 342 HB2 ASP 42 HB2 ASP 42 -18.447 5.195 -20.719 343 HB3 ASP 42 HB1 ASP 42 -18.268 5.568 -19.005 344 H LYS 43 HN LYS 43 -21.079 4.882 -21.087 345 HA LYS 43 HA LYS 43 -22.366 6.805 -19.481 346 HB2 LYS 43 HB2 LYS 43 -22.374 6.865 -21.947 347 HB3 LYS 43 HB1 LYS 43 -23.392 5.427 -21.977 348 HG2 LYS 43 HG2 LYS 43 -25.162 6.631 -20.762 349 HG3 LYS 43 HG1 LYS 43 -24.140 8.068 -20.685 350 HD2 LYS 43 HD2 LYS 43 -24.106 8.179 -23.147 351 HD3 LYS 43 HD1 LYS 43 -25.123 6.740 -23.229 352 HE2 LYS 43 HE2 LYS 43 -26.904 7.921 -22.002 353 HE3 LYS 43 HE1 LYS 43 -25.889 9.360 -21.908 354 HZ1 LYS 43 HZ1 LYS 43 -27.550 8.518 -24.017 355 HZ2 LYS 43 HZ2 LYS 43 -25.943 8.561 -24.569 356 HZ3 LYS 43 HZ3 LYS 43 -26.649 9.949 -23.886 357 H LEU 44 HN LEU 44 -23.291 3.493 -20.367 358 HA LEU 44 HA LEU 44 -25.791 3.488 -19.029 359 HB2 LEU 44 HB2 LEU 44 -23.922 1.250 -19.824 360 HB3 LEU 44 HB1 LEU 44 -25.497 0.967 -19.091 361 HG LEU 44 HG LEU 44 -25.089 2.585 -21.629 362 HD11 LEU 44 HD11 LEU 44 -24.393 0.315 -22.079 363 HD12 LEU 44 HD12 LEU 44 -26.005 0.532 -22.761 364 HD13 LEU 44 HD13 LEU 44 -25.802 -0.333 -21.238 365 HD21 LEU 44 HD21 LEU 44 -27.197 3.212 -20.830 366 HD22 LEU 44 HD22 LEU 44 -27.483 1.659 -20.047 367 HD23 LEU 44 HD23 LEU 44 -27.623 1.804 -21.796 368 H ALA 45 HN ALA 45 -22.520 2.661 -18.013 369 HA ALA 45 HA ALA 45 -23.132 1.524 -15.516 370 HB1 ALA 45 HB1 ALA 45 -20.674 3.081 -16.347 371 HB2 ALA 45 HB2 ALA 45 -20.918 1.346 -16.555 372 HB3 ALA 45 HB3 ALA 45 -20.795 2.032 -14.935 373 H ASP 46 HN ASP 46 -22.622 4.891 -16.480 374 HA ASP 46 HA ASP 46 -22.498 6.040 -13.922 375 HB2 ASP 46 HB2 ASP 46 -23.458 7.115 -16.576 376 HB3 ASP 46 HB1 ASP 46 -23.336 8.113 -15.130 377 H LYS 47 HN LYS 47 -25.279 5.272 -15.978 378 HA LYS 47 HA LYS 47 -27.534 5.193 -15.550 379 HB2 LYS 47 HB2 LYS 47 -26.525 4.725 -12.735 380 HB3 LYS 47 HB1 LYS 47 -28.174 4.432 -13.285 381 HG2 LYS 47 HG2 LYS 47 -27.319 2.817 -14.958 382 HG3 LYS 47 HG1 LYS 47 -25.681 3.092 -14.365 383 HD2 LYS 47 HD2 LYS 47 -26.334 2.289 -12.136 384 HD3 LYS 47 HD1 LYS 47 -27.983 2.032 -12.703 385 HE2 LYS 47 HE2 LYS 47 -26.756 -0.086 -12.748 386 HE3 LYS 47 HE1 LYS 47 -27.126 0.425 -14.395 387 HZ1 LYS 47 HZ1 LYS 47 -24.826 -0.312 -14.161 388 HZ2 LYS 47 HZ2 LYS 47 -24.549 0.892 -12.994 389 HZ3 LYS 47 HZ3 LYS 47 -24.909 1.325 -14.596 390 H GLN 48 HN GLN 48 -25.924 7.810 -15.040 391 HA GLN 48 HA GLN 48 -27.325 9.235 -13.020 392 HB2 GLN 48 HB2 GLN 48 -25.746 10.160 -15.419 393 HB3 GLN 48 HB1 GLN 48 -26.484 11.280 -14.274 394 HG2 GLN 48 HG2 GLN 48 -25.195 10.387 -12.448 395 HG3 GLN 48 HG1 GLN 48 -24.595 9.063 -13.439 396 HE21 GLN 48 HE21 GLN 48 -22.995 11.178 -12.056 397 HE22 GLN 48 HE22 GLN 48 -22.120 11.964 -13.281 398 H GLU 49 HN GLU 49 -27.885 8.806 -16.481 399 HA GLU 49 HA GLU 49 -29.982 10.689 -16.729 400 HB2 GLU 49 HB2 GLU 49 -29.298 8.211 -18.315 401 HB3 GLU 49 HB1 GLU 49 -30.637 9.278 -18.739 402 HG2 GLU 49 HG2 GLU 49 -29.139 11.156 -19.019 403 HG3 GLU 49 HG1 GLU 49 -27.777 10.228 -18.399 404 H HIS 50 HN HIS 50 -29.958 7.261 -15.851 405 HA HIS 50 HA HIS 50 -32.755 6.859 -15.870 406 HB2 HIS 50 HB2 HIS 50 -30.543 5.520 -14.303 407 HB3 HIS 50 HB1 HIS 50 -32.218 4.972 -14.278 408 HD2 HIS 50 HD2 HIS 50 -31.897 5.961 -17.819 409 HE1 HIS 50 HE1 HIS 50 -30.210 2.094 -17.753 410 HE2 HIS 50 HE2 HIS 50 -31.122 3.927 -19.253 411 H LEU 51 HN LEU 51 -30.538 7.979 -13.343 412 HA LEU 51 HA LEU 51 -32.541 8.098 -11.298 413 HB2 LEU 51 HB2 LEU 51 -29.699 8.959 -11.602 414 HB3 LEU 51 HB1 LEU 51 -30.644 9.818 -10.388 415 HG LEU 51 HG LEU 51 -31.281 7.642 -9.374 416 HD11 LEU 51 HD11 LEU 51 -30.107 5.598 -10.082 417 HD12 LEU 51 HD12 LEU 51 -29.322 6.492 -11.384 418 HD13 LEU 51 HD13 LEU 51 -31.070 6.251 -11.406 419 HD21 LEU 51 HD21 LEU 51 -28.301 8.092 -9.727 420 HD22 LEU 51 HD22 LEU 51 -29.030 7.113 -8.454 421 HD23 LEU 51 HD23 LEU 51 -29.329 8.850 -8.511 422 H ASP 52 HN ASP 52 -31.180 10.424 -13.587 423 HA ASP 52 HA ASP 52 -32.442 12.734 -12.595 424 HB2 ASP 52 HB2 ASP 52 -30.611 12.768 -14.255 425 HB3 ASP 52 HB1 ASP 52 -31.705 12.092 -15.460 426 H GLY 53 HN GLY 53 -33.495 10.376 -15.042 427 HA2 GLY 53 HA2 GLY 53 -35.641 9.787 -15.686 428 HA3 GLY 53 HA1 GLY 53 -36.265 10.865 -14.441 429 H ALA 54 HN ALA 54 -33.983 12.324 -16.519 430 HA ALA 54 HA ALA 54 -36.024 14.052 -17.646 431 HB1 ALA 54 HB1 ALA 54 -33.041 14.036 -18.155 432 HB2 ALA 54 HB2 ALA 54 -33.821 14.909 -16.835 433 HB3 ALA 54 HB3 ALA 54 -34.170 15.345 -18.508 434 H LEU 55 HN LEU 55 -34.852 11.078 -18.488 435 HA LEU 55 HA LEU 55 -34.366 11.292 -21.255 436 HB2 LEU 55 HB2 LEU 55 -35.409 9.004 -19.579 437 HB3 LEU 55 HB1 LEU 55 -34.994 8.844 -21.284 438 HG LEU 55 HG LEU 55 -33.074 9.852 -19.161 439 HD11 LEU 55 HD11 LEU 55 -33.554 7.088 -20.283 440 HD12 LEU 55 HD12 LEU 55 -33.502 7.585 -18.592 441 HD13 LEU 55 HD13 LEU 55 -32.019 7.545 -19.546 442 HD21 LEU 55 HD21 LEU 55 -32.883 9.296 -22.117 443 HD22 LEU 55 HD22 LEU 55 -31.467 8.996 -21.111 444 HD23 LEU 55 HD23 LEU 55 -32.171 10.607 -21.176 445 H ARG 56 HN ARG 56 -37.372 10.819 -19.436 446 HA ARG 56 HA ARG 56 -39.038 10.322 -21.663 447 HB2 ARG 56 HB2 ARG 56 -40.895 10.854 -20.177 448 HB3 ARG 56 HB1 ARG 56 -39.706 9.878 -19.318 449 HG2 ARG 56 HG2 ARG 56 -38.763 11.923 -18.300 450 HG3 ARG 56 HG1 ARG 56 -39.961 12.900 -19.148 451 HD2 ARG 56 HD2 ARG 56 -40.652 10.672 -17.220 452 HD3 ARG 56 HD1 ARG 56 -40.599 12.378 -16.783 453 HE ARG 56 HE ARG 56 -42.273 12.168 -19.004 454 HH11 ARG 56 HH11 ARG 56 -44.525 12.057 -18.732 455 HH12 ARG 56 HH12 ARG 56 -45.184 11.521 -17.222 456 HH21 ARG 56 HH21 ARG 56 -42.088 11.019 -15.745 457 HH22 ARG 56 HH22 ARG 56 -43.804 10.932 -15.532 458 H TYR 57 HN TYR 57 -37.572 13.207 -20.487 459 HA TYR 57 HA TYR 57 -37.698 15.407 -21.144 460 HB2 TYR 57 HB2 TYR 57 -36.995 14.489 -23.283 461 HB3 TYR 57 HB1 TYR 57 -38.661 14.070 -23.685 462 HD1 TYR 57 HD1 TYR 57 -36.411 16.945 -22.908 463 HD2 TYR 57 HD2 TYR 57 -40.119 15.668 -24.663 464 HE1 TYR 57 HE1 TYR 57 -36.757 19.220 -23.834 465 HE2 TYR 57 HE2 TYR 57 -40.464 17.942 -25.589 466 HH TYR 57 HH TYR 57 -37.964 20.359 -25.504
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