NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
643291 | 5j8t | 30064 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 24 H1 GLY 24 2.532 -9.657 16.612 2 H2 GLY 24 H2 GLY 24 1.474 -8.569 16.001 3 H3 GLY 24 H3 GLY 24 1.247 -10.171 15.737 4 HA2 GLY 24 HA2 GLY 24 3.497 -8.572 14.690 5 HA3 GLY 24 HA3 GLY 24 3.265 -10.308 14.426 6 H ALA 25 H ALA 25 2.678 -7.234 13.169 7 HA ALA 25 HA ALA 25 0.191 -7.757 11.754 8 HB1 ALA 25 HB1 ALA 25 0.781 -5.535 12.619 9 HB2 ALA 25 HB2 ALA 25 2.209 -5.480 11.558 10 HB3 ALA 25 HB3 ALA 25 0.576 -5.499 10.860 11 H SER 26 H SER 26 1.429 -9.887 10.914 12 HA SER 26 HA SER 26 3.058 -9.660 8.542 13 HB2 SER 26 HB2 SER 26 2.374 -12.002 8.137 14 HB3 SER 26 HB3 SER 26 2.995 -11.734 9.771 15 HG SER 26 HG SER 26 1.066 -13.011 9.720 16 H GLU 27 H GLU 27 2.464 -9.988 6.344 17 HA GLU 27 HA GLU 27 -0.054 -8.772 5.510 18 HB2 GLU 27 HB2 GLU 27 0.735 -9.180 3.243 19 HB3 GLU 27 HB3 GLU 27 1.918 -8.324 4.230 20 HG2 GLU 27 HG2 GLU 27 3.159 -10.494 4.556 21 HG3 GLU 27 HG3 GLU 27 2.031 -11.266 3.437 22 H GLU 28 H GLU 28 -1.938 -9.746 5.083 23 HA GLU 28 HA GLU 28 -2.079 -12.694 4.616 24 HB2 GLU 28 HB2 GLU 28 -3.739 -11.175 6.665 25 HB3 GLU 28 HB3 GLU 28 -3.994 -12.846 6.142 26 HG2 GLU 28 HG2 GLU 28 -1.587 -13.314 6.896 27 HG3 GLU 28 HG3 GLU 28 -1.655 -11.752 7.724 28 H ASN 29 H ASN 29 -2.168 -11.554 2.443 29 HA ASN 29 HA ASN 29 -3.285 -11.114 0.527 30 HB2 ASN 29 HB2 ASN 29 -5.634 -12.538 1.825 31 HB3 ASN 29 HB3 ASN 29 -5.290 -12.396 0.107 32 HD21 ASN 29 HD21 ASN 29 -4.826 -14.343 2.880 33 HD22 ASN 29 HD22 ASN 29 -3.630 -15.423 2.176 34 H ILE 30 H ILE 30 -3.428 -9.038 2.545 35 HA ILE 30 HA ILE 30 -5.941 -7.674 2.582 36 HB ILE 30 HB ILE 30 -3.085 -6.732 2.944 37 HG12 ILE 30 HG12 ILE 30 -5.325 -7.064 4.990 38 HG13 ILE 30 HG13 ILE 30 -4.178 -8.351 4.624 39 HG21 ILE 30 HG21 ILE 30 -4.053 -4.644 3.942 40 HG22 ILE 30 HG22 ILE 30 -4.384 -4.761 2.230 41 HG23 ILE 30 HG23 ILE 30 -5.662 -5.146 3.410 42 HD11 ILE 30 HD11 ILE 30 -3.563 -7.143 6.660 43 HD12 ILE 30 HD12 ILE 30 -2.312 -7.022 5.419 44 HD13 ILE 30 HD13 ILE 30 -3.387 -5.636 5.747 45 H HIS 31 H HIS 31 -6.877 -6.244 1.316 46 HA HIS 31 HA HIS 31 -5.645 -5.350 -1.233 47 HB2 HIS 31 HB2 HIS 31 -7.696 -6.087 -2.456 48 HB3 HIS 31 HB3 HIS 31 -6.697 -7.400 -1.860 49 HD1 HIS 31 HD1 HIS 31 -7.731 -8.896 0.196 50 HD2 HIS 31 HD2 HIS 31 -10.193 -5.883 -1.467 51 HE1 HIS 31 HE1 HIS 31 -10.119 -9.302 1.106 52 HE2 HIS 31 HE2 HIS 31 -11.607 -7.471 0.072 53 H PHE 32 H PHE 32 -5.698 -3.216 -1.005 54 HA PHE 32 HA PHE 32 -8.066 -1.846 0.207 55 HB2 PHE 32 HB2 PHE 32 -5.281 -0.897 -0.492 56 HB3 PHE 32 HB3 PHE 32 -6.563 0.175 0.030 57 HD1 PHE 32 HD1 PHE 32 -3.863 -1.921 1.147 58 HD2 PHE 32 HD2 PHE 32 -7.686 -0.291 2.310 59 HE1 PHE 32 HE1 PHE 32 -3.302 -2.298 3.538 60 HE2 PHE 32 HE2 PHE 32 -7.113 -0.659 4.698 61 HZ PHE 32 HZ PHE 32 -4.924 -1.659 5.313 62 H SER 33 H SER 33 -9.495 -0.776 -1.023 63 HA SER 33 HA SER 33 -9.536 -0.823 -3.861 64 HB2 SER 33 HB2 SER 33 -10.953 1.121 -1.993 65 HB3 SER 33 HB3 SER 33 -11.434 0.712 -3.649 66 HG SER 33 HG SER 33 -11.998 -1.329 -2.977 67 H SER 34 H SER 34 -8.142 1.536 -1.648 68 HA SER 34 HA SER 34 -6.560 2.802 -3.718 69 HB2 SER 34 HB2 SER 34 -8.627 4.050 -4.099 70 HB3 SER 34 HB3 SER 34 -8.802 4.373 -2.366 71 HG SER 34 HG SER 34 -7.849 6.087 -3.743 72 H CYS 35 H CYS 35 -4.869 4.073 -2.802 73 HA CYS 35 HA CYS 35 -4.021 3.708 -0.121 74 HB2 CYS 35 HB2 CYS 35 -3.350 5.676 -2.304 75 HB3 CYS 35 HB3 CYS 35 -2.750 5.957 -0.676 76 H LYS 36 H LYS 36 -6.459 5.971 -1.324 77 HA LYS 36 HA LYS 36 -6.400 7.823 0.853 78 HB2 LYS 36 HB2 LYS 36 -7.661 7.907 -1.391 79 HB3 LYS 36 HB3 LYS 36 -8.929 6.966 -0.617 80 HG2 LYS 36 HG2 LYS 36 -7.856 9.547 0.601 81 HG3 LYS 36 HG3 LYS 36 -9.001 9.610 -0.719 82 HD2 LYS 36 HD2 LYS 36 -9.591 8.149 1.887 83 HD3 LYS 36 HD3 LYS 36 -9.962 9.841 1.633 84 HE2 LYS 36 HE2 LYS 36 -11.016 7.620 -0.174 85 HE3 LYS 36 HE3 LYS 36 -11.857 8.175 1.274 86 HZ1 LYS 36 HZ1 LYS 36 -11.954 10.406 0.310 87 HZ2 LYS 36 HZ2 LYS 36 -12.677 9.332 -0.678 88 HZ3 LYS 36 HZ3 LYS 36 -11.197 9.907 -1.049 89 H GLU 37 H GLU 37 -7.972 4.653 0.587 90 HA GLU 37 HA GLU 37 -9.209 4.762 3.230 91 HB2 GLU 37 HB2 GLU 37 -9.917 3.361 1.169 92 HB3 GLU 37 HB3 GLU 37 -8.569 2.298 1.562 93 HG2 GLU 37 HG2 GLU 37 -10.516 1.322 2.506 94 HG3 GLU 37 HG3 GLU 37 -9.601 1.965 3.860 95 H ALA 38 H ALA 38 -6.136 3.525 1.905 96 HA ALA 38 HA ALA 38 -5.223 2.163 4.246 97 HB1 ALA 38 HB1 ALA 38 -4.333 1.995 1.871 98 HB2 ALA 38 HB2 ALA 38 -3.527 3.559 2.139 99 HB3 ALA 38 HB3 ALA 38 -3.093 2.155 3.118 100 H TRP 39 H TRP 39 -4.610 5.559 3.143 101 HA TRP 39 HA TRP 39 -3.170 6.399 5.440 102 HB2 TRP 39 HB2 TRP 39 -4.860 7.889 3.406 103 HB3 TRP 39 HB3 TRP 39 -4.013 8.713 4.703 104 HD1 TRP 39 HD1 TRP 39 -1.265 7.160 4.636 105 HE1 TRP 39 HE1 TRP 39 0.409 7.629 2.740 106 HE3 TRP 39 HE3 TRP 39 -4.499 8.945 1.085 107 HZ2 TRP 39 HZ2 TRP 39 0.407 9.013 0.247 108 HZ3 TRP 39 HZ3 TRP 39 -3.625 9.771 -1.094 109 HH2 TRP 39 HH2 TRP 39 -1.175 9.833 -1.520 110 H ALA 40 H ALA 40 -6.719 6.278 4.988 111 HA ALA 40 HA ALA 40 -7.387 7.641 7.409 112 HB1 ALA 40 HB1 ALA 40 -9.575 6.597 7.125 113 HB2 ALA 40 HB2 ALA 40 -8.967 7.166 5.559 114 HB3 ALA 40 HB3 ALA 40 -8.909 5.433 5.964 115 H ASN 41 H ASN 41 -6.052 4.464 6.943 116 HA ASN 41 HA ASN 41 -6.532 3.676 9.784 117 HB2 ASN 41 HB2 ASN 41 -5.651 2.129 7.301 118 HB3 ASN 41 HB3 ASN 41 -5.649 1.455 8.926 119 HD21 ASN 41 HD21 ASN 41 -7.774 2.564 6.285 120 HD22 ASN 41 HD22 ASN 41 -9.211 1.861 7.003 121 H GLY 42 H GLY 42 -4.315 5.542 8.254 122 HA2 GLY 42 HA2 GLY 42 -2.267 6.307 8.982 123 HA3 GLY 42 HA3 GLY 42 -2.221 5.058 10.227 124 H TYR 43 H TYR 43 -2.737 3.804 7.027 125 HA TYR 43 HA TYR 43 -0.078 2.538 7.022 126 HB2 TYR 43 HB2 TYR 43 -2.512 2.312 5.245 127 HB3 TYR 43 HB3 TYR 43 -0.976 1.594 4.831 128 HD1 TYR 43 HD1 TYR 43 -1.663 -0.638 4.714 129 HD2 TYR 43 HD2 TYR 43 -2.438 1.597 8.331 130 HE1 TYR 43 HE1 TYR 43 -2.364 -2.728 5.887 131 HE2 TYR 43 HE2 TYR 43 -3.092 -0.479 9.480 132 HH TYR 43 HH TYR 43 -3.373 -2.750 9.312 133 H SER 44 H SER 44 1.440 4.081 6.657 134 HA SER 44 HA SER 44 1.592 5.241 3.929 135 HB2 SER 44 HB2 SER 44 2.520 7.329 4.867 136 HB3 SER 44 HB3 SER 44 0.844 7.068 5.370 137 HG SER 44 HG SER 44 2.152 7.716 7.133 138 H ASP 45 H ASP 45 3.770 5.809 3.288 139 HA ASP 45 HA ASP 45 5.858 5.061 2.755 140 HB2 ASP 45 HB2 ASP 45 6.326 6.624 4.595 141 HB3 ASP 45 HB3 ASP 45 6.266 5.298 5.754 142 H ILE 46 H ILE 46 4.126 2.981 2.673 143 HA ILE 46 HA ILE 46 4.830 0.657 4.188 144 HB ILE 46 HB ILE 46 3.589 0.968 1.455 145 HG12 ILE 46 HG12 ILE 46 2.187 0.305 4.071 146 HG13 ILE 46 HG13 ILE 46 2.290 1.944 3.440 147 HG21 ILE 46 HG21 ILE 46 3.825 -1.243 1.191 148 HG22 ILE 46 HG22 ILE 46 4.452 -1.466 2.823 149 HG23 ILE 46 HG23 ILE 46 2.729 -1.514 2.555 150 HD11 ILE 46 HD11 ILE 46 0.161 0.530 2.921 151 HD12 ILE 46 HD12 ILE 46 0.874 1.524 1.638 152 HD13 ILE 46 HD13 ILE 46 1.144 -0.222 1.649 153 H HIS 47 H HIS 47 6.560 -0.587 4.113 154 HA HIS 47 HA HIS 47 8.505 -0.505 1.837 155 HB2 HIS 47 HB2 HIS 47 8.711 -1.353 4.759 156 HB3 HIS 47 HB3 HIS 47 9.968 -1.695 3.587 157 HD1 HIS 47 HD1 HIS 47 11.128 -0.078 5.729 158 HD2 HIS 47 HD2 HIS 47 8.924 1.674 2.579 159 HE1 HIS 47 HE1 HIS 47 11.859 2.388 5.607 160 HE2 HIS 47 HE2 HIS 47 10.469 3.455 3.711 161 H GLU 48 H GLU 48 9.674 -2.640 1.509 162 HA GLU 48 HA GLU 48 7.994 -4.644 0.481 163 HB2 GLU 48 HB2 GLU 48 10.051 -6.089 0.549 164 HB3 GLU 48 HB3 GLU 48 10.212 -4.542 -0.284 165 HG2 GLU 48 HG2 GLU 48 11.415 -3.562 1.579 166 HG3 GLU 48 HG3 GLU 48 11.126 -4.987 2.580 167 H GLY 49 H GLY 49 7.027 -6.441 1.184 168 HA2 GLY 49 HA2 GLY 49 6.454 -8.211 2.578 169 HA3 GLY 49 HA3 GLY 49 7.519 -7.599 3.841 170 H GLU 50 H GLU 50 5.825 -4.878 3.245 171 HA GLU 50 HA GLU 50 3.628 -5.510 5.156 172 HB2 GLU 50 HB2 GLU 50 4.976 -3.003 4.207 173 HB3 GLU 50 HB3 GLU 50 3.303 -2.888 4.712 174 HG2 GLU 50 HG2 GLU 50 4.857 -4.385 6.680 175 HG3 GLU 50 HG3 GLU 50 5.650 -2.861 6.293 176 HA PRO 51 HA PRO 51 0.534 -5.824 2.070 177 HB2 PRO 51 HB2 PRO 51 -1.674 -4.716 3.261 178 HB3 PRO 51 HB3 PRO 51 -0.943 -6.281 3.754 179 HG2 PRO 51 HG2 PRO 51 -0.457 -3.539 4.971 180 HG3 PRO 51 HG3 PRO 51 -0.906 -5.049 5.831 181 HD2 PRO 51 HD2 PRO 51 1.650 -4.254 5.665 182 HD3 PRO 51 HD3 PRO 51 1.248 -5.986 5.453 183 H GLY 52 H GLY 52 0.352 -4.750 0.243 184 HA2 GLY 52 HA2 GLY 52 -0.583 -2.988 -1.067 185 HA3 GLY 52 HA3 GLY 52 -0.229 -1.818 0.206 186 H TYR 53 H TYR 53 2.607 -3.465 0.148 187 HA TYR 53 HA TYR 53 4.145 -1.598 -1.291 188 HB2 TYR 53 HB2 TYR 53 5.114 -3.083 0.317 189 HB3 TYR 53 HB3 TYR 53 4.542 -4.509 -0.528 190 HD1 TYR 53 HD1 TYR 53 6.999 -1.714 -0.676 191 HD2 TYR 53 HD2 TYR 53 5.761 -5.502 -2.340 192 HE1 TYR 53 HE1 TYR 53 9.226 -1.973 -1.817 193 HE2 TYR 53 HE2 TYR 53 7.959 -5.738 -3.479 194 HH TYR 53 HH TYR 53 10.016 -4.803 -3.860 195 H SER 54 H SER 54 2.318 -4.302 -2.505 196 HA SER 54 HA SER 54 3.698 -4.777 -4.963 197 HB2 SER 54 HB2 SER 54 1.879 -6.190 -3.618 198 HB3 SER 54 HB3 SER 54 0.745 -5.317 -4.645 199 HG SER 54 HG SER 54 2.816 -7.106 -5.376 200 H ALA 55 H ALA 55 2.916 -4.474 -7.114 201 HA ALA 55 HA ALA 55 2.192 -1.851 -7.933 202 HB1 ALA 55 HB1 ALA 55 1.784 -4.476 -9.435 203 HB2 ALA 55 HB2 ALA 55 1.950 -2.854 -10.140 204 HB3 ALA 55 HB3 ALA 55 3.329 -3.615 -9.326 205 H LYS 56 H LYS 56 0.159 -4.453 -6.870 206 HA LYS 56 HA LYS 56 -2.388 -3.720 -7.929 207 HB2 LYS 56 HB2 LYS 56 -1.721 -5.063 -5.272 208 HB3 LYS 56 HB3 LYS 56 -3.269 -5.131 -6.098 209 HG2 LYS 56 HG2 LYS 56 -0.642 -6.323 -7.108 210 HG3 LYS 56 HG3 LYS 56 -1.954 -7.216 -6.366 211 HD2 LYS 56 HD2 LYS 56 -2.247 -5.662 -8.976 212 HD3 LYS 56 HD3 LYS 56 -1.827 -7.370 -8.883 213 HE2 LYS 56 HE2 LYS 56 -3.901 -7.962 -7.845 214 HE3 LYS 56 HE3 LYS 56 -4.335 -6.271 -7.557 215 HZ1 LYS 56 HZ1 LYS 56 -5.488 -7.209 -9.502 216 HZ2 LYS 56 HZ2 LYS 56 -4.069 -7.486 -10.255 217 HZ3 LYS 56 HZ3 LYS 56 -4.547 -5.955 -9.940 218 H LEU 57 H LEU 57 -0.550 -2.095 -5.526 219 HA LEU 57 HA LEU 57 -2.919 -0.436 -4.709 220 HB2 LEU 57 HB2 LEU 57 -0.774 -1.761 -3.225 221 HB3 LEU 57 HB3 LEU 57 -0.669 -0.036 -2.977 222 HG LEU 57 HG LEU 57 -1.900 -0.992 -1.213 223 HD11 LEU 57 HD11 LEU 57 -2.664 1.231 -2.293 224 HD12 LEU 57 HD12 LEU 57 -3.719 0.454 -1.126 225 HD13 LEU 57 HD13 LEU 57 -4.077 0.313 -2.863 226 HD21 LEU 57 HD21 LEU 57 -3.855 -2.340 -1.440 227 HD22 LEU 57 HD22 LEU 57 -2.621 -3.039 -2.495 228 HD23 LEU 57 HD23 LEU 57 -3.935 -2.063 -3.194 229 H ASP 58 H ASP 58 0.582 -0.314 -5.454 230 HA ASP 58 HA ASP 58 0.465 2.628 -5.767 231 HB2 ASP 58 HB2 ASP 58 2.191 1.547 -4.372 232 HB3 ASP 58 HB3 ASP 58 2.823 0.710 -5.790 233 H ARG 59 H ARG 59 -0.498 3.078 -7.683 234 HA ARG 59 HA ARG 59 -0.470 1.664 -10.073 235 HB2 ARG 59 HB2 ARG 59 -1.334 3.658 -11.125 236 HB3 ARG 59 HB3 ARG 59 -2.008 3.510 -9.504 237 HG2 ARG 59 HG2 ARG 59 -0.273 5.212 -8.712 238 HG3 ARG 59 HG3 ARG 59 0.235 5.385 -10.395 239 HD2 ARG 59 HD2 ARG 59 -1.201 7.188 -9.962 240 HD3 ARG 59 HD3 ARG 59 -2.116 6.065 -10.982 241 HE ARG 59 HE ARG 59 -2.706 5.441 -8.275 242 HH11 ARG 59 HH11 ARG 59 -3.268 8.143 -10.430 243 HH12 ARG 59 HH12 ARG 59 -4.674 8.676 -9.547 244 HH21 ARG 59 HH21 ARG 59 -4.511 6.169 -7.196 245 HH22 ARG 59 HH22 ARG 59 -5.353 7.579 -7.767 246 H ASP 60 H ASP 60 1.975 3.937 -9.043 247 HA ASP 60 HA ASP 60 3.447 3.865 -11.585 248 HB2 ASP 60 HB2 ASP 60 4.944 5.465 -10.381 249 HB3 ASP 60 HB3 ASP 60 3.271 5.974 -10.520 250 H HIS 61 H HIS 61 3.294 1.773 -9.022 251 HA HIS 61 HA HIS 61 4.686 0.460 -7.838 252 HB2 HIS 61 HB2 HIS 61 3.785 -0.775 -9.786 253 HB3 HIS 61 HB3 HIS 61 5.279 -0.462 -10.664 254 HD1 HIS 61 HD1 HIS 61 4.992 -1.735 -6.967 255 HD2 HIS 61 HD2 HIS 61 6.319 -2.853 -10.820 256 HE1 HIS 61 HE1 HIS 61 6.240 -3.968 -6.687 257 HE2 HIS 61 HE2 HIS 61 7.028 -4.652 -9.042 258 H ASP 62 H ASP 62 6.015 2.535 -7.394 259 HA ASP 62 HA ASP 62 8.825 2.268 -8.332 260 HB2 ASP 62 HB2 ASP 62 9.211 4.464 -7.596 261 HB3 ASP 62 HB3 ASP 62 7.707 4.446 -8.502 262 H GLY 63 H GLY 63 7.541 0.440 -6.240 263 HA2 GLY 63 HA2 GLY 63 8.452 -0.855 -4.571 264 HA3 GLY 63 HA3 GLY 63 9.933 0.103 -4.651 265 H VAL 64 H VAL 64 7.000 1.830 -4.070 266 HA VAL 64 HA VAL 64 7.067 1.669 -1.117 267 HB VAL 64 HB VAL 64 6.969 4.375 -2.516 268 HG11 VAL 64 HG11 VAL 64 7.500 5.212 -0.221 269 HG12 VAL 64 HG12 VAL 64 5.978 4.334 -0.269 270 HG13 VAL 64 HG13 VAL 64 7.431 3.545 0.385 271 HG21 VAL 64 HG21 VAL 64 9.254 4.849 -1.724 272 HG22 VAL 64 HG22 VAL 64 9.436 3.150 -1.226 273 HG23 VAL 64 HG23 VAL 64 9.238 3.581 -2.943 274 H ALA 65 H ALA 65 4.942 2.256 -0.252 275 HA ALA 65 HA ALA 65 2.878 2.954 -2.291 276 HB1 ALA 65 HB1 ALA 65 1.438 1.209 -1.719 277 HB2 ALA 65 HB2 ALA 65 3.039 0.434 -1.811 278 HB3 ALA 65 HB3 ALA 65 2.316 0.806 -0.245 279 H CYS 66 H CYS 66 1.224 4.157 -1.648 280 HA CYS 66 HA CYS 66 0.408 6.013 -0.678 281 HB2 CYS 66 HB2 CYS 66 0.296 4.416 1.870 282 HB3 CYS 66 HB3 CYS 66 -0.846 5.603 1.256 283 H GLU 67 H GLU 67 3.008 6.394 -0.980 284 HA GLU 67 HA GLU 67 4.592 6.999 1.278 285 HB2 GLU 67 HB2 GLU 67 6.007 8.245 -0.300 286 HB3 GLU 67 HB3 GLU 67 5.546 6.651 -0.874 287 HG2 GLU 67 HG2 GLU 67 3.575 8.438 -1.927 288 HG3 GLU 67 HG3 GLU 67 5.124 9.249 -2.107 289 H LEU 68 H LEU 68 4.977 8.736 2.516 290 HA LEU 68 HA LEU 68 3.436 11.247 2.134 291 HB2 LEU 68 HB2 LEU 68 2.371 9.311 3.575 292 HB3 LEU 68 HB3 LEU 68 3.435 9.886 4.843 293 HG LEU 68 HG LEU 68 1.580 11.781 3.316 294 HD11 LEU 68 HD11 LEU 68 0.870 10.014 5.682 295 HD12 LEU 68 HD12 LEU 68 0.173 9.980 4.045 296 HD13 LEU 68 HD13 LEU 68 -0.126 11.368 5.086 297 HD21 LEU 68 HD21 LEU 68 3.116 12.913 4.829 298 HD22 LEU 68 HD22 LEU 68 2.671 11.813 6.160 299 HD23 LEU 68 HD23 LEU 68 1.491 12.970 5.504 300 H LYS 69 H LYS 69 6.037 10.837 1.553 301 HA LYS 69 HA LYS 69 7.740 11.982 3.709 302 HB2 LYS 69 HB2 LYS 69 8.553 10.964 0.958 303 HB3 LYS 69 HB3 LYS 69 9.635 11.421 2.263 304 HG2 LYS 69 HG2 LYS 69 7.750 9.045 2.144 305 HG3 LYS 69 HG3 LYS 69 9.500 9.009 2.102 306 HD2 LYS 69 HD2 LYS 69 7.851 9.833 4.549 307 HD3 LYS 69 HD3 LYS 69 8.471 8.232 4.217 308 HE2 LYS 69 HE2 LYS 69 10.046 9.010 5.675 309 HE3 LYS 69 HE3 LYS 69 10.822 9.258 4.115 310 HZ1 LYS 69 HZ1 LYS 69 9.439 11.366 5.710 311 HZ2 LYS 69 HZ2 LYS 69 10.211 11.626 4.283 312 HZ3 LYS 69 HZ3 LYS 69 11.050 11.178 5.600 313 H ASN 70 H ASN 70 6.281 13.830 3.513 314 HA ASN 70 HA ASN 70 5.786 15.992 3.025 315 HB2 ASN 70 HB2 ASN 70 8.646 16.228 2.014 316 HB3 ASN 70 HB3 ASN 70 7.641 17.505 2.679 317 HD21 ASN 70 HD21 ASN 70 7.063 17.309 5.044 318 HD22 ASN 70 HD22 ASN 70 8.239 16.515 6.084 Start of MODEL 2 1 H1 GLY 24 H1 GLY 24 5.868 -20.638 10.593 2 H2 GLY 24 H2 GLY 24 5.464 -20.189 9.071 3 H3 GLY 24 H3 GLY 24 5.002 -19.272 10.342 4 HA2 GLY 24 HA2 GLY 24 4.074 -22.018 9.809 5 HA3 GLY 24 HA3 GLY 24 3.555 -21.002 11.167 6 H ALA 25 H ALA 25 1.487 -21.827 9.877 7 HA ALA 25 HA ALA 25 0.710 -20.523 7.463 8 HB1 ALA 25 HB1 ALA 25 -0.970 -21.732 9.703 9 HB2 ALA 25 HB2 ALA 25 -1.534 -21.359 8.058 10 HB3 ALA 25 HB3 ALA 25 -0.293 -22.603 8.306 11 H SER 26 H SER 26 -0.192 -18.619 7.009 12 HA SER 26 HA SER 26 -1.381 -16.804 9.023 13 HB2 SER 26 HB2 SER 26 1.065 -16.083 7.345 14 HB3 SER 26 HB3 SER 26 0.096 -14.923 8.264 15 HG SER 26 HG SER 26 0.645 -16.088 10.177 16 H GLU 27 H GLU 27 -2.134 -14.732 7.885 17 HA GLU 27 HA GLU 27 -3.086 -15.215 5.108 18 HB2 GLU 27 HB2 GLU 27 -5.383 -14.596 5.798 19 HB3 GLU 27 HB3 GLU 27 -4.807 -16.152 6.379 20 HG2 GLU 27 HG2 GLU 27 -4.462 -15.290 8.626 21 HG3 GLU 27 HG3 GLU 27 -4.806 -13.642 8.098 22 H GLU 28 H GLU 28 -1.136 -13.650 5.223 23 HA GLU 28 HA GLU 28 -1.625 -10.851 5.696 24 HB2 GLU 28 HB2 GLU 28 0.574 -10.555 4.681 25 HB3 GLU 28 HB3 GLU 28 0.564 -11.864 5.852 26 HG2 GLU 28 HG2 GLU 28 0.346 -13.502 3.897 27 HG3 GLU 28 HG3 GLU 28 0.600 -12.133 2.816 28 H ASN 29 H ASN 29 -3.449 -12.324 3.708 29 HA ASN 29 HA ASN 29 -2.994 -11.221 1.077 30 HB2 ASN 29 HB2 ASN 29 -5.017 -12.448 0.492 31 HB3 ASN 29 HB3 ASN 29 -3.923 -13.448 1.428 32 HD21 ASN 29 HD21 ASN 29 -6.139 -14.637 1.441 33 HD22 ASN 29 HD22 ASN 29 -7.131 -14.298 2.853 34 H ILE 30 H ILE 30 -3.182 -9.061 2.882 35 HA ILE 30 HA ILE 30 -5.709 -7.709 2.920 36 HB ILE 30 HB ILE 30 -2.842 -6.735 3.081 37 HG12 ILE 30 HG12 ILE 30 -5.004 -6.884 5.230 38 HG13 ILE 30 HG13 ILE 30 -3.874 -8.201 4.932 39 HG21 ILE 30 HG21 ILE 30 -3.791 -4.564 3.948 40 HG22 ILE 30 HG22 ILE 30 -4.133 -4.823 2.252 41 HG23 ILE 30 HG23 ILE 30 -5.402 -5.109 3.470 42 HD11 ILE 30 HD11 ILE 30 -3.079 -5.408 5.850 43 HD12 ILE 30 HD12 ILE 30 -3.148 -6.885 6.828 44 HD13 ILE 30 HD13 ILE 30 -1.971 -6.768 5.515 45 H HIS 31 H HIS 31 -6.755 -6.452 1.556 46 HA HIS 31 HA HIS 31 -5.525 -5.525 -0.991 47 HB2 HIS 31 HB2 HIS 31 -8.214 -6.949 -0.749 48 HB3 HIS 31 HB3 HIS 31 -7.637 -6.128 -2.190 49 HD1 HIS 31 HD1 HIS 31 -4.951 -7.277 -2.891 50 HD2 HIS 31 HD2 HIS 31 -8.022 -9.501 -1.037 51 HE1 HIS 31 HE1 HIS 31 -4.492 -9.755 -3.445 52 HE2 HIS 31 HE2 HIS 31 -6.371 -11.101 -2.306 53 H PHE 32 H PHE 32 -5.601 -3.380 -0.817 54 HA PHE 32 HA PHE 32 -7.984 -1.976 0.333 55 HB2 PHE 32 HB2 PHE 32 -5.208 -1.030 -0.432 56 HB3 PHE 32 HB3 PHE 32 -6.497 0.046 0.060 57 HD1 PHE 32 HD1 PHE 32 -7.566 -0.351 2.396 58 HD2 PHE 32 HD2 PHE 32 -3.714 -1.889 1.198 59 HE1 PHE 32 HE1 PHE 32 -6.899 -0.553 4.782 60 HE2 PHE 32 HE2 PHE 32 -3.063 -2.111 3.588 61 HZ PHE 32 HZ PHE 32 -4.653 -1.427 5.377 62 H SER 33 H SER 33 -9.352 -0.819 -0.967 63 HA SER 33 HA SER 33 -9.227 -0.990 -3.848 64 HB2 SER 33 HB2 SER 33 -10.887 0.815 -2.047 65 HB3 SER 33 HB3 SER 33 -11.170 0.539 -3.774 66 HG SER 33 HG SER 33 -11.597 -1.637 -3.335 67 H SER 34 H SER 34 -8.016 1.401 -1.557 68 HA SER 34 HA SER 34 -6.441 2.750 -3.598 69 HB2 SER 34 HB2 SER 34 -8.616 3.909 -3.915 70 HB3 SER 34 HB3 SER 34 -8.688 4.254 -2.181 71 HG SER 34 HG SER 34 -6.922 5.298 -4.140 72 H CYS 35 H CYS 35 -4.808 4.083 -2.675 73 HA CYS 35 HA CYS 35 -4.000 3.807 0.038 74 HB2 CYS 35 HB2 CYS 35 -3.352 5.779 -2.153 75 HB3 CYS 35 HB3 CYS 35 -2.764 6.045 -0.517 76 H LYS 36 H LYS 36 -6.485 5.928 -1.301 77 HA LYS 36 HA LYS 36 -6.652 7.867 0.804 78 HB2 LYS 36 HB2 LYS 36 -8.723 6.632 -1.042 79 HB3 LYS 36 HB3 LYS 36 -9.121 7.903 0.120 80 HG2 LYS 36 HG2 LYS 36 -7.563 9.453 -0.870 81 HG3 LYS 36 HG3 LYS 36 -6.922 8.234 -1.974 82 HD2 LYS 36 HD2 LYS 36 -9.846 9.096 -2.001 83 HD3 LYS 36 HD3 LYS 36 -8.589 9.915 -2.943 84 HE2 LYS 36 HE2 LYS 36 -8.018 7.825 -4.098 85 HE3 LYS 36 HE3 LYS 36 -9.204 6.936 -3.148 86 HZ1 LYS 36 HZ1 LYS 36 -10.094 7.548 -5.318 87 HZ2 LYS 36 HZ2 LYS 36 -9.850 9.131 -5.040 88 HZ3 LYS 36 HZ3 LYS 36 -10.948 8.308 -4.161 89 H GLU 37 H GLU 37 -7.940 4.561 0.682 90 HA GLU 37 HA GLU 37 -9.216 4.770 3.322 91 HB2 GLU 37 HB2 GLU 37 -10.090 3.375 1.471 92 HB3 GLU 37 HB3 GLU 37 -8.642 2.362 1.545 93 HG2 GLU 37 HG2 GLU 37 -9.226 1.594 3.779 94 HG3 GLU 37 HG3 GLU 37 -10.518 2.795 3.904 95 H ALA 38 H ALA 38 -6.127 3.552 2.025 96 HA ALA 38 HA ALA 38 -5.185 2.304 4.421 97 HB1 ALA 38 HB1 ALA 38 -3.545 3.603 2.212 98 HB2 ALA 38 HB2 ALA 38 -3.058 2.275 3.272 99 HB3 ALA 38 HB3 ALA 38 -4.317 2.004 2.067 100 H TRP 39 H TRP 39 -4.608 5.659 3.162 101 HA TRP 39 HA TRP 39 -3.126 6.629 5.371 102 HB2 TRP 39 HB2 TRP 39 -4.945 8.011 3.371 103 HB3 TRP 39 HB3 TRP 39 -4.063 8.894 4.598 104 HD1 TRP 39 HD1 TRP 39 -1.245 7.591 4.467 105 HE1 TRP 39 HE1 TRP 39 0.289 7.979 2.451 106 HE3 TRP 39 HE3 TRP 39 -4.760 8.923 0.990 107 HZ2 TRP 39 HZ2 TRP 39 0.056 8.900 -0.254 108 HZ3 TRP 39 HZ3 TRP 39 -4.070 9.523 -1.328 109 HH2 TRP 39 HH2 TRP 39 -1.665 9.520 -1.956 110 H ALA 40 H ALA 40 -6.689 6.421 5.028 111 HA ALA 40 HA ALA 40 -7.325 7.868 7.411 112 HB1 ALA 40 HB1 ALA 40 -9.515 6.797 7.196 113 HB2 ALA 40 HB2 ALA 40 -8.937 7.340 5.607 114 HB3 ALA 40 HB3 ALA 40 -8.858 5.615 6.045 115 H ASN 41 H ASN 41 -6.046 4.649 7.007 116 HA ASN 41 HA ASN 41 -6.463 3.942 9.874 117 HB2 ASN 41 HB2 ASN 41 -5.575 2.363 7.415 118 HB3 ASN 41 HB3 ASN 41 -5.512 1.723 9.052 119 HD21 ASN 41 HD21 ASN 41 -7.733 2.699 6.439 120 HD22 ASN 41 HD22 ASN 41 -9.128 1.964 7.208 121 H GLY 42 H GLY 42 -4.313 5.831 8.297 122 HA2 GLY 42 HA2 GLY 42 -2.304 6.694 9.017 123 HA3 GLY 42 HA3 GLY 42 -2.187 5.446 10.257 124 H TYR 43 H TYR 43 -2.700 3.974 7.211 125 HA TYR 43 HA TYR 43 -0.003 2.869 7.161 126 HB2 TYR 43 HB2 TYR 43 -2.408 2.593 5.355 127 HB3 TYR 43 HB3 TYR 43 -0.850 1.924 4.941 128 HD1 TYR 43 HD1 TYR 43 -2.227 1.841 8.465 129 HD2 TYR 43 HD2 TYR 43 -1.552 -0.318 4.779 130 HE1 TYR 43 HE1 TYR 43 -2.771 -0.272 9.607 131 HE2 TYR 43 HE2 TYR 43 -2.135 -2.444 5.948 132 HH TYR 43 HH TYR 43 -3.043 -2.541 9.404 133 H SER 44 H SER 44 1.647 4.057 6.545 134 HA SER 44 HA SER 44 1.683 5.487 3.967 135 HB2 SER 44 HB2 SER 44 2.683 7.495 5.062 136 HB3 SER 44 HB3 SER 44 0.964 7.273 5.409 137 HG SER 44 HG SER 44 1.532 6.426 7.447 138 H ASP 45 H ASP 45 3.851 6.133 3.350 139 HA ASP 45 HA ASP 45 5.946 5.473 2.767 140 HB2 ASP 45 HB2 ASP 45 6.392 5.491 5.770 141 HB3 ASP 45 HB3 ASP 45 7.638 5.624 4.530 142 H ILE 46 H ILE 46 4.190 3.308 2.731 143 HA ILE 46 HA ILE 46 4.989 0.938 4.066 144 HB ILE 46 HB ILE 46 3.793 1.311 1.319 145 HG12 ILE 46 HG12 ILE 46 2.253 0.647 3.856 146 HG13 ILE 46 HG13 ILE 46 2.417 2.289 3.250 147 HG21 ILE 46 HG21 ILE 46 4.736 -1.128 2.270 148 HG22 ILE 46 HG22 ILE 46 3.057 -1.187 2.747 149 HG23 ILE 46 HG23 ILE 46 3.486 -0.913 1.058 150 HD11 ILE 46 HD11 ILE 46 1.260 0.065 1.518 151 HD12 ILE 46 HD12 ILE 46 0.283 1.119 2.560 152 HD13 ILE 46 HD13 ILE 46 1.232 1.802 1.231 153 H HIS 47 H HIS 47 6.738 -0.291 3.899 154 HA HIS 47 HA HIS 47 8.568 -0.125 1.526 155 HB2 HIS 47 HB2 HIS 47 9.000 -1.016 4.412 156 HB3 HIS 47 HB3 HIS 47 10.203 -1.221 3.149 157 HD1 HIS 47 HD1 HIS 47 10.633 0.633 5.759 158 HD2 HIS 47 HD2 HIS 47 9.692 1.815 1.815 159 HE1 HIS 47 HE1 HIS 47 11.534 3.031 5.481 160 HE2 HIS 47 HE2 HIS 47 10.947 3.743 3.076 161 H GLU 48 H GLU 48 9.788 -2.234 1.155 162 HA GLU 48 HA GLU 48 8.120 -4.260 0.181 163 HB2 GLU 48 HB2 GLU 48 10.191 -5.681 0.194 164 HB3 GLU 48 HB3 GLU 48 10.346 -4.123 -0.613 165 HG2 GLU 48 HG2 GLU 48 11.534 -3.166 1.278 166 HG3 GLU 48 HG3 GLU 48 11.307 -4.637 2.228 167 H GLY 49 H GLY 49 7.178 -6.052 0.884 168 HA2 GLY 49 HA2 GLY 49 6.660 -7.846 2.291 169 HA3 GLY 49 HA3 GLY 49 7.668 -7.171 3.569 170 H GLU 50 H GLU 50 6.082 -4.459 3.139 171 HA GLU 50 HA GLU 50 3.864 -5.102 4.973 172 HB2 GLU 50 HB2 GLU 50 5.030 -2.558 3.851 173 HB3 GLU 50 HB3 GLU 50 3.389 -2.548 4.484 174 HG2 GLU 50 HG2 GLU 50 4.274 -3.530 6.603 175 HG3 GLU 50 HG3 GLU 50 5.910 -3.282 5.955 176 HA PRO 51 HA PRO 51 0.626 -5.511 2.002 177 HB2 PRO 51 HB2 PRO 51 -1.520 -4.335 3.232 178 HB3 PRO 51 HB3 PRO 51 -0.794 -5.890 3.754 179 HG2 PRO 51 HG2 PRO 51 -0.227 -3.121 4.867 180 HG3 PRO 51 HG3 PRO 51 -0.673 -4.597 5.784 181 HD2 PRO 51 HD2 PRO 51 1.891 -3.859 5.520 182 HD3 PRO 51 HD3 PRO 51 1.449 -5.584 5.368 183 H GLY 52 H GLY 52 0.393 -4.479 0.152 184 HA2 GLY 52 HA2 GLY 52 -0.540 -2.763 -1.191 185 HA3 GLY 52 HA3 GLY 52 -0.196 -1.558 0.047 186 H TYR 53 H TYR 53 2.673 -3.191 -0.042 187 HA TYR 53 HA TYR 53 4.154 -1.346 -1.594 188 HB2 TYR 53 HB2 TYR 53 5.158 -2.738 0.095 189 HB3 TYR 53 HB3 TYR 53 4.626 -4.211 -0.696 190 HD1 TYR 53 HD1 TYR 53 5.853 -5.221 -2.496 191 HD2 TYR 53 HD2 TYR 53 7.040 -1.385 -0.910 192 HE1 TYR 53 HE1 TYR 53 8.038 -5.425 -3.664 193 HE2 TYR 53 HE2 TYR 53 9.256 -1.621 -2.057 194 HH TYR 53 HH TYR 53 10.082 -4.466 -4.060 195 H SER 54 H SER 54 2.298 -4.105 -2.621 196 HA SER 54 HA SER 54 3.618 -4.720 -5.110 197 HB2 SER 54 HB2 SER 54 0.881 -5.330 -3.934 198 HB3 SER 54 HB3 SER 54 1.323 -5.844 -5.559 199 HG SER 54 HG SER 54 2.747 -6.485 -3.162 200 H ALA 55 H ALA 55 2.914 -4.412 -7.222 201 HA ALA 55 HA ALA 55 2.045 -1.902 -8.119 202 HB1 ALA 55 HB1 ALA 55 1.811 -4.620 -9.486 203 HB2 ALA 55 HB2 ALA 55 1.801 -3.039 -10.289 204 HB3 ALA 55 HB3 ALA 55 3.260 -3.598 -9.459 205 H LYS 56 H LYS 56 0.051 -4.533 -6.961 206 HA LYS 56 HA LYS 56 -2.489 -3.850 -8.056 207 HB2 LYS 56 HB2 LYS 56 -1.937 -5.037 -5.300 208 HB3 LYS 56 HB3 LYS 56 -3.443 -5.101 -6.218 209 HG2 LYS 56 HG2 LYS 56 -2.028 -6.319 -8.054 210 HG3 LYS 56 HG3 LYS 56 -0.837 -6.554 -6.754 211 HD2 LYS 56 HD2 LYS 56 -2.599 -7.697 -5.383 212 HD3 LYS 56 HD3 LYS 56 -3.768 -7.406 -6.676 213 HE2 LYS 56 HE2 LYS 56 -3.136 -9.641 -6.970 214 HE3 LYS 56 HE3 LYS 56 -2.294 -8.749 -8.238 215 HZ1 LYS 56 HZ1 LYS 56 -0.273 -8.845 -6.850 216 HZ2 LYS 56 HZ2 LYS 56 -0.835 -10.351 -7.131 217 HZ3 LYS 56 HZ3 LYS 56 -1.076 -9.658 -5.675 218 H LEU 57 H LEU 57 -0.662 -2.208 -5.568 219 HA LEU 57 HA LEU 57 -2.987 -0.413 -4.954 220 HB2 LEU 57 HB2 LEU 57 -0.827 -1.671 -3.363 221 HB3 LEU 57 HB3 LEU 57 -0.846 0.062 -3.158 222 HG LEU 57 HG LEU 57 -2.096 -0.982 -1.424 223 HD11 LEU 57 HD11 LEU 57 -2.842 1.237 -2.486 224 HD12 LEU 57 HD12 LEU 57 -3.992 0.416 -1.444 225 HD13 LEU 57 HD13 LEU 57 -4.183 0.315 -3.205 226 HD21 LEU 57 HD21 LEU 57 -4.026 -2.367 -1.774 227 HD22 LEU 57 HD22 LEU 57 -2.704 -3.034 -2.747 228 HD23 LEU 57 HD23 LEU 57 -3.994 -2.090 -3.525 229 H ASP 58 H ASP 58 0.516 -0.504 -5.613 230 HA ASP 58 HA ASP 58 0.596 2.418 -5.927 231 HB2 ASP 58 HB2 ASP 58 2.184 1.101 -4.524 232 HB3 ASP 58 HB3 ASP 58 2.842 0.364 -5.985 233 H ARG 59 H ARG 59 -0.443 2.831 -7.866 234 HA ARG 59 HA ARG 59 -0.266 1.596 -10.330 235 HB2 ARG 59 HB2 ARG 59 -1.064 3.669 -11.314 236 HB3 ARG 59 HB3 ARG 59 -1.825 3.388 -9.760 237 HG2 ARG 59 HG2 ARG 59 -1.396 5.630 -9.556 238 HG3 ARG 59 HG3 ARG 59 0.062 4.993 -8.825 239 HD2 ARG 59 HD2 ARG 59 0.905 6.643 -10.207 240 HD3 ARG 59 HD3 ARG 59 1.094 5.228 -11.241 241 HE ARG 59 HE ARG 59 -1.436 6.677 -11.586 242 HH11 ARG 59 HH11 ARG 59 1.866 6.455 -12.762 243 HH12 ARG 59 HH12 ARG 59 1.503 7.369 -14.200 244 HH21 ARG 59 HH21 ARG 59 -1.807 7.864 -13.424 245 HH22 ARG 59 HH22 ARG 59 -0.515 8.147 -14.554 246 H ASP 60 H ASP 60 2.157 3.705 -9.015 247 HA ASP 60 HA ASP 60 3.746 3.779 -11.506 248 HB2 ASP 60 HB2 ASP 60 5.184 5.327 -10.194 249 HB3 ASP 60 HB3 ASP 60 3.512 5.842 -10.342 250 H HIS 61 H HIS 61 3.506 1.624 -8.971 251 HA HIS 61 HA HIS 61 4.899 0.378 -7.702 252 HB2 HIS 61 HB2 HIS 61 4.055 -0.862 -9.717 253 HB3 HIS 61 HB3 HIS 61 5.641 -0.652 -10.449 254 HD1 HIS 61 HD1 HIS 61 6.278 -3.233 -10.399 255 HD2 HIS 61 HD2 HIS 61 5.117 -1.614 -6.671 256 HE1 HIS 61 HE1 HIS 61 6.799 -5.028 -8.625 257 HE2 HIS 61 HE2 HIS 61 6.130 -4.007 -6.354 258 H ASP 62 H ASP 62 6.197 2.597 -7.445 259 HA ASP 62 HA ASP 62 9.015 2.365 -8.291 260 HB2 ASP 62 HB2 ASP 62 9.333 4.554 -7.441 261 HB3 ASP 62 HB3 ASP 62 7.837 4.537 -8.359 262 H GLY 63 H GLY 63 7.525 0.686 -6.023 263 HA2 GLY 63 HA2 GLY 63 8.370 -0.583 -4.287 264 HA3 GLY 63 HA3 GLY 63 9.893 0.308 -4.343 265 H VAL 64 H VAL 64 7.161 2.398 -4.126 266 HA VAL 64 HA VAL 64 7.007 2.280 -1.156 267 HB VAL 64 HB VAL 64 7.147 4.965 -2.577 268 HG11 VAL 64 HG11 VAL 64 7.520 4.088 0.326 269 HG12 VAL 64 HG12 VAL 64 7.586 5.759 -0.276 270 HG13 VAL 64 HG13 VAL 64 6.065 4.859 -0.339 271 HG21 VAL 64 HG21 VAL 64 9.439 5.242 -1.714 272 HG22 VAL 64 HG22 VAL 64 9.461 3.523 -1.239 273 HG23 VAL 64 HG23 VAL 64 9.343 3.990 -2.956 274 H ALA 65 H ALA 65 4.951 2.334 -0.491 275 HA ALA 65 HA ALA 65 2.880 3.335 -2.396 276 HB1 ALA 65 HB1 ALA 65 2.858 0.921 -2.334 277 HB2 ALA 65 HB2 ALA 65 2.808 0.896 -0.582 278 HB3 ALA 65 HB3 ALA 65 1.418 1.523 -1.495 279 H CYS 66 H CYS 66 1.212 4.463 -1.666 280 HA CYS 66 HA CYS 66 0.308 6.202 -0.611 281 HB2 CYS 66 HB2 CYS 66 0.440 4.578 1.922 282 HB3 CYS 66 HB3 CYS 66 -0.786 5.729 1.413 283 H GLU 67 H GLU 67 3.055 6.510 -0.954 284 HA GLU 67 HA GLU 67 4.512 7.609 1.190 285 HB2 GLU 67 HB2 GLU 67 5.730 8.849 -0.579 286 HB3 GLU 67 HB3 GLU 67 5.607 7.128 -0.856 287 HG2 GLU 67 HG2 GLU 67 3.548 8.851 -2.220 288 HG3 GLU 67 HG3 GLU 67 5.210 9.000 -2.750 289 H LEU 68 H LEU 68 4.902 9.684 2.001 290 HA LEU 68 HA LEU 68 2.968 11.872 1.262 291 HB2 LEU 68 HB2 LEU 68 4.107 11.139 3.986 292 HB3 LEU 68 HB3 LEU 68 3.598 12.767 3.595 293 HG LEU 68 HG LEU 68 1.321 11.674 2.865 294 HD11 LEU 68 HD11 LEU 68 2.392 9.667 4.889 295 HD12 LEU 68 HD12 LEU 68 2.047 9.315 3.180 296 HD13 LEU 68 HD13 LEU 68 0.725 9.743 4.281 297 HD21 LEU 68 HD21 LEU 68 1.591 13.263 4.725 298 HD22 LEU 68 HD22 LEU 68 2.147 11.947 5.787 299 HD23 LEU 68 HD23 LEU 68 0.479 11.957 5.162 300 H LYS 69 H LYS 69 6.343 11.230 2.291 301 HA LYS 69 HA LYS 69 7.326 13.878 1.914 302 HB2 LYS 69 HB2 LYS 69 9.541 12.858 1.919 303 HB3 LYS 69 HB3 LYS 69 8.520 12.261 3.210 304 HG2 LYS 69 HG2 LYS 69 9.041 10.167 2.625 305 HG3 LYS 69 HG3 LYS 69 8.104 10.370 1.162 306 HD2 LYS 69 HD2 LYS 69 10.169 9.666 0.329 307 HD3 LYS 69 HD3 LYS 69 10.244 11.411 0.124 308 HE2 LYS 69 HE2 LYS 69 12.345 10.860 1.022 309 HE3 LYS 69 HE3 LYS 69 11.452 11.495 2.405 310 HZ1 LYS 69 HZ1 LYS 69 12.616 9.431 2.956 311 HZ2 LYS 69 HZ2 LYS 69 11.848 8.611 1.777 312 HZ3 LYS 69 HZ3 LYS 69 11.011 9.168 3.066 313 H ASN 70 H ASN 70 7.329 15.066 0.178 314 HA ASN 70 HA ASN 70 6.840 14.096 -2.475 315 HB2 ASN 70 HB2 ASN 70 6.883 16.352 -3.174 316 HB3 ASN 70 HB3 ASN 70 6.150 16.358 -1.585 317 HD21 ASN 70 HD21 ASN 70 7.238 17.518 0.111 318 HD22 ASN 70 HD22 ASN 70 8.654 18.496 -0.234 Start of MODEL 3 1 H1 GLY 24 H1 GLY 24 -3.784 -27.565 0.806 2 H2 GLY 24 H2 GLY 24 -4.537 -28.510 1.911 3 H3 GLY 24 H3 GLY 24 -5.342 -28.019 0.571 4 HA2 GLY 24 HA2 GLY 24 -6.179 -26.375 1.801 5 HA3 GLY 24 HA3 GLY 24 -4.961 -26.672 3.055 6 H ALA 25 H ALA 25 -5.898 -24.100 1.984 7 HA ALA 25 HA ALA 25 -3.249 -22.930 1.289 8 HB1 ALA 25 HB1 ALA 25 -5.886 -22.311 -0.121 9 HB2 ALA 25 HB2 ALA 25 -4.338 -21.477 -0.385 10 HB3 ALA 25 HB3 ALA 25 -4.508 -23.188 -0.826 11 H SER 26 H SER 26 -2.877 -20.884 2.126 12 HA SER 26 HA SER 26 -4.330 -20.199 4.533 13 HB2 SER 26 HB2 SER 26 -2.628 -18.359 4.645 14 HB3 SER 26 HB3 SER 26 -1.953 -19.990 4.500 15 HG SER 26 HG SER 26 -0.907 -18.552 3.074 16 H GLU 27 H GLU 27 -3.842 -18.517 1.435 17 HA GLU 27 HA GLU 27 -4.637 -16.600 0.559 18 HB2 GLU 27 HB2 GLU 27 -6.477 -18.402 0.241 19 HB3 GLU 27 HB3 GLU 27 -7.392 -17.488 1.433 20 HG2 GLU 27 HG2 GLU 27 -8.155 -16.684 -0.634 21 HG3 GLU 27 HG3 GLU 27 -7.032 -15.430 -0.126 22 H GLU 28 H GLU 28 -3.635 -16.108 3.093 23 HA GLU 28 HA GLU 28 -5.454 -14.048 4.281 24 HB2 GLU 28 HB2 GLU 28 -4.817 -16.015 5.710 25 HB3 GLU 28 HB3 GLU 28 -3.140 -15.466 5.637 26 HG2 GLU 28 HG2 GLU 28 -4.050 -13.184 6.512 27 HG3 GLU 28 HG3 GLU 28 -5.555 -14.037 6.828 28 H ASN 29 H ASN 29 -4.921 -12.405 2.826 29 HA ASN 29 HA ASN 29 -2.420 -11.006 3.547 30 HB2 ASN 29 HB2 ASN 29 -2.140 -12.478 1.397 31 HB3 ASN 29 HB3 ASN 29 -3.180 -11.289 0.613 32 HD21 ASN 29 HD21 ASN 29 -0.136 -11.697 2.455 33 HD22 ASN 29 HD22 ASN 29 0.650 -10.288 1.754 34 H ILE 30 H ILE 30 -2.488 -8.767 3.310 35 HA ILE 30 HA ILE 30 -5.131 -7.576 3.605 36 HB ILE 30 HB ILE 30 -2.301 -6.492 3.630 37 HG12 ILE 30 HG12 ILE 30 -4.284 -6.539 5.935 38 HG13 ILE 30 HG13 ILE 30 -3.334 -7.977 5.559 39 HG21 ILE 30 HG21 ILE 30 -3.327 -4.369 4.569 40 HG22 ILE 30 HG22 ILE 30 -3.662 -4.632 2.862 41 HG23 ILE 30 HG23 ILE 30 -4.915 -4.976 4.083 42 HD11 ILE 30 HD11 ILE 30 -2.279 -6.703 7.333 43 HD12 ILE 30 HD12 ILE 30 -1.245 -6.716 5.897 44 HD13 ILE 30 HD13 ILE 30 -2.198 -5.261 6.305 45 H HIS 31 H HIS 31 -6.320 -6.500 2.194 46 HA HIS 31 HA HIS 31 -5.201 -5.647 -0.437 47 HB2 HIS 31 HB2 HIS 31 -6.236 -7.809 -0.815 48 HB3 HIS 31 HB3 HIS 31 -7.704 -7.308 0.015 49 HD1 HIS 31 HD1 HIS 31 -9.498 -7.113 -1.848 50 HD2 HIS 31 HD2 HIS 31 -5.743 -5.471 -2.876 51 HE1 HIS 31 HE1 HIS 31 -9.793 -6.006 -4.156 52 HE2 HIS 31 HE2 HIS 31 -7.501 -5.003 -4.769 53 H PHE 32 H PHE 32 -5.166 -3.530 0.114 54 HA PHE 32 HA PHE 32 -7.576 -2.046 0.957 55 HB2 PHE 32 HB2 PHE 32 -4.810 -1.229 0.004 56 HB3 PHE 32 HB3 PHE 32 -6.072 -0.073 0.393 57 HD1 PHE 32 HD1 PHE 32 -3.365 -2.078 1.698 58 HD2 PHE 32 HD2 PHE 32 -7.012 -0.036 2.771 59 HE1 PHE 32 HE1 PHE 32 -2.637 -2.018 4.075 60 HE2 PHE 32 HE2 PHE 32 -6.276 0.024 5.143 61 HZ PHE 32 HZ PHE 32 -4.093 -0.965 5.794 62 H SER 33 H SER 33 -9.077 -1.179 -0.428 63 HA SER 33 HA SER 33 -9.001 -1.624 -3.273 64 HB2 SER 33 HB2 SER 33 -10.745 0.253 -1.634 65 HB3 SER 33 HB3 SER 33 -11.034 -0.237 -3.315 66 HG SER 33 HG SER 33 -12.213 -1.515 -1.777 67 H SER 34 H SER 34 -8.115 1.164 -1.273 68 HA SER 34 HA SER 34 -6.628 2.443 -3.473 69 HB2 SER 34 HB2 SER 34 -8.939 3.826 -2.020 70 HB3 SER 34 HB3 SER 34 -7.736 4.668 -3.006 71 HG SER 34 HG SER 34 -8.465 3.497 -4.819 72 H CYS 35 H CYS 35 -4.994 3.852 -2.683 73 HA CYS 35 HA CYS 35 -4.084 3.707 -0.017 74 HB2 CYS 35 HB2 CYS 35 -3.560 5.603 -2.299 75 HB3 CYS 35 HB3 CYS 35 -2.954 6.000 -0.697 76 H LYS 36 H LYS 36 -6.609 5.844 -1.255 77 HA LYS 36 HA LYS 36 -6.802 7.744 0.847 78 HB2 LYS 36 HB2 LYS 36 -8.870 6.343 -0.885 79 HB3 LYS 36 HB3 LYS 36 -9.338 7.553 0.296 80 HG2 LYS 36 HG2 LYS 36 -7.252 8.101 -1.851 81 HG3 LYS 36 HG3 LYS 36 -8.966 8.323 -2.150 82 HD2 LYS 36 HD2 LYS 36 -7.597 9.761 0.170 83 HD3 LYS 36 HD3 LYS 36 -7.507 10.349 -1.481 84 HE2 LYS 36 HE2 LYS 36 -9.271 11.557 -0.590 85 HE3 LYS 36 HE3 LYS 36 -10.037 10.327 -1.590 86 HZ1 LYS 36 HZ1 LYS 36 -11.134 10.580 0.566 87 HZ2 LYS 36 HZ2 LYS 36 -9.768 10.213 1.375 88 HZ3 LYS 36 HZ3 LYS 36 -10.520 9.077 0.458 89 H GLU 37 H GLU 37 -7.924 4.372 0.847 90 HA GLU 37 HA GLU 37 -9.165 4.582 3.482 91 HB2 GLU 37 HB2 GLU 37 -9.680 2.931 1.508 92 HB3 GLU 37 HB3 GLU 37 -8.274 2.045 2.071 93 HG2 GLU 37 HG2 GLU 37 -10.128 0.992 3.052 94 HG3 GLU 37 HG3 GLU 37 -9.380 1.903 4.359 95 H ALA 38 H ALA 38 -6.004 3.545 2.230 96 HA ALA 38 HA ALA 38 -4.955 2.512 4.698 97 HB1 ALA 38 HB1 ALA 38 -2.869 2.443 3.458 98 HB2 ALA 38 HB2 ALA 38 -4.171 1.999 2.356 99 HB3 ALA 38 HB3 ALA 38 -3.462 3.631 2.287 100 H TRP 39 H TRP 39 -4.562 5.739 3.104 101 HA TRP 39 HA TRP 39 -3.031 6.997 5.123 102 HB2 TRP 39 HB2 TRP 39 -5.001 8.040 3.061 103 HB3 TRP 39 HB3 TRP 39 -4.189 9.119 4.174 104 HD1 TRP 39 HD1 TRP 39 -1.275 8.062 4.142 105 HE1 TRP 39 HE1 TRP 39 0.213 8.338 2.075 106 HE3 TRP 39 HE3 TRP 39 -4.903 8.710 0.589 107 HZ2 TRP 39 HZ2 TRP 39 -0.107 8.897 -0.726 108 HZ3 TRP 39 HZ3 TRP 39 -4.278 9.065 -1.795 109 HH2 TRP 39 HH2 TRP 39 -1.885 9.152 -2.462 110 H ALA 40 H ALA 40 -6.604 6.663 4.950 111 HA ALA 40 HA ALA 40 -7.178 8.258 7.243 112 HB1 ALA 40 HB1 ALA 40 -8.706 5.863 6.134 113 HB2 ALA 40 HB2 ALA 40 -9.350 7.150 7.183 114 HB3 ALA 40 HB3 ALA 40 -8.827 7.537 5.530 115 H ASN 41 H ASN 41 -5.875 5.012 7.044 116 HA ASN 41 HA ASN 41 -6.180 4.536 9.967 117 HB2 ASN 41 HB2 ASN 41 -5.307 2.806 7.609 118 HB3 ASN 41 HB3 ASN 41 -5.134 2.299 9.285 119 HD21 ASN 41 HD21 ASN 41 -7.517 2.956 6.724 120 HD22 ASN 41 HD22 ASN 41 -8.845 2.244 7.625 121 H GLY 42 H GLY 42 -4.068 6.318 8.153 122 HA2 GLY 42 HA2 GLY 42 -2.057 7.269 8.765 123 HA3 GLY 42 HA3 GLY 42 -1.935 6.181 10.148 124 H TYR 43 H TYR 43 -2.439 4.588 7.093 125 HA TYR 43 HA TYR 43 0.272 3.425 7.157 126 HB2 TYR 43 HB2 TYR 43 -2.188 2.913 5.480 127 HB3 TYR 43 HB3 TYR 43 -0.632 2.213 5.105 128 HD1 TYR 43 HD1 TYR 43 -0.917 -0.072 5.386 129 HD2 TYR 43 HD2 TYR 43 -2.366 2.572 8.479 130 HE1 TYR 43 HE1 TYR 43 -1.500 -2.030 6.817 131 HE2 TYR 43 HE2 TYR 43 -2.878 0.626 9.908 132 HH TYR 43 HH TYR 43 -2.273 -2.742 8.844 133 H SER 44 H SER 44 1.711 4.968 6.586 134 HA SER 44 HA SER 44 1.719 5.937 3.779 135 HB2 SER 44 HB2 SER 44 2.489 8.151 4.555 136 HB3 SER 44 HB3 SER 44 0.856 7.782 5.125 137 HG SER 44 HG SER 44 2.072 8.612 6.844 138 H ASP 45 H ASP 45 3.851 6.597 3.046 139 HA ASP 45 HA ASP 45 5.933 5.879 2.483 140 HB2 ASP 45 HB2 ASP 45 6.447 7.554 4.213 141 HB3 ASP 45 HB3 ASP 45 6.481 6.291 5.439 142 H ILE 46 H ILE 46 4.254 3.788 2.559 143 HA ILE 46 HA ILE 46 5.051 1.469 4.046 144 HB ILE 46 HB ILE 46 3.860 1.761 1.278 145 HG12 ILE 46 HG12 ILE 46 2.363 1.094 3.852 146 HG13 ILE 46 HG13 ILE 46 2.462 2.728 3.201 147 HG21 ILE 46 HG21 ILE 46 3.281 -0.507 1.218 148 HG22 ILE 46 HG22 ILE 46 4.893 -0.591 1.897 149 HG23 ILE 46 HG23 ILE 46 3.474 -0.730 2.954 150 HD11 ILE 46 HD11 ILE 46 1.255 2.143 1.213 151 HD12 ILE 46 HD12 ILE 46 1.317 0.414 1.563 152 HD13 ILE 46 HD13 ILE 46 0.350 1.493 2.596 153 H HIS 47 H HIS 47 6.841 0.258 3.890 154 HA HIS 47 HA HIS 47 8.652 0.429 1.497 155 HB2 HIS 47 HB2 HIS 47 9.211 -0.230 4.421 156 HB3 HIS 47 HB3 HIS 47 10.390 -0.433 3.138 157 HD1 HIS 47 HD1 HIS 47 11.208 1.462 5.393 158 HD2 HIS 47 HD2 HIS 47 9.074 2.663 1.951 159 HE1 HIS 47 HE1 HIS 47 11.603 3.997 5.130 160 HE2 HIS 47 HE2 HIS 47 10.205 4.727 3.083 161 H GLU 48 H GLU 48 9.989 -1.670 1.292 162 HA GLU 48 HA GLU 48 8.373 -3.807 0.474 163 HB2 GLU 48 HB2 GLU 48 10.503 -5.181 0.652 164 HB3 GLU 48 HB3 GLU 48 10.578 -3.741 -0.358 165 HG2 GLU 48 HG2 GLU 48 11.853 -2.520 1.224 166 HG3 GLU 48 HG3 GLU 48 11.518 -3.656 2.526 167 H GLY 49 H GLY 49 7.470 -5.556 1.317 168 HA2 GLY 49 HA2 GLY 49 7.017 -7.266 2.848 169 HA3 GLY 49 HA3 GLY 49 8.048 -6.498 4.052 170 H GLU 50 H GLU 50 6.460 -3.831 3.549 171 HA GLU 50 HA GLU 50 4.245 -4.403 5.411 172 HB2 GLU 50 HB2 GLU 50 5.398 -1.874 4.210 173 HB3 GLU 50 HB3 GLU 50 3.755 -1.881 4.817 174 HG2 GLU 50 HG2 GLU 50 5.101 -1.093 6.565 175 HG3 GLU 50 HG3 GLU 50 4.503 -2.682 7.013 176 HA PRO 51 HA PRO 51 1.106 -5.135 2.458 177 HB2 PRO 51 HB2 PRO 51 -1.136 -4.019 3.563 178 HB3 PRO 51 HB3 PRO 51 -0.311 -5.469 4.224 179 HG2 PRO 51 HG2 PRO 51 0.036 -2.583 5.103 180 HG3 PRO 51 HG3 PRO 51 -0.307 -4.007 6.139 181 HD2 PRO 51 HD2 PRO 51 2.198 -3.110 5.836 182 HD3 PRO 51 HD3 PRO 51 1.876 -4.869 5.835 183 H GLY 52 H GLY 52 0.571 -4.284 0.554 184 HA2 GLY 52 HA2 GLY 52 -0.368 -2.708 -0.917 185 HA3 GLY 52 HA3 GLY 52 -0.080 -1.404 0.234 186 H TYR 53 H TYR 53 2.871 -2.923 0.224 187 HA TYR 53 HA TYR 53 4.241 -1.116 -1.466 188 HB2 TYR 53 HB2 TYR 53 5.335 -2.323 0.297 189 HB3 TYR 53 HB3 TYR 53 4.851 -3.877 -0.356 190 HD1 TYR 53 HD1 TYR 53 6.079 -4.977 -2.114 191 HD2 TYR 53 HD2 TYR 53 7.170 -1.009 -0.804 192 HE1 TYR 53 HE1 TYR 53 8.269 -5.193 -3.286 193 HE2 TYR 53 HE2 TYR 53 9.379 -1.254 -1.943 194 HH TYR 53 HH TYR 53 10.726 -2.586 -3.229 195 H SER 54 H SER 54 2.471 -4.009 -2.294 196 HA SER 54 HA SER 54 3.834 -4.763 -4.701 197 HB2 SER 54 HB2 SER 54 2.148 -6.126 -3.251 198 HB3 SER 54 HB3 SER 54 0.895 -5.256 -4.134 199 HG SER 54 HG SER 54 2.847 -7.073 -5.101 200 H ALA 55 H ALA 55 3.085 -4.617 -6.866 201 HA ALA 55 HA ALA 55 2.233 -2.100 -7.868 202 HB1 ALA 55 HB1 ALA 55 2.055 -4.858 -9.160 203 HB2 ALA 55 HB2 ALA 55 2.043 -3.293 -10.003 204 HB3 ALA 55 HB3 ALA 55 3.500 -3.822 -9.141 205 H LYS 56 H LYS 56 0.325 -4.709 -6.583 206 HA LYS 56 HA LYS 56 -2.241 -4.178 -7.706 207 HB2 LYS 56 HB2 LYS 56 -1.574 -5.224 -4.913 208 HB3 LYS 56 HB3 LYS 56 -3.119 -5.362 -5.766 209 HG2 LYS 56 HG2 LYS 56 -1.794 -6.573 -7.624 210 HG3 LYS 56 HG3 LYS 56 -0.477 -6.710 -6.437 211 HD2 LYS 56 HD2 LYS 56 -1.805 -8.023 -4.947 212 HD3 LYS 56 HD3 LYS 56 -3.305 -7.654 -5.798 213 HE2 LYS 56 HE2 LYS 56 -1.024 -9.347 -6.915 214 HE3 LYS 56 HE3 LYS 56 -2.521 -9.958 -6.197 215 HZ1 LYS 56 HZ1 LYS 56 -3.732 -8.685 -7.979 216 HZ2 LYS 56 HZ2 LYS 56 -2.838 -9.942 -8.536 217 HZ3 LYS 56 HZ3 LYS 56 -2.289 -8.409 -8.720 218 H LEU 57 H LEU 57 -0.484 -2.343 -5.325 219 HA LEU 57 HA LEU 57 -2.884 -0.614 -4.802 220 HB2 LEU 57 HB2 LEU 57 -0.710 -1.726 -3.121 221 HB3 LEU 57 HB3 LEU 57 -0.818 0.014 -2.975 222 HG LEU 57 HG LEU 57 -2.066 -1.044 -1.237 223 HD11 LEU 57 HD11 LEU 57 -4.143 0.111 -3.133 224 HD12 LEU 57 HD12 LEU 57 -2.882 1.108 -2.363 225 HD13 LEU 57 HD13 LEU 57 -4.050 0.245 -1.369 226 HD21 LEU 57 HD21 LEU 57 -2.544 -3.165 -2.467 227 HD22 LEU 57 HD22 LEU 57 -3.817 -2.311 -3.379 228 HD23 LEU 57 HD23 LEU 57 -3.959 -2.504 -1.626 229 H ASP 58 H ASP 58 0.606 -0.628 -5.486 230 HA ASP 58 HA ASP 58 0.588 2.288 -5.959 231 HB2 ASP 58 HB2 ASP 58 2.194 1.146 -4.436 232 HB3 ASP 58 HB3 ASP 58 2.894 0.304 -5.821 233 H ARG 59 H ARG 59 -0.450 2.491 -7.924 234 HA ARG 59 HA ARG 59 -0.231 1.077 -10.284 235 HB2 ARG 59 HB2 ARG 59 -1.072 3.073 -11.412 236 HB3 ARG 59 HB3 ARG 59 -1.841 2.854 -9.852 237 HG2 ARG 59 HG2 ARG 59 -1.466 5.101 -9.722 238 HG3 ARG 59 HG3 ARG 59 0.030 4.550 -9.000 239 HD2 ARG 59 HD2 ARG 59 0.937 6.034 -10.478 240 HD3 ARG 59 HD3 ARG 59 0.880 4.662 -11.569 241 HE ARG 59 HE ARG 59 -0.816 5.674 -12.798 242 HH11 ARG 59 HH11 ARG 59 -0.384 7.540 -9.861 243 HH12 ARG 59 HH12 ARG 59 -1.368 8.856 -10.443 244 HH21 ARG 59 HH21 ARG 59 -2.056 7.394 -13.478 245 HH22 ARG 59 HH22 ARG 59 -2.283 8.768 -12.436 246 H ASP 60 H ASP 60 2.114 3.387 -9.155 247 HA ASP 60 HA ASP 60 3.716 3.281 -11.635 248 HB2 ASP 60 HB2 ASP 60 5.113 4.966 -10.455 249 HB3 ASP 60 HB3 ASP 60 3.430 5.429 -10.657 250 H HIS 61 H HIS 61 3.530 1.369 -8.893 251 HA HIS 61 HA HIS 61 4.972 0.337 -7.488 252 HB2 HIS 61 HB2 HIS 61 4.125 -1.174 -9.302 253 HB3 HIS 61 HB3 HIS 61 5.700 -1.044 -10.075 254 HD1 HIS 61 HD1 HIS 61 5.076 -1.592 -6.233 255 HD2 HIS 61 HD2 HIS 61 6.610 -3.481 -9.692 256 HE1 HIS 61 HE1 HIS 61 6.221 -3.739 -5.435 257 HE2 HIS 61 HE2 HIS 61 7.126 -4.910 -7.549 258 H ASP 62 H ASP 62 6.205 2.595 -7.537 259 HA ASP 62 HA ASP 62 9.028 2.353 -8.323 260 HB2 ASP 62 HB2 ASP 62 9.292 4.606 -7.600 261 HB3 ASP 62 HB3 ASP 62 7.819 4.486 -8.552 262 H GLY 63 H GLY 63 7.569 0.793 -5.951 263 HA2 GLY 63 HA2 GLY 63 8.453 -0.342 -4.141 264 HA3 GLY 63 HA3 GLY 63 9.934 0.617 -4.224 265 H VAL 64 H VAL 64 7.181 2.652 -4.191 266 HA VAL 64 HA VAL 64 6.996 2.738 -1.211 267 HB VAL 64 HB VAL 64 7.065 5.281 -2.883 268 HG11 VAL 64 HG11 VAL 64 7.329 4.708 0.106 269 HG12 VAL 64 HG12 VAL 64 7.383 6.312 -0.654 270 HG13 VAL 64 HG13 VAL 64 5.888 5.366 -0.695 271 HG21 VAL 64 HG21 VAL 64 9.357 4.045 -1.323 272 HG22 VAL 64 HG22 VAL 64 9.297 4.348 -3.079 273 HG23 VAL 64 HG23 VAL 64 9.308 5.713 -1.957 274 H ALA 65 H ALA 65 4.955 2.645 -0.577 275 HA ALA 65 HA ALA 65 2.823 3.449 -2.509 276 HB1 ALA 65 HB1 ALA 65 2.888 1.121 -0.543 277 HB2 ALA 65 HB2 ALA 65 1.448 1.636 -1.459 278 HB3 ALA 65 HB3 ALA 65 2.901 1.041 -2.301 279 H CYS 66 H CYS 66 1.056 4.479 -1.781 280 HA CYS 66 HA CYS 66 0.131 6.272 -0.817 281 HB2 CYS 66 HB2 CYS 66 0.365 4.765 1.782 282 HB3 CYS 66 HB3 CYS 66 -0.905 5.862 1.262 283 H GLU 67 H GLU 67 2.727 6.802 -1.300 284 HA GLU 67 HA GLU 67 4.292 7.868 0.794 285 HB2 GLU 67 HB2 GLU 67 5.288 9.312 -1.009 286 HB3 GLU 67 HB3 GLU 67 5.397 7.577 -1.223 287 HG2 GLU 67 HG2 GLU 67 3.132 9.008 -2.619 288 HG3 GLU 67 HG3 GLU 67 4.767 9.189 -3.225 289 H LEU 68 H LEU 68 4.447 9.735 1.887 290 HA LEU 68 HA LEU 68 2.618 12.026 1.231 291 HB2 LEU 68 HB2 LEU 68 3.418 10.869 3.928 292 HB3 LEU 68 HB3 LEU 68 2.813 12.507 3.757 293 HG LEU 68 HG LEU 68 1.252 10.002 3.045 294 HD11 LEU 68 HD11 LEU 68 0.933 12.007 5.328 295 HD12 LEU 68 HD12 LEU 68 1.622 10.383 5.488 296 HD13 LEU 68 HD13 LEU 68 -0.080 10.577 5.028 297 HD21 LEU 68 HD21 LEU 68 -0.695 11.582 2.927 298 HD22 LEU 68 HD22 LEU 68 0.481 11.870 1.644 299 HD23 LEU 68 HD23 LEU 68 0.434 12.949 3.059 300 H LYS 69 H LYS 69 5.844 11.122 2.474 301 HA LYS 69 HA LYS 69 6.642 13.805 3.172 302 HB2 LYS 69 HB2 LYS 69 8.403 11.400 2.492 303 HB3 LYS 69 HB3 LYS 69 8.921 12.844 3.353 304 HG2 LYS 69 HG2 LYS 69 6.850 10.836 4.349 305 HG3 LYS 69 HG3 LYS 69 8.530 10.885 4.843 306 HD2 LYS 69 HD2 LYS 69 6.607 13.211 5.228 307 HD3 LYS 69 HD3 LYS 69 6.812 11.945 6.425 308 HE2 LYS 69 HE2 LYS 69 9.110 13.685 5.419 309 HE3 LYS 69 HE3 LYS 69 8.134 14.074 6.836 310 HZ1 LYS 69 HZ1 LYS 69 8.842 11.985 7.851 311 HZ2 LYS 69 HZ2 LYS 69 10.144 12.894 7.478 312 HZ3 LYS 69 HZ3 LYS 69 9.764 11.605 6.552 313 H ASN 70 H ASN 70 7.013 11.966 0.317 314 HA ASN 70 HA ASN 70 8.070 12.279 -1.729 315 HB2 ASN 70 HB2 ASN 70 6.175 14.654 -1.498 316 HB3 ASN 70 HB3 ASN 70 6.888 14.093 -3.004 317 HD21 ASN 70 HD21 ASN 70 4.434 13.410 -0.590 318 HD22 ASN 70 HD22 ASN 70 3.701 12.093 -1.503 Start of MODEL 4 1 H1 GLY 24 H1 GLY 24 4.274 -19.678 -3.311 2 H2 GLY 24 H2 GLY 24 5.020 -18.263 -3.656 3 H3 GLY 24 H3 GLY 24 4.431 -18.531 -2.153 4 HA2 GLY 24 HA2 GLY 24 2.957 -17.038 -3.315 5 HA3 GLY 24 HA3 GLY 24 2.841 -18.229 -4.619 6 H ALA 25 H ALA 25 1.455 -17.148 -1.716 7 HA ALA 25 HA ALA 25 -0.582 -19.251 -1.757 8 HB1 ALA 25 HB1 ALA 25 1.180 -20.208 -0.274 9 HB2 ALA 25 HB2 ALA 25 1.110 -18.749 0.740 10 HB3 ALA 25 HB3 ALA 25 -0.294 -19.833 0.625 11 H SER 26 H SER 26 -2.215 -18.759 0.072 12 HA SER 26 HA SER 26 -2.772 -15.815 0.199 13 HB2 SER 26 HB2 SER 26 -4.728 -18.116 -0.130 14 HB3 SER 26 HB3 SER 26 -5.151 -16.401 0.059 15 HG SER 26 HG SER 26 -5.091 -17.095 -2.153 16 H GLU 27 H GLU 27 -1.975 -15.422 2.199 17 HA GLU 27 HA GLU 27 -3.046 -16.971 4.530 18 HB2 GLU 27 HB2 GLU 27 -0.922 -16.553 5.670 19 HB3 GLU 27 HB3 GLU 27 -0.798 -17.612 4.276 20 HG2 GLU 27 HG2 GLU 27 0.268 -15.930 2.935 21 HG3 GLU 27 HG3 GLU 27 -0.070 -14.660 4.105 22 H GLU 28 H GLU 28 -4.757 -15.310 4.069 23 HA GLU 28 HA GLU 28 -5.935 -13.476 4.582 24 HB2 GLU 28 HB2 GLU 28 -5.181 -14.364 6.927 25 HB3 GLU 28 HB3 GLU 28 -4.156 -12.939 6.961 26 HG2 GLU 28 HG2 GLU 28 -6.038 -12.201 8.053 27 HG3 GLU 28 HG3 GLU 28 -6.362 -11.612 6.428 28 H ASN 29 H ASN 29 -3.978 -13.133 2.655 29 HA ASN 29 HA ASN 29 -2.406 -10.846 2.679 30 HB2 ASN 29 HB2 ASN 29 -4.068 -12.132 0.474 31 HB3 ASN 29 HB3 ASN 29 -3.042 -10.736 0.182 32 HD21 ASN 29 HD21 ASN 29 -1.102 -11.275 -0.679 33 HD22 ASN 29 HD22 ASN 29 -0.235 -12.758 -0.308 34 H ILE 30 H ILE 30 -2.739 -8.777 3.003 35 HA ILE 30 HA ILE 30 -5.373 -7.573 3.219 36 HB ILE 30 HB ILE 30 -2.544 -6.495 3.370 37 HG12 ILE 30 HG12 ILE 30 -4.673 -6.756 5.544 38 HG13 ILE 30 HG13 ILE 30 -3.512 -8.033 5.208 39 HG21 ILE 30 HG21 ILE 30 -5.162 -4.980 3.831 40 HG22 ILE 30 HG22 ILE 30 -3.554 -4.380 4.267 41 HG23 ILE 30 HG23 ILE 30 -3.943 -4.637 2.575 42 HD11 ILE 30 HD11 ILE 30 -1.641 -6.598 5.812 43 HD12 ILE 30 HD12 ILE 30 -2.749 -5.239 6.136 44 HD13 ILE 30 HD13 ILE 30 -2.818 -6.703 7.123 45 H HIS 31 H HIS 31 -6.517 -6.535 1.791 46 HA HIS 31 HA HIS 31 -5.351 -5.600 -0.800 47 HB2 HIS 31 HB2 HIS 31 -7.943 -7.136 -0.343 48 HB3 HIS 31 HB3 HIS 31 -7.603 -6.226 -1.805 49 HD1 HIS 31 HD1 HIS 31 -7.052 -9.618 -0.377 50 HD2 HIS 31 HD2 HIS 31 -5.413 -7.065 -3.316 51 HE1 HIS 31 HE1 HIS 31 -5.769 -11.132 -2.025 52 HE2 HIS 31 HE2 HIS 31 -4.747 -9.562 -3.796 53 H PHE 32 H PHE 32 -5.322 -3.460 -0.494 54 HA PHE 32 HA PHE 32 -7.685 -2.009 0.610 55 HB2 PHE 32 HB2 PHE 32 -4.910 -1.138 -0.234 56 HB3 PHE 32 HB3 PHE 32 -6.176 -0.007 0.209 57 HD1 PHE 32 HD1 PHE 32 -7.303 -0.388 2.561 58 HD2 PHE 32 HD2 PHE 32 -3.405 -1.861 1.433 59 HE1 PHE 32 HE1 PHE 32 -6.665 -0.542 4.957 60 HE2 PHE 32 HE2 PHE 32 -2.769 -2.000 3.826 61 HZ PHE 32 HZ PHE 32 -4.406 -1.351 5.592 62 H SER 33 H SER 33 -9.143 -1.025 -0.691 63 HA SER 33 HA SER 33 -9.148 -1.272 -3.539 64 HB2 SER 33 HB2 SER 33 -10.672 0.703 -1.797 65 HB3 SER 33 HB3 SER 33 -11.084 0.224 -3.453 66 HG SER 33 HG SER 33 -11.449 -1.895 -2.703 67 H SER 34 H SER 34 -7.890 1.277 -1.424 68 HA SER 34 HA SER 34 -6.252 2.387 -3.534 69 HB2 SER 34 HB2 SER 34 -7.171 4.651 -3.530 70 HB3 SER 34 HB3 SER 34 -8.423 3.514 -4.034 71 HG SER 34 HG SER 34 -9.492 4.578 -2.524 72 H CYS 35 H CYS 35 -4.683 3.923 -2.727 73 HA CYS 35 HA CYS 35 -3.891 3.825 -0.013 74 HB2 CYS 35 HB2 CYS 35 -3.278 5.670 -2.313 75 HB3 CYS 35 HB3 CYS 35 -2.743 6.109 -0.697 76 H LYS 36 H LYS 36 -6.487 5.787 -1.350 77 HA LYS 36 HA LYS 36 -6.521 7.856 0.673 78 HB2 LYS 36 HB2 LYS 36 -8.809 6.702 -0.983 79 HB3 LYS 36 HB3 LYS 36 -8.928 8.073 0.100 80 HG2 LYS 36 HG2 LYS 36 -8.723 9.100 -1.925 81 HG3 LYS 36 HG3 LYS 36 -7.081 9.202 -1.292 82 HD2 LYS 36 HD2 LYS 36 -6.376 7.364 -2.784 83 HD3 LYS 36 HD3 LYS 36 -8.064 7.108 -3.290 84 HE2 LYS 36 HE2 LYS 36 -8.096 9.480 -4.144 85 HE3 LYS 36 HE3 LYS 36 -6.380 9.614 -3.743 86 HZ1 LYS 36 HZ1 LYS 36 -7.560 7.713 -5.701 87 HZ2 LYS 36 HZ2 LYS 36 -5.970 7.760 -5.305 88 HZ3 LYS 36 HZ3 LYS 36 -6.665 9.027 -6.064 89 H GLU 37 H GLU 37 -7.920 4.603 0.554 90 HA GLU 37 HA GLU 37 -9.203 4.783 3.160 91 HB2 GLU 37 HB2 GLU 37 -9.708 3.195 1.139 92 HB3 GLU 37 HB3 GLU 37 -8.347 2.249 1.715 93 HG2 GLU 37 HG2 GLU 37 -10.377 1.295 2.580 94 HG3 GLU 37 HG3 GLU 37 -9.467 1.981 3.921 95 H ALA 38 H ALA 38 -6.029 3.682 1.987 96 HA ALA 38 HA ALA 38 -5.109 2.491 4.412 97 HB1 ALA 38 HB1 ALA 38 -3.397 3.826 2.284 98 HB2 ALA 38 HB2 ALA 38 -2.989 2.441 3.307 99 HB3 ALA 38 HB3 ALA 38 -4.195 2.254 2.034 100 H TRP 39 H TRP 39 -4.594 5.856 3.139 101 HA TRP 39 HA TRP 39 -3.167 6.843 5.380 102 HB2 TRP 39 HB2 TRP 39 -4.959 8.190 3.340 103 HB3 TRP 39 HB3 TRP 39 -4.156 9.096 4.606 104 HD1 TRP 39 HD1 TRP 39 -1.291 7.889 4.588 105 HE1 TRP 39 HE1 TRP 39 0.314 8.347 2.628 106 HE3 TRP 39 HE3 TRP 39 -4.726 9.060 0.984 107 HZ2 TRP 39 HZ2 TRP 39 0.133 9.333 -0.054 108 HZ3 TRP 39 HZ3 TRP 39 -3.981 9.717 -1.299 109 HH2 TRP 39 HH2 TRP 39 -1.555 9.867 -1.828 110 H ALA 40 H ALA 40 -6.715 6.542 5.009 111 HA ALA 40 HA ALA 40 -7.404 7.989 7.380 112 HB1 ALA 40 HB1 ALA 40 -8.989 7.396 5.565 113 HB2 ALA 40 HB2 ALA 40 -8.869 5.681 6.030 114 HB3 ALA 40 HB3 ALA 40 -9.562 6.863 7.157 115 H ASN 41 H ASN 41 -6.043 4.800 6.992 116 HA ASN 41 HA ASN 41 -6.483 4.075 9.852 117 HB2 ASN 41 HB2 ASN 41 -5.477 2.524 7.418 118 HB3 ASN 41 HB3 ASN 41 -5.459 1.890 9.057 119 HD21 ASN 41 HD21 ASN 41 -7.615 2.794 6.360 120 HD22 ASN 41 HD22 ASN 41 -9.005 1.999 7.074 121 H GLY 42 H GLY 42 -4.327 5.997 8.271 122 HA2 GLY 42 HA2 GLY 42 -2.313 6.872 8.975 123 HA3 GLY 42 HA3 GLY 42 -2.229 5.681 10.273 124 H TYR 43 H TYR 43 -2.691 4.311 7.099 125 HA TYR 43 HA TYR 43 0.019 3.135 7.151 126 HB2 TYR 43 HB2 TYR 43 -2.440 2.716 5.452 127 HB3 TYR 43 HB3 TYR 43 -0.875 2.113 4.960 128 HD1 TYR 43 HD1 TYR 43 -1.417 -0.170 4.917 129 HD2 TYR 43 HD2 TYR 43 -2.096 2.084 8.543 130 HE1 TYR 43 HE1 TYR 43 -1.856 -2.280 6.176 131 HE2 TYR 43 HE2 TYR 43 -2.473 -0.014 9.781 132 HH TYR 43 HH TYR 43 -2.564 -2.306 9.680 133 H SER 44 H SER 44 1.622 4.356 6.487 134 HA SER 44 HA SER 44 1.597 5.656 3.840 135 HB2 SER 44 HB2 SER 44 2.622 7.721 4.928 136 HB3 SER 44 HB3 SER 44 0.877 7.513 5.080 137 HG SER 44 HG SER 44 2.850 6.995 7.079 138 H ASP 45 H ASP 45 3.696 6.319 3.126 139 HA ASP 45 HA ASP 45 5.791 5.694 2.508 140 HB2 ASP 45 HB2 ASP 45 6.342 5.964 5.481 141 HB3 ASP 45 HB3 ASP 45 7.550 5.994 4.201 142 H ILE 46 H ILE 46 4.162 3.490 2.605 143 HA ILE 46 HA ILE 46 5.050 1.242 4.099 144 HB ILE 46 HB ILE 46 3.770 1.400 1.370 145 HG12 ILE 46 HG12 ILE 46 2.358 0.853 4.000 146 HG13 ILE 46 HG13 ILE 46 2.425 2.454 3.269 147 HG21 ILE 46 HG21 ILE 46 3.022 -1.031 2.764 148 HG22 ILE 46 HG22 ILE 46 3.870 -0.846 1.222 149 HG23 ILE 46 HG23 ILE 46 4.758 -0.939 2.747 150 HD11 ILE 46 HD11 ILE 46 0.367 0.850 2.799 151 HD12 ILE 46 HD12 ILE 46 1.003 1.926 1.541 152 HD13 ILE 46 HD13 ILE 46 1.420 0.209 1.517 153 H HIS 47 H HIS 47 6.823 0.052 3.986 154 HA HIS 47 HA HIS 47 8.701 0.188 1.651 155 HB2 HIS 47 HB2 HIS 47 9.011 -0.530 4.597 156 HB3 HIS 47 HB3 HIS 47 10.239 -0.944 3.418 157 HD1 HIS 47 HD1 HIS 47 11.418 0.803 5.450 158 HD2 HIS 47 HD2 HIS 47 9.246 2.325 2.162 159 HE1 HIS 47 HE1 HIS 47 12.241 3.218 5.085 160 HE2 HIS 47 HE2 HIS 47 10.909 4.134 3.080 161 H GLU 48 H GLU 48 9.992 -1.942 1.404 162 HA GLU 48 HA GLU 48 8.342 -4.004 0.413 163 HB2 GLU 48 HB2 GLU 48 10.429 -5.427 0.567 164 HB3 GLU 48 HB3 GLU 48 10.565 -3.937 -0.364 165 HG2 GLU 48 HG2 GLU 48 11.799 -2.826 1.332 166 HG3 GLU 48 HG3 GLU 48 11.437 -4.059 2.539 167 H GLY 49 H GLY 49 7.519 -5.876 1.122 168 HA2 GLY 49 HA2 GLY 49 6.976 -7.621 2.561 169 HA3 GLY 49 HA3 GLY 49 7.972 -6.911 3.830 170 H GLU 50 H GLU 50 6.351 -4.246 3.342 171 HA GLU 50 HA GLU 50 4.151 -4.855 5.206 172 HB2 GLU 50 HB2 GLU 50 5.483 -2.398 4.156 173 HB3 GLU 50 HB3 GLU 50 3.766 -2.254 4.550 174 HG2 GLU 50 HG2 GLU 50 4.154 -2.985 6.784 175 HG3 GLU 50 HG3 GLU 50 5.859 -3.336 6.434 176 HA PRO 51 HA PRO 51 0.945 -5.406 2.275 177 HB2 PRO 51 HB2 PRO 51 -1.246 -4.268 3.458 178 HB3 PRO 51 HB3 PRO 51 -0.454 -5.765 4.049 179 HG2 PRO 51 HG2 PRO 51 -0.010 -2.924 5.028 180 HG3 PRO 51 HG3 PRO 51 -0.381 -4.376 6.016 181 HD2 PRO 51 HD2 PRO 51 2.144 -3.514 5.690 182 HD3 PRO 51 HD3 PRO 51 1.787 -5.268 5.652 183 H GLY 52 H GLY 52 0.657 -4.466 0.378 184 HA2 GLY 52 HA2 GLY 52 -0.333 -2.842 -1.037 185 HA3 GLY 52 HA3 GLY 52 -0.062 -1.580 0.166 186 H TYR 53 H TYR 53 2.873 -3.103 0.138 187 HA TYR 53 HA TYR 53 4.299 -1.245 -1.457 188 HB2 TYR 53 HB2 TYR 53 5.347 -2.550 0.257 189 HB3 TYR 53 HB3 TYR 53 4.828 -4.064 -0.460 190 HD1 TYR 53 HD1 TYR 53 7.185 -1.215 -0.834 191 HD2 TYR 53 HD2 TYR 53 6.049 -5.143 -2.216 192 HE1 TYR 53 HE1 TYR 53 9.407 -1.476 -1.962 193 HE2 TYR 53 HE2 TYR 53 8.257 -5.390 -3.350 194 HH TYR 53 HH TYR 53 10.752 -2.819 -3.238 195 H SER 54 H SER 54 2.570 -4.127 -2.375 196 HA SER 54 HA SER 54 3.846 -4.722 -4.882 197 HB2 SER 54 HB2 SER 54 1.177 -5.445 -3.627 198 HB3 SER 54 HB3 SER 54 1.626 -5.997 -5.243 199 HG SER 54 HG SER 54 2.288 -7.528 -3.697 200 H ALA 55 H ALA 55 3.099 -4.472 -6.990 201 HA ALA 55 HA ALA 55 2.141 -1.973 -7.863 202 HB1 ALA 55 HB1 ALA 55 3.430 -3.648 -9.209 203 HB2 ALA 55 HB2 ALA 55 1.969 -4.651 -9.316 204 HB3 ALA 55 HB3 ALA 55 1.997 -3.035 -10.053 205 H LYS 56 H LYS 56 0.274 -4.667 -6.739 206 HA LYS 56 HA LYS 56 -2.355 -4.141 -7.703 207 HB2 LYS 56 HB2 LYS 56 -1.394 -5.145 -4.988 208 HB3 LYS 56 HB3 LYS 56 -3.046 -5.259 -5.561 209 HG2 LYS 56 HG2 LYS 56 -0.660 -6.675 -6.846 210 HG3 LYS 56 HG3 LYS 56 -1.790 -7.371 -5.701 211 HD2 LYS 56 HD2 LYS 56 -2.757 -8.138 -7.632 212 HD3 LYS 56 HD3 LYS 56 -3.646 -6.642 -7.421 213 HE2 LYS 56 HE2 LYS 56 -3.116 -6.512 -9.662 214 HE3 LYS 56 HE3 LYS 56 -1.775 -5.597 -8.969 215 HZ1 LYS 56 HZ1 LYS 56 -0.449 -7.692 -9.094 216 HZ2 LYS 56 HZ2 LYS 56 -0.957 -7.201 -10.567 217 HZ3 LYS 56 HZ3 LYS 56 -1.701 -8.442 -9.824 218 H LEU 57 H LEU 57 -0.475 -2.278 -5.403 219 HA LEU 57 HA LEU 57 -2.864 -0.581 -4.756 220 HB2 LEU 57 HB2 LEU 57 -0.636 -1.736 -3.197 221 HB3 LEU 57 HB3 LEU 57 -0.723 -0.004 -2.997 222 HG LEU 57 HG LEU 57 -1.910 -1.100 -1.251 223 HD11 LEU 57 HD11 LEU 57 -3.664 0.362 -1.173 224 HD12 LEU 57 HD12 LEU 57 -4.211 0.003 -2.830 225 HD13 LEU 57 HD13 LEU 57 -2.814 1.064 -2.536 226 HD21 LEU 57 HD21 LEU 57 -3.796 -2.267 -3.328 227 HD22 LEU 57 HD22 LEU 57 -3.794 -2.551 -1.577 228 HD23 LEU 57 HD23 LEU 57 -2.461 -3.172 -2.572 229 H ASP 58 H ASP 58 0.652 -0.458 -5.419 230 HA ASP 58 HA ASP 58 0.506 2.459 -5.884 231 HB2 ASP 58 HB2 ASP 58 2.213 1.419 -4.421 232 HB3 ASP 58 HB3 ASP 58 2.901 0.583 -5.812 233 H ARG 59 H ARG 59 -0.525 2.717 -7.816 234 HA ARG 59 HA ARG 59 -0.367 1.258 -10.172 235 HB2 ARG 59 HB2 ARG 59 -1.292 3.197 -11.289 236 HB3 ARG 59 HB3 ARG 59 -2.008 3.039 -9.687 237 HG2 ARG 59 HG2 ARG 59 -0.415 4.836 -8.854 238 HG3 ARG 59 HG3 ARG 59 0.196 4.994 -10.505 239 HD2 ARG 59 HD2 ARG 59 -1.336 6.751 -10.186 240 HD3 ARG 59 HD3 ARG 59 -2.100 5.581 -11.277 241 HE ARG 59 HE ARG 59 -2.832 5.061 -8.528 242 HH11 ARG 59 HH11 ARG 59 -3.557 7.332 -11.092 243 HH12 ARG 59 HH12 ARG 59 -5.139 7.692 -10.458 244 HH21 ARG 59 HH21 ARG 59 -4.876 5.529 -7.792 245 HH22 ARG 59 HH22 ARG 59 -5.872 6.668 -8.656 246 H ASP 60 H ASP 60 1.911 3.687 -9.129 247 HA ASP 60 HA ASP 60 3.457 3.705 -11.610 248 HB2 ASP 60 HB2 ASP 60 4.869 5.312 -10.299 249 HB3 ASP 60 HB3 ASP 60 3.185 5.766 -10.485 250 H HIS 61 H HIS 61 3.364 1.592 -9.020 251 HA HIS 61 HA HIS 61 4.836 0.425 -7.775 252 HB2 HIS 61 HB2 HIS 61 3.948 -0.938 -9.667 253 HB3 HIS 61 HB3 HIS 61 5.463 -0.675 -10.526 254 HD1 HIS 61 HD1 HIS 61 5.015 -1.696 -6.757 255 HD2 HIS 61 HD2 HIS 61 6.582 -3.033 -10.449 256 HE1 HIS 61 HE1 HIS 61 6.275 -3.883 -6.263 257 HE2 HIS 61 HE2 HIS 61 7.208 -4.704 -8.522 258 H ASP 62 H ASP 62 6.047 2.609 -7.548 259 HA ASP 62 HA ASP 62 8.881 2.439 -8.415 260 HB2 ASP 62 HB2 ASP 62 9.138 4.658 -7.590 261 HB3 ASP 62 HB3 ASP 62 7.684 4.582 -8.574 262 H GLY 63 H GLY 63 7.389 0.765 -6.158 263 HA2 GLY 63 HA2 GLY 63 8.232 -0.482 -4.407 264 HA3 GLY 63 HA3 GLY 63 9.754 0.408 -4.494 265 H VAL 64 H VAL 64 7.009 2.485 -4.200 266 HA VAL 64 HA VAL 64 7.000 2.426 -1.220 267 HB VAL 64 HB VAL 64 7.166 5.064 -2.719 268 HG11 VAL 64 HG11 VAL 64 7.626 5.953 -0.476 269 HG12 VAL 64 HG12 VAL 64 6.110 5.045 -0.445 270 HG13 VAL 64 HG13 VAL 64 7.586 4.314 0.213 271 HG21 VAL 64 HG21 VAL 64 9.314 4.011 -3.089 272 HG22 VAL 64 HG22 VAL 64 9.463 5.311 -1.904 273 HG23 VAL 64 HG23 VAL 64 9.450 3.614 -1.356 274 H ALA 65 H ALA 65 4.984 2.355 -0.533 275 HA ALA 65 HA ALA 65 2.825 3.346 -2.328 276 HB1 ALA 65 HB1 ALA 65 3.081 0.896 -0.597 277 HB2 ALA 65 HB2 ALA 65 1.464 1.606 -0.877 278 HB3 ALA 65 HB3 ALA 65 2.476 1.082 -2.228 279 H CYS 66 H CYS 66 1.244 4.585 -1.621 280 HA CYS 66 HA CYS 66 0.413 6.414 -0.649 281 HB2 CYS 66 HB2 CYS 66 0.473 4.917 1.951 282 HB3 CYS 66 HB3 CYS 66 -0.742 6.024 1.331 283 H GLU 67 H GLU 67 2.950 6.889 -1.075 284 HA GLU 67 HA GLU 67 4.580 7.844 1.077 285 HB2 GLU 67 HB2 GLU 67 5.850 8.923 -0.747 286 HB3 GLU 67 HB3 GLU 67 5.538 7.224 -1.025 287 HG2 GLU 67 HG2 GLU 67 3.476 8.930 -2.282 288 HG3 GLU 67 HG3 GLU 67 5.093 9.343 -2.805 289 H LEU 68 H LEU 68 5.168 9.989 1.703 290 HA LEU 68 HA LEU 68 3.125 12.135 1.144 291 HB2 LEU 68 HB2 LEU 68 4.692 11.490 3.667 292 HB3 LEU 68 HB3 LEU 68 4.060 13.092 3.344 293 HG LEU 68 HG LEU 68 1.740 12.034 3.054 294 HD11 LEU 68 HD11 LEU 68 1.411 9.954 4.399 295 HD12 LEU 68 HD12 LEU 68 3.180 9.784 4.513 296 HD13 LEU 68 HD13 LEU 68 2.361 9.659 2.942 297 HD21 LEU 68 HD21 LEU 68 1.369 12.035 5.492 298 HD22 LEU 68 HD22 LEU 68 2.389 13.394 4.990 299 HD23 LEU 68 HD23 LEU 68 3.131 11.971 5.765 300 H LYS 69 H LYS 69 6.638 11.565 1.350 301 HA LYS 69 HA LYS 69 7.470 14.271 0.876 302 HB2 LYS 69 HB2 LYS 69 8.684 11.547 0.323 303 HB3 LYS 69 HB3 LYS 69 9.472 13.002 -0.262 304 HG2 LYS 69 HG2 LYS 69 8.805 12.538 2.681 305 HG3 LYS 69 HG3 LYS 69 10.340 12.133 1.909 306 HD2 LYS 69 HD2 LYS 69 10.395 14.627 1.142 307 HD3 LYS 69 HD3 LYS 69 9.166 14.891 2.395 308 HE2 LYS 69 HE2 LYS 69 10.678 14.052 4.122 309 HE3 LYS 69 HE3 LYS 69 11.834 13.507 2.902 310 HZ1 LYS 69 HZ1 LYS 69 12.568 15.593 3.824 311 HZ2 LYS 69 HZ2 LYS 69 11.163 16.342 3.469 312 HZ3 LYS 69 HZ3 LYS 69 12.160 15.852 2.270 313 H ASN 70 H ASN 70 7.101 15.532 -0.731 314 HA ASN 70 HA ASN 70 6.053 14.650 -3.325 315 HB2 ASN 70 HB2 ASN 70 5.209 16.628 -1.929 316 HB3 ASN 70 HB3 ASN 70 6.706 17.460 -2.345 317 HD21 ASN 70 HD21 ASN 70 5.687 19.137 -3.505 318 HD22 ASN 70 HD22 ASN 70 4.814 18.840 -5.001 Start of MODEL 5 1 H1 GLY 24 H1 GLY 24 -15.700 -20.584 -3.337 2 H2 GLY 24 H2 GLY 24 -16.288 -19.470 -4.383 3 H3 GLY 24 H3 GLY 24 -14.866 -20.216 -4.700 4 HA2 GLY 24 HA2 GLY 24 -14.464 -17.968 -3.923 5 HA3 GLY 24 HA3 GLY 24 -15.379 -18.367 -2.459 6 H ALA 25 H ALA 25 -12.293 -18.260 -3.842 7 HA ALA 25 HA ALA 25 -10.955 -20.313 -2.282 8 HB1 ALA 25 HB1 ALA 25 -8.930 -19.207 -3.115 9 HB2 ALA 25 HB2 ALA 25 -10.098 -19.394 -4.431 10 HB3 ALA 25 HB3 ALA 25 -9.880 -17.807 -3.655 11 H SER 26 H SER 26 -9.103 -19.625 -0.801 12 HA SER 26 HA SER 26 -9.985 -17.615 1.230 13 HB2 SER 26 HB2 SER 26 -8.467 -18.870 2.756 14 HB3 SER 26 HB3 SER 26 -9.825 -19.820 2.147 15 HG SER 26 HG SER 26 -7.107 -19.929 1.270 16 H GLU 27 H GLU 27 -8.349 -16.327 2.264 17 HA GLU 27 HA GLU 27 -5.708 -16.074 1.007 18 HB2 GLU 27 HB2 GLU 27 -5.898 -13.684 0.618 19 HB3 GLU 27 HB3 GLU 27 -6.986 -14.584 -0.414 20 HG2 GLU 27 HG2 GLU 27 -7.881 -13.186 2.151 21 HG3 GLU 27 HG3 GLU 27 -7.845 -12.405 0.582 22 H GLU 28 H GLU 28 -4.245 -14.730 2.176 23 HA GLU 28 HA GLU 28 -4.910 -14.130 5.010 24 HB2 GLU 28 HB2 GLU 28 -2.810 -15.338 5.699 25 HB3 GLU 28 HB3 GLU 28 -4.155 -16.328 5.187 26 HG2 GLU 28 HG2 GLU 28 -2.087 -17.264 4.382 27 HG3 GLU 28 HG3 GLU 28 -3.114 -16.808 3.040 28 H ASN 29 H ASN 29 -4.311 -12.527 2.540 29 HA ASN 29 HA ASN 29 -2.060 -10.876 3.606 30 HB2 ASN 29 HB2 ASN 29 -1.645 -12.241 1.437 31 HB3 ASN 29 HB3 ASN 29 -2.786 -11.144 0.661 32 HD21 ASN 29 HD21 ASN 29 -2.134 -8.775 0.545 33 HD22 ASN 29 HD22 ASN 29 -0.416 -8.439 0.642 34 H ILE 30 H ILE 30 -2.336 -8.645 3.505 35 HA ILE 30 HA ILE 30 -5.037 -7.612 3.658 36 HB ILE 30 HB ILE 30 -2.276 -6.369 3.696 37 HG12 ILE 30 HG12 ILE 30 -4.396 -6.604 5.885 38 HG13 ILE 30 HG13 ILE 30 -3.165 -7.831 5.629 39 HG21 ILE 30 HG21 ILE 30 -3.725 -4.608 2.811 40 HG22 ILE 30 HG22 ILE 30 -4.949 -4.935 4.068 41 HG23 ILE 30 HG23 ILE 30 -3.376 -4.250 4.490 42 HD11 ILE 30 HD11 ILE 30 -2.555 -4.949 6.386 43 HD12 ILE 30 HD12 ILE 30 -2.541 -6.357 7.455 44 HD13 ILE 30 HD13 ILE 30 -1.377 -6.263 6.130 45 H HIS 31 H HIS 31 -6.135 -6.246 2.332 46 HA HIS 31 HA HIS 31 -5.149 -5.679 -0.395 47 HB2 HIS 31 HB2 HIS 31 -7.190 -6.613 -1.426 48 HB3 HIS 31 HB3 HIS 31 -6.174 -7.829 -0.678 49 HD1 HIS 31 HD1 HIS 31 -9.639 -6.263 -0.316 50 HD2 HIS 31 HD2 HIS 31 -7.134 -9.107 1.538 51 HE1 HIS 31 HE1 HIS 31 -11.132 -7.584 1.317 52 HE2 HIS 31 HE2 HIS 31 -9.591 -9.306 2.456 53 H PHE 32 H PHE 32 -5.146 -3.495 -0.132 54 HA PHE 32 HA PHE 32 -7.552 -2.069 0.882 55 HB2 PHE 32 HB2 PHE 32 -4.836 -1.133 -0.073 56 HB3 PHE 32 HB3 PHE 32 -6.133 -0.041 0.371 57 HD1 PHE 32 HD1 PHE 32 -3.280 -1.806 1.581 58 HD2 PHE 32 HD2 PHE 32 -7.165 -0.345 2.752 59 HE1 PHE 32 HE1 PHE 32 -2.578 -1.837 3.960 60 HE2 PHE 32 HE2 PHE 32 -6.466 -0.393 5.135 61 HZ PHE 32 HZ PHE 32 -4.183 -1.165 5.744 62 H SER 33 H SER 33 -9.054 -1.133 -0.395 63 HA SER 33 HA SER 33 -9.136 -1.542 -3.258 64 HB2 SER 33 HB2 SER 33 -11.134 -1.347 -1.796 65 HB3 SER 33 HB3 SER 33 -10.739 0.352 -1.495 66 HG SER 33 HG SER 33 -11.476 -0.880 -3.965 67 H SER 34 H SER 34 -8.038 1.139 -1.221 68 HA SER 34 HA SER 34 -6.514 2.340 -3.399 69 HB2 SER 34 HB2 SER 34 -8.713 3.365 -3.803 70 HB3 SER 34 HB3 SER 34 -8.825 3.860 -2.106 71 HG SER 34 HG SER 34 -8.010 5.419 -3.808 72 H CYS 35 H CYS 35 -4.964 3.879 -2.616 73 HA CYS 35 HA CYS 35 -4.001 3.691 0.052 74 HB2 CYS 35 HB2 CYS 35 -3.553 5.631 -2.212 75 HB3 CYS 35 HB3 CYS 35 -2.926 5.999 -0.610 76 H LYS 36 H LYS 36 -6.638 5.687 -1.172 77 HA LYS 36 HA LYS 36 -6.847 7.629 0.923 78 HB2 LYS 36 HB2 LYS 36 -8.876 6.171 -0.804 79 HB3 LYS 36 HB3 LYS 36 -9.367 7.389 0.377 80 HG2 LYS 36 HG2 LYS 36 -8.276 9.147 -0.725 81 HG3 LYS 36 HG3 LYS 36 -7.241 8.073 -1.677 82 HD2 LYS 36 HD2 LYS 36 -9.051 7.335 -3.045 83 HD3 LYS 36 HD3 LYS 36 -10.270 8.109 -2.031 84 HE2 LYS 36 HE2 LYS 36 -8.080 9.728 -3.388 85 HE3 LYS 36 HE3 LYS 36 -9.517 9.229 -4.284 86 HZ1 LYS 36 HZ1 LYS 36 -9.813 11.425 -3.296 87 HZ2 LYS 36 HZ2 LYS 36 -9.593 10.841 -1.789 88 HZ3 LYS 36 HZ3 LYS 36 -10.894 10.382 -2.667 89 H GLU 37 H GLU 37 -7.905 4.240 0.880 90 HA GLU 37 HA GLU 37 -9.122 4.327 3.536 91 HB2 GLU 37 HB2 GLU 37 -9.806 2.825 1.663 92 HB3 GLU 37 HB3 GLU 37 -8.262 1.977 1.796 93 HG2 GLU 37 HG2 GLU 37 -8.832 1.193 4.036 94 HG3 GLU 37 HG3 GLU 37 -10.277 2.213 4.064 95 H ALA 38 H ALA 38 -5.946 3.386 2.215 96 HA ALA 38 HA ALA 38 -4.849 2.312 4.641 97 HB1 ALA 38 HB1 ALA 38 -3.408 3.601 2.286 98 HB2 ALA 38 HB2 ALA 38 -2.750 2.413 3.418 99 HB3 ALA 38 HB3 ALA 38 -4.023 1.931 2.294 100 H TRP 39 H TRP 39 -4.525 5.606 3.167 101 HA TRP 39 HA TRP 39 -3.057 6.811 5.264 102 HB2 TRP 39 HB2 TRP 39 -4.962 7.902 3.173 103 HB3 TRP 39 HB3 TRP 39 -4.189 8.953 4.339 104 HD1 TRP 39 HD1 TRP 39 -1.266 7.934 4.367 105 HE1 TRP 39 HE1 TRP 39 0.283 8.299 2.343 106 HE3 TRP 39 HE3 TRP 39 -4.809 8.569 0.733 107 HZ2 TRP 39 HZ2 TRP 39 0.016 8.945 -0.445 108 HZ3 TRP 39 HZ3 TRP 39 -4.132 9.037 -1.618 109 HH2 TRP 39 HH2 TRP 39 -1.726 9.229 -2.213 110 H ALA 40 H ALA 40 -6.614 6.417 5.001 111 HA ALA 40 HA ALA 40 -7.296 7.955 7.299 112 HB1 ALA 40 HB1 ALA 40 -8.686 5.514 6.116 113 HB2 ALA 40 HB2 ALA 40 -9.407 6.711 7.211 114 HB3 ALA 40 HB3 ALA 40 -8.902 7.200 5.584 115 H ASN 41 H ASN 41 -5.819 4.794 7.109 116 HA ASN 41 HA ASN 41 -6.134 4.312 10.037 117 HB2 ASN 41 HB2 ASN 41 -5.269 2.559 7.692 118 HB3 ASN 41 HB3 ASN 41 -5.133 2.063 9.375 119 HD21 ASN 41 HD21 ASN 41 -7.450 2.707 6.756 120 HD22 ASN 41 HD22 ASN 41 -8.811 2.039 7.643 121 H GLY 42 H GLY 42 -4.095 6.140 8.251 122 HA2 GLY 42 HA2 GLY 42 -2.079 7.098 8.809 123 HA3 GLY 42 HA3 GLY 42 -1.924 6.006 10.187 124 H TYR 43 H TYR 43 -2.436 4.398 7.138 125 HA TYR 43 HA TYR 43 0.303 3.303 7.170 126 HB2 TYR 43 HB2 TYR 43 -2.161 2.747 5.515 127 HB3 TYR 43 HB3 TYR 43 -0.592 2.095 5.110 128 HD1 TYR 43 HD1 TYR 43 -1.110 -0.177 5.231 129 HD2 TYR 43 HD2 TYR 43 -1.968 2.336 8.640 130 HE1 TYR 43 HE1 TYR 43 -1.655 -2.184 6.605 131 HE2 TYR 43 HE2 TYR 43 -2.482 0.340 9.989 132 HH TYR 43 HH TYR 43 -2.641 -1.949 10.032 133 H SER 44 H SER 44 1.689 4.904 6.609 134 HA SER 44 HA SER 44 1.646 5.874 3.796 135 HB2 SER 44 HB2 SER 44 2.473 8.054 4.584 136 HB3 SER 44 HB3 SER 44 0.840 7.711 5.176 137 HG SER 44 HG SER 44 2.113 8.525 6.864 138 H ASP 45 H ASP 45 3.749 6.528 3.004 139 HA ASP 45 HA ASP 45 5.818 5.818 2.375 140 HB2 ASP 45 HB2 ASP 45 6.411 7.481 4.061 141 HB3 ASP 45 HB3 ASP 45 6.437 6.242 5.316 142 H ILE 46 H ILE 46 4.206 3.706 2.393 143 HA ILE 46 HA ILE 46 5.064 1.423 3.932 144 HB ILE 46 HB ILE 46 3.762 1.625 1.227 145 HG12 ILE 46 HG12 ILE 46 2.346 0.989 3.837 146 HG13 ILE 46 HG13 ILE 46 2.420 2.618 3.169 147 HG21 ILE 46 HG21 ILE 46 4.865 -0.715 2.361 148 HG22 ILE 46 HG22 ILE 46 3.150 -0.848 2.698 149 HG23 ILE 46 HG23 ILE 46 3.712 -0.604 1.040 150 HD11 ILE 46 HD11 ILE 46 0.324 1.312 2.576 151 HD12 ILE 46 HD12 ILE 46 1.206 2.016 1.207 152 HD13 ILE 46 HD13 ILE 46 1.336 0.288 1.529 153 H HIS 47 H HIS 47 7.029 0.576 3.867 154 HA HIS 47 HA HIS 47 8.715 0.541 1.400 155 HB2 HIS 47 HB2 HIS 47 9.277 -0.084 4.335 156 HB3 HIS 47 HB3 HIS 47 10.453 -0.330 3.057 157 HD1 HIS 47 HD1 HIS 47 11.101 1.672 5.380 158 HD2 HIS 47 HD2 HIS 47 9.379 2.679 1.656 159 HE1 HIS 47 HE1 HIS 47 11.612 4.168 4.983 160 HE2 HIS 47 HE2 HIS 47 10.498 4.778 2.749 161 H GLU 48 H GLU 48 10.054 -1.530 1.204 162 HA GLU 48 HA GLU 48 8.508 -3.732 0.446 163 HB2 GLU 48 HB2 GLU 48 10.680 -5.019 0.617 164 HB3 GLU 48 HB3 GLU 48 10.703 -3.566 -0.380 165 HG2 GLU 48 HG2 GLU 48 11.866 -2.298 1.333 166 HG3 GLU 48 HG3 GLU 48 11.709 -3.620 2.489 167 H GLY 49 H GLY 49 7.653 -5.486 1.328 168 HA2 GLY 49 HA2 GLY 49 7.279 -7.196 2.877 169 HA3 GLY 49 HA3 GLY 49 8.269 -6.366 4.073 170 H GLU 50 H GLU 50 6.552 -3.801 3.526 171 HA GLU 50 HA GLU 50 4.373 -4.400 5.423 172 HB2 GLU 50 HB2 GLU 50 5.468 -1.923 4.104 173 HB3 GLU 50 HB3 GLU 50 3.861 -1.873 4.785 174 HG2 GLU 50 HG2 GLU 50 5.928 -3.024 6.595 175 HG3 GLU 50 HG3 GLU 50 6.209 -1.354 6.111 176 HA PRO 51 HA PRO 51 1.227 -5.232 2.485 177 HB2 PRO 51 HB2 PRO 51 -1.034 -4.199 3.630 178 HB3 PRO 51 HB3 PRO 51 -0.151 -5.624 4.273 179 HG2 PRO 51 HG2 PRO 51 0.101 -2.727 5.155 180 HG3 PRO 51 HG3 PRO 51 -0.168 -4.165 6.192 181 HD2 PRO 51 HD2 PRO 51 2.292 -3.146 5.830 182 HD3 PRO 51 HD3 PRO 51 2.053 -4.920 5.867 183 H GLY 52 H GLY 52 0.819 -4.372 0.565 184 HA2 GLY 52 HA2 GLY 52 -0.242 -2.809 -0.881 185 HA3 GLY 52 HA3 GLY 52 0.048 -1.504 0.268 186 H TYR 53 H TYR 53 3.004 -3.021 0.206 187 HA TYR 53 HA TYR 53 4.335 -1.167 -1.468 188 HB2 TYR 53 HB2 TYR 53 5.455 -2.398 0.269 189 HB3 TYR 53 HB3 TYR 53 5.001 -3.942 -0.427 190 HD1 TYR 53 HD1 TYR 53 6.248 -4.967 -2.219 191 HD2 TYR 53 HD2 TYR 53 7.244 -1.006 -0.819 192 HE1 TYR 53 HE1 TYR 53 8.457 -5.118 -3.369 193 HE2 TYR 53 HE2 TYR 53 9.479 -1.193 -1.927 194 HH TYR 53 HH TYR 53 10.867 -2.472 -3.224 195 H SER 54 H SER 54 2.620 -4.073 -2.303 196 HA SER 54 HA SER 54 3.879 -4.744 -4.806 197 HB2 SER 54 HB2 SER 54 1.194 -5.392 -3.538 198 HB3 SER 54 HB3 SER 54 1.630 -5.969 -5.142 199 HG SER 54 HG SER 54 3.156 -6.424 -2.764 200 H ALA 55 H ALA 55 3.153 -4.498 -6.907 201 HA ALA 55 HA ALA 55 2.160 -2.038 -7.831 202 HB1 ALA 55 HB1 ALA 55 3.459 -3.697 -9.153 203 HB2 ALA 55 HB2 ALA 55 2.045 -4.770 -9.185 204 HB3 ALA 55 HB3 ALA 55 1.984 -3.188 -9.992 205 H LYS 56 H LYS 56 0.327 -4.739 -6.636 206 HA LYS 56 HA LYS 56 -2.308 -4.283 -7.608 207 HB2 LYS 56 HB2 LYS 56 -1.321 -5.181 -4.866 208 HB3 LYS 56 HB3 LYS 56 -2.979 -5.337 -5.414 209 HG2 LYS 56 HG2 LYS 56 -0.603 -6.748 -6.726 210 HG3 LYS 56 HG3 LYS 56 -1.635 -7.423 -5.481 211 HD2 LYS 56 HD2 LYS 56 -2.646 -8.337 -7.316 212 HD3 LYS 56 HD3 LYS 56 -3.621 -6.898 -7.096 213 HE2 LYS 56 HE2 LYS 56 -3.237 -7.019 -9.408 214 HE3 LYS 56 HE3 LYS 56 -2.128 -5.763 -8.863 215 HZ1 LYS 56 HZ1 LYS 56 -1.400 -8.593 -9.424 216 HZ2 LYS 56 HZ2 LYS 56 -0.343 -7.459 -8.906 217 HZ3 LYS 56 HZ3 LYS 56 -1.043 -7.320 -10.374 218 H LEU 57 H LEU 57 -0.482 -2.408 -5.280 219 HA LEU 57 HA LEU 57 -2.860 -0.676 -4.697 220 HB2 LEU 57 HB2 LEU 57 -0.589 -1.736 -3.125 221 HB3 LEU 57 HB3 LEU 57 -0.665 0.005 -3.027 222 HG LEU 57 HG LEU 57 -1.812 -0.995 -1.183 223 HD11 LEU 57 HD11 LEU 57 -3.986 0.172 -2.953 224 HD12 LEU 57 HD12 LEU 57 -2.653 1.152 -2.301 225 HD13 LEU 57 HD13 LEU 57 -3.755 0.343 -1.202 226 HD21 LEU 57 HD21 LEU 57 -2.420 -3.120 -2.411 227 HD22 LEU 57 HD22 LEU 57 -3.780 -2.233 -3.142 228 HD23 LEU 57 HD23 LEU 57 -3.701 -2.454 -1.386 229 H ASP 58 H ASP 58 0.589 -0.657 -5.574 230 HA ASP 58 HA ASP 58 0.506 2.263 -6.002 231 HB2 ASP 58 HB2 ASP 58 2.122 1.127 -4.490 232 HB3 ASP 58 HB3 ASP 58 2.833 0.310 -5.881 233 H ARG 59 H ARG 59 -0.473 2.529 -7.968 234 HA ARG 59 HA ARG 59 -0.212 1.130 -10.335 235 HB2 ARG 59 HB2 ARG 59 -1.075 3.092 -11.462 236 HB3 ARG 59 HB3 ARG 59 -1.854 2.908 -9.891 237 HG2 ARG 59 HG2 ARG 59 -0.240 4.662 -8.977 238 HG3 ARG 59 HG3 ARG 59 0.371 4.878 -10.617 239 HD2 ARG 59 HD2 ARG 59 -1.213 6.635 -10.128 240 HD3 ARG 59 HD3 ARG 59 -1.843 5.590 -11.395 241 HE ARG 59 HE ARG 59 -3.618 5.021 -10.046 242 HH11 ARG 59 HH11 ARG 59 -1.232 6.442 -7.894 243 HH12 ARG 59 HH12 ARG 59 -2.305 6.367 -6.525 244 HH21 ARG 59 HH21 ARG 59 -4.923 4.984 -8.271 245 HH22 ARG 59 HH22 ARG 59 -4.344 5.580 -6.743 246 H ASP 60 H ASP 60 2.111 3.442 -9.150 247 HA ASP 60 HA ASP 60 3.694 3.415 -11.643 248 HB2 ASP 60 HB2 ASP 60 5.046 5.106 -10.560 249 HB3 ASP 60 HB3 ASP 60 3.340 5.511 -10.451 250 H HIS 61 H HIS 61 3.526 1.456 -8.920 251 HA HIS 61 HA HIS 61 4.958 0.377 -7.554 252 HB2 HIS 61 HB2 HIS 61 4.105 -1.091 -9.404 253 HB3 HIS 61 HB3 HIS 61 5.673 -0.931 -10.189 254 HD1 HIS 61 HD1 HIS 61 6.551 -3.403 -9.836 255 HD2 HIS 61 HD2 HIS 61 5.093 -1.533 -6.338 256 HE1 HIS 61 HE1 HIS 61 7.147 -4.958 -7.870 257 HE2 HIS 61 HE2 HIS 61 6.289 -3.780 -5.739 258 H ASP 62 H ASP 62 6.242 2.710 -7.751 259 HA ASP 62 HA ASP 62 9.062 2.371 -8.395 260 HB2 ASP 62 HB2 ASP 62 9.348 4.610 -7.573 261 HB3 ASP 62 HB3 ASP 62 7.931 4.527 -8.605 262 H GLY 63 H GLY 63 7.551 0.812 -6.018 263 HA2 GLY 63 HA2 GLY 63 8.422 -0.346 -4.212 264 HA3 GLY 63 HA3 GLY 63 9.932 0.563 -4.326 265 H VAL 64 H VAL 64 7.184 2.623 -4.241 266 HA VAL 64 HA VAL 64 7.056 2.713 -1.265 267 HB VAL 64 HB VAL 64 7.068 5.282 -2.891 268 HG11 VAL 64 HG11 VAL 64 7.488 4.650 0.066 269 HG12 VAL 64 HG12 VAL 64 7.483 6.268 -0.663 270 HG13 VAL 64 HG13 VAL 64 6.001 5.304 -0.650 271 HG21 VAL 64 HG21 VAL 64 9.292 4.392 -3.232 272 HG22 VAL 64 HG22 VAL 64 9.355 5.712 -2.062 273 HG23 VAL 64 HG23 VAL 64 9.453 4.025 -1.495 274 H ALA 65 H ALA 65 5.019 2.569 -0.621 275 HA ALA 65 HA ALA 65 2.870 3.431 -2.508 276 HB1 ALA 65 HB1 ALA 65 2.853 1.058 -2.399 277 HB2 ALA 65 HB2 ALA 65 3.009 1.028 -0.657 278 HB3 ALA 65 HB3 ALA 65 1.498 1.611 -1.391 279 H CYS 66 H CYS 66 1.144 4.474 -1.789 280 HA CYS 66 HA CYS 66 0.223 6.256 -0.807 281 HB2 CYS 66 HB2 CYS 66 0.446 4.744 1.788 282 HB3 CYS 66 HB3 CYS 66 -0.813 5.855 1.268 283 H GLU 67 H GLU 67 2.796 6.727 -1.328 284 HA GLU 67 HA GLU 67 4.514 7.689 0.655 285 HB2 GLU 67 HB2 GLU 67 5.360 9.217 -1.213 286 HB3 GLU 67 HB3 GLU 67 5.482 7.488 -1.412 287 HG2 GLU 67 HG2 GLU 67 3.096 8.855 -2.644 288 HG3 GLU 67 HG3 GLU 67 4.677 9.101 -3.358 289 H LEU 68 H LEU 68 4.664 9.371 1.976 290 HA LEU 68 HA LEU 68 2.930 11.764 1.674 291 HB2 LEU 68 HB2 LEU 68 1.888 9.751 3.007 292 HB3 LEU 68 HB3 LEU 68 3.031 10.208 4.266 293 HG LEU 68 HG LEU 68 1.958 12.559 4.185 294 HD11 LEU 68 HD11 LEU 68 -0.298 12.728 3.288 295 HD12 LEU 68 HD12 LEU 68 -0.212 11.071 2.660 296 HD13 LEU 68 HD13 LEU 68 0.823 12.341 1.978 297 HD21 LEU 68 HD21 LEU 68 0.188 10.214 4.968 298 HD22 LEU 68 HD22 LEU 68 0.056 11.887 5.557 299 HD23 LEU 68 HD23 LEU 68 1.484 10.925 5.961 300 H LYS 69 H LYS 69 5.815 11.426 1.464 301 HA LYS 69 HA LYS 69 7.809 12.371 2.075 302 HB2 LYS 69 HB2 LYS 69 6.103 14.629 3.195 303 HB3 LYS 69 HB3 LYS 69 7.779 14.702 2.695 304 HG2 LYS 69 HG2 LYS 69 6.738 15.723 0.973 305 HG3 LYS 69 HG3 LYS 69 6.991 14.107 0.323 306 HD2 LYS 69 HD2 LYS 69 4.668 13.553 0.538 307 HD3 LYS 69 HD3 LYS 69 4.345 14.906 1.631 308 HE2 LYS 69 HE2 LYS 69 5.185 15.213 -1.286 309 HE3 LYS 69 HE3 LYS 69 3.504 15.143 -0.752 310 HZ1 LYS 69 HZ1 LYS 69 4.226 17.435 -0.954 311 HZ2 LYS 69 HZ2 LYS 69 5.457 17.216 0.091 312 HZ3 LYS 69 HZ3 LYS 69 3.911 17.123 0.614 313 H ASN 70 H ASN 70 6.814 10.532 4.063 314 HA ASN 70 HA ASN 70 7.645 11.663 6.683 315 HB2 ASN 70 HB2 ASN 70 5.461 10.497 6.459 316 HB3 ASN 70 HB3 ASN 70 6.294 9.017 5.998 317 HD21 ASN 70 HD21 ASN 70 7.722 8.030 7.608 318 HD22 ASN 70 HD22 ASN 70 7.325 8.239 9.319 Start of MODEL 6 1 H1 GLY 24 H1 GLY 24 5.485 -18.788 4.165 2 H2 GLY 24 H2 GLY 24 4.137 -18.534 3.272 3 H3 GLY 24 H3 GLY 24 4.031 -18.651 4.902 4 HA2 GLY 24 HA2 GLY 24 4.854 -20.831 3.087 5 HA3 GLY 24 HA3 GLY 24 4.713 -20.970 4.846 6 H ALA 25 H ALA 25 2.546 -20.645 5.798 7 HA ALA 25 HA ALA 25 0.216 -20.955 3.983 8 HB1 ALA 25 HB1 ALA 25 0.979 -23.231 4.634 9 HB2 ALA 25 HB2 ALA 25 0.840 -22.779 6.349 10 HB3 ALA 25 HB3 ALA 25 -0.606 -22.847 5.319 11 H SER 26 H SER 26 -1.828 -20.996 5.497 12 HA SER 26 HA SER 26 -3.295 -19.535 6.366 13 HB2 SER 26 HB2 SER 26 -3.234 -19.257 8.752 14 HB3 SER 26 HB3 SER 26 -2.745 -20.878 8.276 15 HG SER 26 HG SER 26 -1.128 -18.753 9.251 16 H GLU 27 H GLU 27 -1.432 -18.171 4.737 17 HA GLU 27 HA GLU 27 -0.678 -15.632 5.840 18 HB2 GLU 27 HB2 GLU 27 0.011 -16.999 3.608 19 HB3 GLU 27 HB3 GLU 27 -1.248 -15.998 2.902 20 HG2 GLU 27 HG2 GLU 27 0.838 -14.887 2.565 21 HG3 GLU 27 HG3 GLU 27 -0.020 -13.963 3.791 22 H GLU 28 H GLU 28 -1.555 -13.528 5.292 23 HA GLU 28 HA GLU 28 -4.520 -13.452 4.829 24 HB2 GLU 28 HB2 GLU 28 -2.894 -12.015 6.953 25 HB3 GLU 28 HB3 GLU 28 -4.545 -11.575 6.489 26 HG2 GLU 28 HG2 GLU 28 -5.353 -13.823 7.099 27 HG3 GLU 28 HG3 GLU 28 -3.717 -14.305 7.557 28 H ASN 29 H ASN 29 -4.059 -13.050 2.648 29 HA ASN 29 HA ASN 29 -2.530 -10.876 1.634 30 HB2 ASN 29 HB2 ASN 29 -4.978 -12.207 0.395 31 HB3 ASN 29 HB3 ASN 29 -3.723 -11.306 -0.453 32 HD21 ASN 29 HD21 ASN 29 -1.685 -12.381 -0.880 33 HD22 ASN 29 HD22 ASN 29 -1.531 -14.108 -0.605 34 H ILE 30 H ILE 30 -2.863 -8.809 2.293 35 HA ILE 30 HA ILE 30 -5.566 -7.709 2.757 36 HB ILE 30 HB ILE 30 -2.752 -6.644 3.065 37 HG12 ILE 30 HG12 ILE 30 -4.974 -6.870 5.138 38 HG13 ILE 30 HG13 ILE 30 -3.930 -8.241 4.772 39 HG21 ILE 30 HG21 ILE 30 -5.362 -5.096 3.445 40 HG22 ILE 30 HG22 ILE 30 -3.783 -4.559 4.032 41 HG23 ILE 30 HG23 ILE 30 -4.048 -4.711 2.303 42 HD11 ILE 30 HD11 ILE 30 -3.175 -7.058 6.764 43 HD12 ILE 30 HD12 ILE 30 -1.954 -6.994 5.488 44 HD13 ILE 30 HD13 ILE 30 -2.961 -5.562 5.842 45 H HIS 31 H HIS 31 -6.670 -6.402 1.477 46 HA HIS 31 HA HIS 31 -5.527 -5.453 -1.111 47 HB2 HIS 31 HB2 HIS 31 -8.270 -6.742 -0.818 48 HB3 HIS 31 HB3 HIS 31 -7.526 -6.160 -2.296 49 HD1 HIS 31 HD1 HIS 31 -5.472 -7.768 -3.275 50 HD2 HIS 31 HD2 HIS 31 -7.832 -9.201 -0.081 51 HE1 HIS 31 HE1 HIS 31 -5.144 -10.326 -3.217 52 HE2 HIS 31 HE2 HIS 31 -6.600 -11.187 -1.269 53 H PHE 32 H PHE 32 -5.488 -3.289 -0.666 54 HA PHE 32 HA PHE 32 -7.853 -1.915 0.512 55 HB2 PHE 32 HB2 PHE 32 -5.096 -0.996 -0.320 56 HB3 PHE 32 HB3 PHE 32 -6.362 0.123 0.142 57 HD1 PHE 32 HD1 PHE 32 -3.705 -1.995 1.369 58 HD2 PHE 32 HD2 PHE 32 -7.411 -0.073 2.463 59 HE1 PHE 32 HE1 PHE 32 -3.103 -2.189 3.772 60 HE2 PHE 32 HE2 PHE 32 -6.798 -0.260 4.862 61 HZ PHE 32 HZ PHE 32 -4.647 -1.319 5.518 62 H SER 33 H SER 33 -9.351 -0.884 -0.688 63 HA SER 33 HA SER 33 -9.493 -1.047 -3.521 64 HB2 SER 33 HB2 SER 33 -10.959 0.872 -1.672 65 HB3 SER 33 HB3 SER 33 -11.452 0.383 -3.306 66 HG SER 33 HG SER 33 -12.532 -0.819 -1.650 67 H SER 34 H SER 34 -8.124 1.462 -1.452 68 HA SER 34 HA SER 34 -6.656 2.658 -3.641 69 HB2 SER 34 HB2 SER 34 -8.858 3.828 -3.913 70 HB3 SER 34 HB3 SER 34 -8.776 4.336 -2.220 71 HG SER 34 HG SER 34 -7.280 5.201 -4.440 72 H CYS 35 H CYS 35 -4.934 3.988 -2.847 73 HA CYS 35 HA CYS 35 -4.041 3.836 -0.163 74 HB2 CYS 35 HB2 CYS 35 -3.428 5.671 -2.475 75 HB3 CYS 35 HB3 CYS 35 -2.807 6.053 -0.877 76 H LYS 36 H LYS 36 -6.505 6.007 -1.484 77 HA LYS 36 HA LYS 36 -6.567 7.954 0.621 78 HB2 LYS 36 HB2 LYS 36 -8.671 6.772 -1.217 79 HB3 LYS 36 HB3 LYS 36 -9.113 7.943 0.017 80 HG2 LYS 36 HG2 LYS 36 -6.960 8.514 -2.064 81 HG3 LYS 36 HG3 LYS 36 -8.675 8.865 -2.307 82 HD2 LYS 36 HD2 LYS 36 -8.677 10.302 -0.271 83 HD3 LYS 36 HD3 LYS 36 -6.932 10.032 -0.087 84 HE2 LYS 36 HE2 LYS 36 -6.519 11.040 -2.298 85 HE3 LYS 36 HE3 LYS 36 -8.258 11.245 -2.550 86 HZ1 LYS 36 HZ1 LYS 36 -7.239 13.299 -1.758 87 HZ2 LYS 36 HZ2 LYS 36 -6.686 12.576 -0.405 88 HZ3 LYS 36 HZ3 LYS 36 -8.294 12.758 -0.640 89 H GLU 37 H GLU 37 -7.858 4.653 0.576 90 HA GLU 37 HA GLU 37 -9.120 4.921 3.206 91 HB2 GLU 37 HB2 GLU 37 -9.697 3.280 1.228 92 HB3 GLU 37 HB3 GLU 37 -8.348 2.328 1.834 93 HG2 GLU 37 HG2 GLU 37 -10.139 1.354 2.912 94 HG3 GLU 37 HG3 GLU 37 -9.589 2.471 4.153 95 H ALA 38 H ALA 38 -6.014 3.695 1.951 96 HA ALA 38 HA ALA 38 -5.022 2.581 4.385 97 HB1 ALA 38 HB1 ALA 38 -3.472 3.782 2.057 98 HB2 ALA 38 HB2 ALA 38 -2.879 2.594 3.216 99 HB3 ALA 38 HB3 ALA 38 -4.153 2.138 2.080 100 H TRP 39 H TRP 39 -4.492 5.873 2.964 101 HA TRP 39 HA TRP 39 -2.962 6.947 5.086 102 HB2 TRP 39 HB2 TRP 39 -4.837 8.200 3.055 103 HB3 TRP 39 HB3 TRP 39 -3.985 9.173 4.237 104 HD1 TRP 39 HD1 TRP 39 -1.147 8.016 4.219 105 HE1 TRP 39 HE1 TRP 39 0.410 8.213 2.185 106 HE3 TRP 39 HE3 TRP 39 -4.648 8.938 0.623 107 HZ2 TRP 39 HZ2 TRP 39 0.169 8.813 -0.610 108 HZ3 TRP 39 HZ3 TRP 39 -3.961 9.315 -1.746 109 HH2 TRP 39 HH2 TRP 39 -1.555 9.249 -2.372 110 H ALA 40 H ALA 40 -6.536 6.770 4.838 111 HA ALA 40 HA ALA 40 -7.088 8.289 7.191 112 HB1 ALA 40 HB1 ALA 40 -9.306 7.271 7.037 113 HB2 ALA 40 HB2 ALA 40 -8.736 7.733 5.422 114 HB3 ALA 40 HB3 ALA 40 -8.694 6.027 5.928 115 H ASN 41 H ASN 41 -5.955 4.993 6.851 116 HA ASN 41 HA ASN 41 -6.389 4.363 9.729 117 HB2 ASN 41 HB2 ASN 41 -5.569 2.724 7.288 118 HB3 ASN 41 HB3 ASN 41 -5.501 2.097 8.930 119 HD21 ASN 41 HD21 ASN 41 -7.719 3.103 6.343 120 HD22 ASN 41 HD22 ASN 41 -9.134 2.434 7.142 121 H GLY 42 H GLY 42 -4.079 6.066 8.082 122 HA2 GLY 42 HA2 GLY 42 -1.993 6.784 8.787 123 HA3 GLY 42 HA3 GLY 42 -2.002 5.598 10.092 124 H TYR 43 H TYR 43 -2.650 4.136 7.051 125 HA TYR 43 HA TYR 43 -0.025 2.799 6.990 126 HB2 TYR 43 HB2 TYR 43 -2.610 2.449 5.465 127 HB3 TYR 43 HB3 TYR 43 -1.117 1.706 4.939 128 HD1 TYR 43 HD1 TYR 43 -2.395 1.996 8.511 129 HD2 TYR 43 HD2 TYR 43 -1.593 -0.555 5.117 130 HE1 TYR 43 HE1 TYR 43 -2.883 0.004 9.890 131 HE2 TYR 43 HE2 TYR 43 -2.133 -2.553 6.502 132 HH TYR 43 HH TYR 43 -2.735 -3.326 8.575 133 H SER 44 H SER 44 1.350 4.475 6.550 134 HA SER 44 HA SER 44 1.452 5.477 3.742 135 HB2 SER 44 HB2 SER 44 0.815 7.427 4.758 136 HB3 SER 44 HB3 SER 44 1.522 7.009 6.324 137 HG SER 44 HG SER 44 3.464 7.698 5.661 138 H ASP 45 H ASP 45 3.608 6.067 3.062 139 HA ASP 45 HA ASP 45 5.727 5.384 2.535 140 HB2 ASP 45 HB2 ASP 45 6.051 7.042 4.331 141 HB3 ASP 45 HB3 ASP 45 6.086 5.751 5.530 142 H ILE 46 H ILE 46 4.120 3.233 2.525 143 HA ILE 46 HA ILE 46 4.848 1.013 4.161 144 HB ILE 46 HB ILE 46 3.690 1.032 1.367 145 HG12 ILE 46 HG12 ILE 46 2.223 0.924 4.043 146 HG13 ILE 46 HG13 ILE 46 2.330 2.365 3.054 147 HG21 ILE 46 HG21 ILE 46 2.906 -1.223 1.791 148 HG22 ILE 46 HG22 ILE 46 4.596 -1.222 2.211 149 HG23 ILE 46 HG23 ILE 46 3.370 -1.122 3.488 150 HD11 ILE 46 HD11 ILE 46 0.271 0.557 2.958 151 HD12 ILE 46 HD12 ILE 46 0.655 1.749 1.706 152 HD13 ILE 46 HD13 ILE 46 1.218 0.089 1.531 153 H HIS 47 H HIS 47 6.876 0.304 4.308 154 HA HIS 47 HA HIS 47 8.742 0.118 2.034 155 HB2 HIS 47 HB2 HIS 47 8.909 -0.748 4.956 156 HB3 HIS 47 HB3 HIS 47 10.218 -0.951 3.802 157 HD1 HIS 47 HD1 HIS 47 10.653 0.848 6.350 158 HD2 HIS 47 HD2 HIS 47 9.500 2.185 2.513 159 HE1 HIS 47 HE1 HIS 47 11.373 3.318 6.185 160 HE2 HIS 47 HE2 HIS 47 10.624 4.129 3.857 161 H GLU 48 H GLU 48 9.960 -1.966 1.760 162 HA GLU 48 HA GLU 48 8.331 -3.909 0.554 163 HB2 GLU 48 HB2 GLU 48 11.087 -4.360 1.732 164 HB3 GLU 48 HB3 GLU 48 10.343 -5.280 0.435 165 HG2 GLU 48 HG2 GLU 48 11.251 -3.910 -1.083 166 HG3 GLU 48 HG3 GLU 48 10.392 -2.532 -0.413 167 H GLY 49 H GLY 49 7.340 -5.764 1.175 168 HA2 GLY 49 HA2 GLY 49 6.922 -7.685 2.458 169 HA3 GLY 49 HA3 GLY 49 7.885 -7.039 3.783 170 H GLU 50 H GLU 50 6.211 -4.402 3.535 171 HA GLU 50 HA GLU 50 3.975 -5.253 5.271 172 HB2 GLU 50 HB2 GLU 50 5.108 -2.578 4.402 173 HB3 GLU 50 HB3 GLU 50 3.547 -2.676 5.191 174 HG2 GLU 50 HG2 GLU 50 6.109 -3.788 6.397 175 HG3 GLU 50 HG3 GLU 50 5.469 -2.181 6.719 176 HA PRO 51 HA PRO 51 0.921 -5.599 2.230 177 HB2 PRO 51 HB2 PRO 51 -1.367 -4.596 3.370 178 HB3 PRO 51 HB3 PRO 51 -0.568 -6.118 3.882 179 HG2 PRO 51 HG2 PRO 51 -0.268 -3.356 5.108 180 HG3 PRO 51 HG3 PRO 51 -0.617 -4.898 5.954 181 HD2 PRO 51 HD2 PRO 51 1.884 -3.933 5.826 182 HD3 PRO 51 HD3 PRO 51 1.594 -5.685 5.619 183 H GLY 52 H GLY 52 0.586 -4.583 0.393 184 HA2 GLY 52 HA2 GLY 52 -0.396 -2.877 -0.941 185 HA3 GLY 52 HA3 GLY 52 -0.074 -1.674 0.308 186 H TYR 53 H TYR 53 2.838 -3.198 0.256 187 HA TYR 53 HA TYR 53 4.277 -1.320 -1.260 188 HB2 TYR 53 HB2 TYR 53 5.379 -2.705 0.332 189 HB3 TYR 53 HB3 TYR 53 4.779 -4.184 -0.401 190 HD1 TYR 53 HD1 TYR 53 7.157 -1.354 -0.898 191 HD2 TYR 53 HD2 TYR 53 5.932 -5.290 -2.174 192 HE1 TYR 53 HE1 TYR 53 9.235 -1.576 -2.281 193 HE2 TYR 53 HE2 TYR 53 8.011 -5.511 -3.522 194 HH TYR 53 HH TYR 53 9.962 -4.507 -4.195 195 H SER 54 H SER 54 2.563 -4.151 -2.345 196 HA SER 54 HA SER 54 3.798 -4.622 -4.874 197 HB2 SER 54 HB2 SER 54 1.105 -5.324 -3.661 198 HB3 SER 54 HB3 SER 54 1.545 -5.829 -5.293 199 HG SER 54 HG SER 54 2.160 -7.431 -3.800 200 H ALA 55 H ALA 55 3.067 -4.311 -6.967 201 HA ALA 55 HA ALA 55 2.132 -1.805 -7.828 202 HB1 ALA 55 HB1 ALA 55 1.918 -4.489 -9.262 203 HB2 ALA 55 HB2 ALA 55 1.940 -2.881 -10.016 204 HB3 ALA 55 HB3 ALA 55 3.382 -3.490 -9.187 205 H LYS 56 H LYS 56 0.236 -4.507 -6.738 206 HA LYS 56 HA LYS 56 -2.365 -3.963 -7.736 207 HB2 LYS 56 HB2 LYS 56 -1.502 -5.048 -5.015 208 HB3 LYS 56 HB3 LYS 56 -3.110 -5.206 -5.696 209 HG2 LYS 56 HG2 LYS 56 -0.562 -6.437 -6.846 210 HG3 LYS 56 HG3 LYS 56 -1.764 -7.278 -5.887 211 HD2 LYS 56 HD2 LYS 56 -2.279 -6.053 -8.637 212 HD3 LYS 56 HD3 LYS 56 -1.949 -7.755 -8.302 213 HE2 LYS 56 HE2 LYS 56 -3.961 -7.850 -6.825 214 HE3 LYS 56 HE3 LYS 56 -4.333 -6.172 -7.240 215 HZ1 LYS 56 HZ1 LYS 56 -5.575 -7.735 -8.627 216 HZ2 LYS 56 HZ2 LYS 56 -4.202 -8.417 -9.184 217 HZ3 LYS 56 HZ3 LYS 56 -4.560 -6.868 -9.565 218 H LEU 57 H LEU 57 -0.552 -2.201 -5.365 219 HA LEU 57 HA LEU 57 -2.925 -0.516 -4.621 220 HB2 LEU 57 HB2 LEU 57 -0.656 -1.694 -3.156 221 HB3 LEU 57 HB3 LEU 57 -0.660 0.041 -2.970 222 HG LEU 57 HG LEU 57 -1.787 -0.972 -1.149 223 HD11 LEU 57 HD11 LEU 57 -3.647 0.428 -1.038 224 HD12 LEU 57 HD12 LEU 57 -4.035 0.251 -2.766 225 HD13 LEU 57 HD13 LEU 57 -2.638 1.214 -2.237 226 HD21 LEU 57 HD21 LEU 57 -3.838 -2.122 -3.071 227 HD22 LEU 57 HD22 LEU 57 -3.676 -2.413 -1.324 228 HD23 LEU 57 HD23 LEU 57 -2.455 -3.047 -2.439 229 H ASP 58 H ASP 58 0.549 -0.403 -5.430 230 HA ASP 58 HA ASP 58 0.433 2.518 -5.784 231 HB2 ASP 58 HB2 ASP 58 2.150 1.369 -4.384 232 HB3 ASP 58 HB3 ASP 58 2.804 0.599 -5.825 233 H ARG 59 H ARG 59 -0.643 2.833 -7.699 234 HA ARG 59 HA ARG 59 -0.497 1.540 -10.127 235 HB2 ARG 59 HB2 ARG 59 -1.343 3.594 -11.146 236 HB3 ARG 59 HB3 ARG 59 -2.112 3.299 -9.586 237 HG2 ARG 59 HG2 ARG 59 -0.577 4.967 -8.526 238 HG3 ARG 59 HG3 ARG 59 0.158 5.284 -10.108 239 HD2 ARG 59 HD2 ARG 59 -1.947 6.129 -10.979 240 HD3 ARG 59 HD3 ARG 59 -2.776 5.712 -9.462 241 HE ARG 59 HE ARG 59 -0.555 7.381 -8.841 242 HH11 ARG 59 HH11 ARG 59 -3.658 7.738 -10.420 243 HH12 ARG 59 HH12 ARG 59 -3.810 9.410 -9.945 244 HH21 ARG 59 HH21 ARG 59 -0.812 9.500 -8.254 245 HH22 ARG 59 HH22 ARG 59 -2.230 10.377 -8.748 246 H ASP 60 H ASP 60 1.897 3.797 -8.978 247 HA ASP 60 HA ASP 60 3.367 3.835 -11.540 248 HB2 ASP 60 HB2 ASP 60 4.762 5.507 -10.451 249 HB3 ASP 60 HB3 ASP 60 3.061 5.913 -10.338 250 H HIS 61 H HIS 61 3.338 1.779 -8.897 251 HA HIS 61 HA HIS 61 4.834 0.559 -7.715 252 HB2 HIS 61 HB2 HIS 61 3.876 -0.739 -9.608 253 HB3 HIS 61 HB3 HIS 61 5.346 -0.441 -10.530 254 HD1 HIS 61 HD1 HIS 61 6.536 -2.761 -10.531 255 HD2 HIS 61 HD2 HIS 61 4.995 -1.608 -6.768 256 HE1 HIS 61 HE1 HIS 61 7.302 -4.555 -8.848 257 HE2 HIS 61 HE2 HIS 61 6.384 -3.827 -6.555 258 H ASP 62 H ASP 62 6.110 2.812 -7.581 259 HA ASP 62 HA ASP 62 8.922 2.512 -8.438 260 HB2 ASP 62 HB2 ASP 62 9.278 4.710 -7.563 261 HB3 ASP 62 HB3 ASP 62 7.814 4.705 -8.538 262 H GLY 63 H GLY 63 7.451 0.810 -6.202 263 HA2 GLY 63 HA2 GLY 63 8.325 -0.491 -4.502 264 HA3 GLY 63 HA3 GLY 63 9.830 0.432 -4.548 265 H VAL 64 H VAL 64 7.034 2.420 -4.219 266 HA VAL 64 HA VAL 64 6.957 2.270 -1.243 267 HB VAL 64 HB VAL 64 7.081 4.971 -2.645 268 HG11 VAL 64 HG11 VAL 64 5.974 4.859 -0.417 269 HG12 VAL 64 HG12 VAL 64 7.428 4.098 0.259 270 HG13 VAL 64 HG13 VAL 64 7.487 5.768 -0.345 271 HG21 VAL 64 HG21 VAL 64 9.389 3.547 -1.296 272 HG22 VAL 64 HG22 VAL 64 9.274 4.004 -3.014 273 HG23 VAL 64 HG23 VAL 64 9.353 5.263 -1.778 274 H ALA 65 H ALA 65 4.912 2.241 -0.572 275 HA ALA 65 HA ALA 65 2.812 3.143 -2.476 276 HB1 ALA 65 HB1 ALA 65 1.465 1.355 -1.764 277 HB2 ALA 65 HB2 ALA 65 3.096 0.654 -1.912 278 HB3 ALA 65 HB3 ALA 65 2.431 1.051 -0.326 279 H CYS 66 H CYS 66 1.165 4.353 -1.829 280 HA CYS 66 HA CYS 66 0.285 6.173 -0.871 281 HB2 CYS 66 HB2 CYS 66 0.301 4.624 1.712 282 HB3 CYS 66 HB3 CYS 66 -0.889 5.775 1.128 283 H GLU 67 H GLU 67 2.807 6.741 -1.273 284 HA GLU 67 HA GLU 67 4.420 7.445 0.984 285 HB2 GLU 67 HB2 GLU 67 5.663 8.841 -0.679 286 HB3 GLU 67 HB3 GLU 67 5.522 7.144 -1.067 287 HG2 GLU 67 HG2 GLU 67 3.523 9.035 -2.308 288 HG3 GLU 67 HG3 GLU 67 5.174 9.042 -2.884 289 H LEU 68 H LEU 68 5.004 9.512 1.860 290 HA LEU 68 HA LEU 68 3.040 11.739 1.480 291 HB2 LEU 68 HB2 LEU 68 3.896 10.435 4.089 292 HB3 LEU 68 HB3 LEU 68 3.393 12.112 4.041 293 HG LEU 68 HG LEU 68 1.647 9.730 3.331 294 HD11 LEU 68 HD11 LEU 68 2.118 10.153 5.777 295 HD12 LEU 68 HD12 LEU 68 0.417 10.383 5.349 296 HD13 LEU 68 HD13 LEU 68 1.477 11.791 5.588 297 HD21 LEU 68 HD21 LEU 68 1.013 12.717 3.326 298 HD22 LEU 68 HD22 LEU 68 -0.203 11.421 3.266 299 HD23 LEU 68 HD23 LEU 68 0.933 11.608 1.934 300 H LYS 69 H LYS 69 6.327 10.812 2.500 301 HA LYS 69 HA LYS 69 7.301 13.417 3.017 302 HB2 LYS 69 HB2 LYS 69 8.313 11.205 3.677 303 HB3 LYS 69 HB3 LYS 69 8.795 10.951 2.000 304 HG2 LYS 69 HG2 LYS 69 10.643 11.704 3.371 305 HG3 LYS 69 HG3 LYS 69 10.296 12.890 2.110 306 HD2 LYS 69 HD2 LYS 69 9.271 14.403 3.649 307 HD3 LYS 69 HD3 LYS 69 9.138 13.181 4.916 308 HE2 LYS 69 HE2 LYS 69 11.790 14.256 3.846 309 HE3 LYS 69 HE3 LYS 69 10.939 14.952 5.227 310 HZ1 LYS 69 HZ1 LYS 69 11.112 12.795 6.352 311 HZ2 LYS 69 HZ2 LYS 69 12.592 13.365 5.976 312 HZ3 LYS 69 HZ3 LYS 69 11.941 12.159 5.095 313 H ASN 70 H ASN 70 7.192 11.611 -0.011 314 HA ASN 70 HA ASN 70 8.342 13.860 -1.591 315 HB2 ASN 70 HB2 ASN 70 7.597 10.984 -2.285 316 HB3 ASN 70 HB3 ASN 70 8.052 12.177 -3.490 317 HD21 ASN 70 HD21 ASN 70 9.495 9.882 -3.377 318 HD22 ASN 70 HD22 ASN 70 11.093 10.244 -2.741 Start of MODEL 7 1 H1 GLY 24 H1 GLY 24 -9.701 -18.836 15.049 2 H2 GLY 24 H2 GLY 24 -10.259 -17.793 16.184 3 H3 GLY 24 H3 GLY 24 -11.053 -17.958 14.760 4 HA2 GLY 24 HA2 GLY 24 -9.796 -15.901 14.776 5 HA3 GLY 24 HA3 GLY 24 -8.335 -16.856 15.088 6 H ALA 25 H ALA 25 -9.459 -15.116 12.755 7 HA ALA 25 HA ALA 25 -8.735 -16.947 10.517 8 HB1 ALA 25 HB1 ALA 25 -11.187 -16.958 10.757 9 HB2 ALA 25 HB2 ALA 25 -11.219 -15.182 10.657 10 HB3 ALA 25 HB3 ALA 25 -10.694 -16.149 9.260 11 H SER 26 H SER 26 -6.790 -15.499 11.288 12 HA SER 26 HA SER 26 -6.500 -12.780 10.604 13 HB2 SER 26 HB2 SER 26 -4.922 -14.190 11.931 14 HB3 SER 26 HB3 SER 26 -4.380 -14.951 10.422 15 HG SER 26 HG SER 26 -3.050 -13.164 11.012 16 H GLU 27 H GLU 27 -6.112 -11.652 8.761 17 HA GLU 27 HA GLU 27 -6.595 -12.890 6.164 18 HB2 GLU 27 HB2 GLU 27 -6.048 -10.053 7.088 19 HB3 GLU 27 HB3 GLU 27 -6.151 -10.489 5.375 20 HG2 GLU 27 HG2 GLU 27 -8.413 -11.394 5.693 21 HG3 GLU 27 HG3 GLU 27 -8.349 -11.026 7.418 22 H GLU 28 H GLU 28 -4.980 -14.262 5.591 23 HA GLU 28 HA GLU 28 -2.189 -13.801 5.721 24 HB2 GLU 28 HB2 GLU 28 -1.988 -15.672 4.211 25 HB3 GLU 28 HB3 GLU 28 -3.249 -15.993 5.399 26 HG2 GLU 28 HG2 GLU 28 -4.968 -15.307 3.653 27 HG3 GLU 28 HG3 GLU 28 -3.654 -15.181 2.484 28 H ASN 29 H ASN 29 -4.492 -12.614 3.382 29 HA ASN 29 HA ASN 29 -2.352 -11.192 1.850 30 HB2 ASN 29 HB2 ASN 29 -4.780 -12.702 0.781 31 HB3 ASN 29 HB3 ASN 29 -3.900 -11.506 -0.159 32 HD21 ASN 29 HD21 ASN 29 -4.231 -14.084 -1.101 33 HD22 ASN 29 HD22 ASN 29 -2.651 -14.855 -1.122 34 H ILE 30 H ILE 30 -2.633 -9.090 2.228 35 HA ILE 30 HA ILE 30 -5.283 -7.943 2.928 36 HB ILE 30 HB ILE 30 -2.436 -6.918 2.963 37 HG12 ILE 30 HG12 ILE 30 -4.386 -7.010 5.290 38 HG13 ILE 30 HG13 ILE 30 -3.512 -8.473 4.820 39 HG21 ILE 30 HG21 ILE 30 -3.713 -4.969 2.319 40 HG22 ILE 30 HG22 ILE 30 -5.000 -5.347 3.495 41 HG23 ILE 30 HG23 ILE 30 -3.406 -4.825 4.046 42 HD11 ILE 30 HD11 ILE 30 -1.359 -7.292 5.178 43 HD12 ILE 30 HD12 ILE 30 -2.272 -5.860 5.734 44 HD13 ILE 30 HD13 ILE 30 -2.360 -7.381 6.634 45 H HIS 31 H HIS 31 -6.388 -6.496 1.722 46 HA HIS 31 HA HIS 31 -5.471 -5.842 -1.031 47 HB2 HIS 31 HB2 HIS 31 -7.628 -6.664 -1.947 48 HB3 HIS 31 HB3 HIS 31 -6.579 -7.921 -1.322 49 HD1 HIS 31 HD1 HIS 31 -9.921 -6.216 -0.516 50 HD2 HIS 31 HD2 HIS 31 -7.430 -9.352 0.807 51 HE1 HIS 31 HE1 HIS 31 -11.332 -7.617 1.132 52 HE2 HIS 31 HE2 HIS 31 -9.782 -9.502 1.964 53 H PHE 32 H PHE 32 -5.209 -3.704 -0.173 54 HA PHE 32 HA PHE 32 -7.523 -2.149 0.695 55 HB2 PHE 32 HB2 PHE 32 -4.729 -1.398 -0.218 56 HB3 PHE 32 HB3 PHE 32 -5.939 -0.208 0.245 57 HD1 PHE 32 HD1 PHE 32 -7.072 -0.574 2.600 58 HD2 PHE 32 HD2 PHE 32 -3.243 -2.191 1.433 59 HE1 PHE 32 HE1 PHE 32 -6.440 -0.809 4.990 60 HE2 PHE 32 HE2 PHE 32 -2.612 -2.408 3.824 61 HZ PHE 32 HZ PHE 32 -4.217 -1.730 5.603 62 H SER 33 H SER 33 -9.040 -1.174 -0.519 63 HA SER 33 HA SER 33 -9.199 -1.408 -3.360 64 HB2 SER 33 HB2 SER 33 -10.662 0.572 -1.574 65 HB3 SER 33 HB3 SER 33 -11.175 -0.010 -3.166 66 HG SER 33 HG SER 33 -11.393 -2.103 -2.268 67 H SER 34 H SER 34 -7.848 1.125 -1.330 68 HA SER 34 HA SER 34 -6.394 2.355 -3.507 69 HB2 SER 34 HB2 SER 34 -8.574 3.499 -3.844 70 HB3 SER 34 HB3 SER 34 -8.617 3.937 -2.131 71 HG SER 34 HG SER 34 -7.034 4.959 -4.215 72 H CYS 35 H CYS 35 -4.807 3.882 -2.669 73 HA CYS 35 HA CYS 35 -3.893 3.646 0.018 74 HB2 CYS 35 HB2 CYS 35 -3.418 5.644 -2.194 75 HB3 CYS 35 HB3 CYS 35 -2.821 5.970 -0.572 76 H LYS 36 H LYS 36 -6.576 5.593 -1.206 77 HA LYS 36 HA LYS 36 -6.733 7.520 0.945 78 HB2 LYS 36 HB2 LYS 36 -8.782 6.267 -0.922 79 HB3 LYS 36 HB3 LYS 36 -9.297 7.187 0.474 80 HG2 LYS 36 HG2 LYS 36 -9.367 8.797 -1.069 81 HG3 LYS 36 HG3 LYS 36 -7.795 9.113 -0.374 82 HD2 LYS 36 HD2 LYS 36 -8.162 7.473 -2.926 83 HD3 LYS 36 HD3 LYS 36 -8.138 9.238 -2.930 84 HE2 LYS 36 HE2 LYS 36 -5.901 9.183 -1.796 85 HE3 LYS 36 HE3 LYS 36 -5.876 7.430 -2.013 86 HZ1 LYS 36 HZ1 LYS 36 -5.267 9.438 -3.925 87 HZ2 LYS 36 HZ2 LYS 36 -6.480 8.514 -4.498 88 HZ3 LYS 36 HZ3 LYS 36 -5.070 7.823 -4.066 89 H GLU 37 H GLU 37 -7.878 4.162 0.743 90 HA GLU 37 HA GLU 37 -9.125 4.165 3.368 91 HB2 GLU 37 HB2 GLU 37 -9.490 2.603 1.249 92 HB3 GLU 37 HB3 GLU 37 -8.131 1.702 1.907 93 HG2 GLU 37 HG2 GLU 37 -9.956 0.594 2.810 94 HG3 GLU 37 HG3 GLU 37 -9.516 1.664 4.136 95 H ALA 38 H ALA 38 -5.928 3.274 2.104 96 HA ALA 38 HA ALA 38 -4.890 2.086 4.496 97 HB1 ALA 38 HB1 ALA 38 -3.354 3.454 2.250 98 HB2 ALA 38 HB2 ALA 38 -2.803 2.129 3.285 99 HB3 ALA 38 HB3 ALA 38 -4.072 1.832 2.102 100 H TRP 39 H TRP 39 -4.517 5.443 3.170 101 HA TRP 39 HA TRP 39 -3.057 6.524 5.349 102 HB2 TRP 39 HB2 TRP 39 -4.891 7.736 3.262 103 HB3 TRP 39 HB3 TRP 39 -4.162 8.728 4.507 104 HD1 TRP 39 HD1 TRP 39 -1.243 7.657 4.603 105 HE1 TRP 39 HE1 TRP 39 0.380 8.032 2.654 106 HE3 TRP 39 HE3 TRP 39 -4.631 8.587 0.865 107 HZ2 TRP 39 HZ2 TRP 39 0.246 8.804 -0.096 108 HZ3 TRP 39 HZ3 TRP 39 -3.819 9.170 -1.424 109 HH2 TRP 39 HH2 TRP 39 -1.395 9.251 -1.920 110 H ALA 40 H ALA 40 -6.609 6.188 5.003 111 HA ALA 40 HA ALA 40 -7.311 7.647 7.344 112 HB1 ALA 40 HB1 ALA 40 -9.429 6.428 7.191 113 HB2 ALA 40 HB2 ALA 40 -8.900 6.952 5.582 114 HB3 ALA 40 HB3 ALA 40 -8.704 5.252 6.075 115 H ASN 41 H ASN 41 -5.840 4.492 7.064 116 HA ASN 41 HA ASN 41 -6.185 3.919 9.972 117 HB2 ASN 41 HB2 ASN 41 -5.297 2.232 7.588 118 HB3 ASN 41 HB3 ASN 41 -5.206 1.686 9.258 119 HD21 ASN 41 HD21 ASN 41 -7.458 2.434 6.607 120 HD22 ASN 41 HD22 ASN 41 -8.842 1.747 7.439 121 H GLY 42 H GLY 42 -4.090 5.747 8.218 122 HA2 GLY 42 HA2 GLY 42 -2.096 6.698 8.883 123 HA3 GLY 42 HA3 GLY 42 -1.934 5.518 10.181 124 H TYR 43 H TYR 43 -2.444 4.032 7.098 125 HA TYR 43 HA TYR 43 0.261 2.902 7.108 126 HB2 TYR 43 HB2 TYR 43 -2.148 2.534 5.325 127 HB3 TYR 43 HB3 TYR 43 -0.595 1.825 4.964 128 HD1 TYR 43 HD1 TYR 43 -2.433 2.013 8.299 129 HD2 TYR 43 HD2 TYR 43 -0.953 -0.469 5.088 130 HE1 TYR 43 HE1 TYR 43 -3.053 -0.004 9.576 131 HE2 TYR 43 HE2 TYR 43 -1.637 -2.499 6.373 132 HH TYR 43 HH TYR 43 -2.505 -3.313 8.318 133 H SER 44 H SER 44 1.797 4.299 6.588 134 HA SER 44 HA SER 44 1.874 5.546 3.899 135 HB2 SER 44 HB2 SER 44 1.115 7.366 5.233 136 HB3 SER 44 HB3 SER 44 2.210 6.962 6.565 137 HG SER 44 HG SER 44 3.678 8.137 5.647 138 H ASP 45 H ASP 45 4.074 6.171 3.315 139 HA ASP 45 HA ASP 45 6.157 5.421 2.742 140 HB2 ASP 45 HB2 ASP 45 6.562 6.874 4.716 141 HB3 ASP 45 HB3 ASP 45 6.545 5.451 5.755 142 H ILE 46 H ILE 46 4.364 3.357 2.597 143 HA ILE 46 HA ILE 46 5.087 0.924 3.928 144 HB ILE 46 HB ILE 46 3.864 1.415 1.211 145 HG12 ILE 46 HG12 ILE 46 2.379 0.658 3.761 146 HG13 ILE 46 HG13 ILE 46 2.535 2.323 3.206 147 HG21 ILE 46 HG21 ILE 46 4.829 -1.056 1.977 148 HG22 ILE 46 HG22 ILE 46 3.188 -1.139 2.600 149 HG23 ILE 46 HG23 ILE 46 3.473 -0.795 0.897 150 HD11 ILE 46 HD11 ILE 46 1.285 1.924 1.223 151 HD12 ILE 46 HD12 ILE 46 1.335 0.171 1.410 152 HD13 ILE 46 HD13 ILE 46 0.382 1.157 2.541 153 H HIS 47 H HIS 47 6.927 -0.166 3.781 154 HA HIS 47 HA HIS 47 8.691 -0.007 1.364 155 HB2 HIS 47 HB2 HIS 47 9.252 -0.945 4.210 156 HB3 HIS 47 HB3 HIS 47 10.430 -0.933 2.905 157 HD1 HIS 47 HD1 HIS 47 10.778 0.773 5.619 158 HD2 HIS 47 HD2 HIS 47 9.306 2.162 1.912 159 HE1 HIS 47 HE1 HIS 47 11.070 3.336 5.624 160 HE2 HIS 47 HE2 HIS 47 10.063 4.172 3.409 161 H GLU 48 H GLU 48 9.958 -2.133 1.033 162 HA GLU 48 HA GLU 48 8.243 -4.117 0.035 163 HB2 GLU 48 HB2 GLU 48 10.607 -3.750 -0.614 164 HB3 GLU 48 HB3 GLU 48 11.138 -4.353 0.960 165 HG2 GLU 48 HG2 GLU 48 10.202 -6.580 0.446 166 HG3 GLU 48 HG3 GLU 48 9.539 -5.969 -1.072 167 H GLY 49 H GLY 49 7.184 -5.812 0.817 168 HA2 GLY 49 HA2 GLY 49 6.819 -7.708 2.178 169 HA3 GLY 49 HA3 GLY 49 7.851 -7.035 3.438 170 H GLU 50 H GLU 50 6.280 -4.357 3.121 171 HA GLU 50 HA GLU 50 4.038 -4.977 4.939 172 HB2 GLU 50 HB2 GLU 50 5.248 -2.466 3.776 173 HB3 GLU 50 HB3 GLU 50 3.649 -2.401 4.470 174 HG2 GLU 50 HG2 GLU 50 5.747 -3.712 6.160 175 HG3 GLU 50 HG3 GLU 50 5.942 -1.990 5.852 176 HA PRO 51 HA PRO 51 0.921 -5.438 1.870 177 HB2 PRO 51 HB2 PRO 51 -1.298 -4.333 3.017 178 HB3 PRO 51 HB3 PRO 51 -0.529 -5.844 3.600 179 HG2 PRO 51 HG2 PRO 51 -0.110 -3.027 4.660 180 HG3 PRO 51 HG3 PRO 51 -0.513 -4.497 5.603 181 HD2 PRO 51 HD2 PRO 51 2.019 -3.657 5.379 182 HD3 PRO 51 HD3 PRO 51 1.648 -5.405 5.288 183 H GLY 52 H GLY 52 0.459 -4.425 0.027 184 HA2 GLY 52 HA2 GLY 52 -0.472 -2.712 -1.298 185 HA3 GLY 52 HA3 GLY 52 -0.124 -1.512 -0.056 186 H TYR 53 H TYR 53 2.774 -3.052 -0.162 187 HA TYR 53 HA TYR 53 4.204 -1.186 -1.732 188 HB2 TYR 53 HB2 TYR 53 5.226 -2.560 -0.025 189 HB3 TYR 53 HB3 TYR 53 4.725 -4.041 -0.818 190 HD1 TYR 53 HD1 TYR 53 6.004 -5.046 -2.584 191 HD2 TYR 53 HD2 TYR 53 7.054 -1.151 -1.046 192 HE1 TYR 53 HE1 TYR 53 8.234 -5.225 -3.676 193 HE2 TYR 53 HE2 TYR 53 9.315 -1.362 -2.116 194 HH TYR 53 HH TYR 53 10.270 -4.224 -4.029 195 H SER 54 H SER 54 2.451 -4.026 -2.678 196 HA SER 54 HA SER 54 3.777 -4.627 -5.173 197 HB2 SER 54 HB2 SER 54 1.183 -5.449 -3.849 198 HB3 SER 54 HB3 SER 54 1.565 -5.963 -5.497 199 HG SER 54 HG SER 54 2.334 -7.479 -3.952 200 H ALA 55 H ALA 55 2.960 -4.450 -7.288 201 HA ALA 55 HA ALA 55 2.150 -1.875 -8.059 202 HB1 ALA 55 HB1 ALA 55 3.406 -3.634 -9.402 203 HB2 ALA 55 HB2 ALA 55 1.836 -4.389 -9.741 204 HB3 ALA 55 HB3 ALA 55 2.168 -2.732 -10.285 205 H LYS 56 H LYS 56 0.089 -4.508 -7.121 206 HA LYS 56 HA LYS 56 -2.420 -3.740 -8.208 207 HB2 LYS 56 HB2 LYS 56 -3.413 -4.995 -6.376 208 HB3 LYS 56 HB3 LYS 56 -2.054 -5.879 -7.074 209 HG2 LYS 56 HG2 LYS 56 -0.625 -5.270 -5.189 210 HG3 LYS 56 HG3 LYS 56 -1.841 -4.181 -4.550 211 HD2 LYS 56 HD2 LYS 56 -1.875 -6.140 -3.208 212 HD3 LYS 56 HD3 LYS 56 -3.366 -6.116 -4.159 213 HE2 LYS 56 HE2 LYS 56 -2.334 -7.728 -5.772 214 HE3 LYS 56 HE3 LYS 56 -0.851 -7.729 -4.808 215 HZ1 LYS 56 HZ1 LYS 56 -2.141 -8.644 -2.949 216 HZ2 LYS 56 HZ2 LYS 56 -2.259 -9.621 -4.251 217 HZ3 LYS 56 HZ3 LYS 56 -3.508 -8.653 -3.847 218 H LEU 57 H LEU 57 -0.576 -2.115 -5.707 219 HA LEU 57 HA LEU 57 -2.902 -0.326 -5.099 220 HB2 LEU 57 HB2 LEU 57 -0.774 -1.641 -3.496 221 HB3 LEU 57 HB3 LEU 57 -0.864 0.078 -3.200 222 HG LEU 57 HG LEU 57 -2.124 -1.047 -1.563 223 HD11 LEU 57 HD11 LEU 57 -4.186 0.155 -1.671 224 HD12 LEU 57 HD12 LEU 57 -4.209 0.142 -3.435 225 HD13 LEU 57 HD13 LEU 57 -3.012 1.126 -2.556 226 HD21 LEU 57 HD21 LEU 57 -3.740 -2.320 -3.802 227 HD22 LEU 57 HD22 LEU 57 -4.066 -2.472 -2.069 228 HD23 LEU 57 HD23 LEU 57 -2.568 -3.134 -2.735 229 H ASP 58 H ASP 58 0.597 -0.402 -5.775 230 HA ASP 58 HA ASP 58 0.626 2.550 -6.054 231 HB2 ASP 58 HB2 ASP 58 2.235 1.277 -4.602 232 HB3 ASP 58 HB3 ASP 58 2.959 0.603 -6.061 233 H ARG 59 H ARG 59 -0.375 2.894 -8.019 234 HA ARG 59 HA ARG 59 -0.102 1.529 -10.435 235 HB2 ARG 59 HB2 ARG 59 -0.967 3.540 -11.510 236 HB3 ARG 59 HB3 ARG 59 -1.799 3.248 -9.981 237 HG2 ARG 59 HG2 ARG 59 -0.338 4.975 -8.884 238 HG3 ARG 59 HG3 ARG 59 0.427 5.291 -10.451 239 HD2 ARG 59 HD2 ARG 59 -1.728 5.990 -11.387 240 HD3 ARG 59 HD3 ARG 59 -2.515 5.690 -9.820 241 HE ARG 59 HE ARG 59 -0.398 7.376 -9.210 242 HH11 ARG 59 HH11 ARG 59 -3.161 7.721 -11.331 243 HH12 ARG 59 HH12 ARG 59 -3.153 9.460 -11.204 244 HH21 ARG 59 HH21 ARG 59 -0.437 9.580 -9.089 245 HH22 ARG 59 HH22 ARG 59 -1.648 10.481 -9.955 246 H ASP 60 H ASP 60 2.100 3.936 -9.170 247 HA ASP 60 HA ASP 60 3.768 4.060 -11.573 248 HB2 ASP 60 HB2 ASP 60 5.126 5.595 -10.149 249 HB3 ASP 60 HB3 ASP 60 3.447 6.065 -10.339 250 H HIS 61 H HIS 61 3.531 1.861 -9.056 251 HA HIS 61 HA HIS 61 4.923 0.618 -7.801 252 HB2 HIS 61 HB2 HIS 61 4.094 -0.614 -9.839 253 HB3 HIS 61 HB3 HIS 61 5.694 -0.410 -10.542 254 HD1 HIS 61 HD1 HIS 61 4.998 -1.448 -6.825 255 HD2 HIS 61 HD2 HIS 61 6.494 -2.915 -10.498 256 HE1 HIS 61 HE1 HIS 61 6.045 -3.736 -6.318 257 HE2 HIS 61 HE2 HIS 61 6.928 -4.642 -8.567 258 H ASP 62 H ASP 62 6.168 2.789 -7.458 259 HA ASP 62 HA ASP 62 8.997 2.655 -8.321 260 HB2 ASP 62 HB2 ASP 62 9.241 4.847 -7.470 261 HB3 ASP 62 HB3 ASP 62 7.728 4.797 -8.358 262 H GLY 63 H GLY 63 7.504 0.925 -6.085 263 HA2 GLY 63 HA2 GLY 63 8.318 -0.338 -4.335 264 HA3 GLY 63 HA3 GLY 63 9.847 0.542 -4.383 265 H VAL 64 H VAL 64 7.163 2.687 -4.170 266 HA VAL 64 HA VAL 64 7.025 2.572 -1.190 267 HB VAL 64 HB VAL 64 7.233 5.227 -2.666 268 HG11 VAL 64 HG11 VAL 64 7.568 6.083 -0.371 269 HG12 VAL 64 HG12 VAL 64 6.033 5.211 -0.482 270 HG13 VAL 64 HG13 VAL 64 7.435 4.435 0.278 271 HG21 VAL 64 HG21 VAL 64 9.403 4.186 -2.912 272 HG22 VAL 64 HG22 VAL 64 9.483 5.460 -1.692 273 HG23 VAL 64 HG23 VAL 64 9.427 3.751 -1.184 274 H ALA 65 H ALA 65 4.964 2.239 -0.704 275 HA ALA 65 HA ALA 65 2.884 3.411 -2.483 276 HB1 ALA 65 HB1 ALA 65 1.393 1.656 -1.449 277 HB2 ALA 65 HB2 ALA 65 2.741 1.030 -2.411 278 HB3 ALA 65 HB3 ALA 65 2.836 0.983 -0.658 279 H CYS 66 H CYS 66 1.250 4.587 -1.739 280 HA CYS 66 HA CYS 66 0.307 6.276 -0.641 281 HB2 CYS 66 HB2 CYS 66 0.496 4.605 1.855 282 HB3 CYS 66 HB3 CYS 66 -0.765 5.726 1.375 283 H GLU 67 H GLU 67 2.857 6.910 -1.059 284 HA GLU 67 HA GLU 67 4.373 7.790 1.198 285 HB2 GLU 67 HB2 GLU 67 5.577 9.156 -0.494 286 HB3 GLU 67 HB3 GLU 67 5.487 7.444 -0.849 287 HG2 GLU 67 HG2 GLU 67 3.468 9.276 -2.150 288 HG3 GLU 67 HG3 GLU 67 5.135 9.306 -2.688 289 H LEU 68 H LEU 68 4.701 9.734 2.196 290 HA LEU 68 HA LEU 68 2.829 12.016 1.687 291 HB2 LEU 68 HB2 LEU 68 3.775 10.816 4.315 292 HB3 LEU 68 HB3 LEU 68 3.048 12.410 4.209 293 HG LEU 68 HG LEU 68 1.620 9.847 3.427 294 HD11 LEU 68 HD11 LEU 68 2.083 10.105 5.856 295 HD12 LEU 68 HD12 LEU 68 0.354 10.253 5.493 296 HD13 LEU 68 HD13 LEU 68 1.330 11.708 5.830 297 HD21 LEU 68 HD21 LEU 68 0.701 11.749 2.169 298 HD22 LEU 68 HD22 LEU 68 0.651 12.741 3.646 299 HD23 LEU 68 HD23 LEU 68 -0.404 11.322 3.475 300 H LYS 69 H LYS 69 5.495 11.557 0.640 301 HA LYS 69 HA LYS 69 7.422 13.393 1.800 302 HB2 LYS 69 HB2 LYS 69 7.146 12.334 -1.043 303 HB3 LYS 69 HB3 LYS 69 8.542 13.190 -0.399 304 HG2 LYS 69 HG2 LYS 69 7.548 10.449 0.512 305 HG3 LYS 69 HG3 LYS 69 8.919 10.793 -0.530 306 HD2 LYS 69 HD2 LYS 69 10.100 10.577 1.399 307 HD3 LYS 69 HD3 LYS 69 9.720 12.285 1.534 308 HE2 LYS 69 HE2 LYS 69 9.239 11.454 3.663 309 HE3 LYS 69 HE3 LYS 69 7.646 11.554 2.913 310 HZ1 LYS 69 HZ1 LYS 69 7.850 9.134 2.433 311 HZ2 LYS 69 HZ2 LYS 69 7.966 9.428 4.040 312 HZ3 LYS 69 HZ3 LYS 69 9.303 9.092 3.171 313 H ASN 70 H ASN 70 6.484 15.275 2.282 314 HA ASN 70 HA ASN 70 5.625 17.367 2.136 315 HB2 ASN 70 HB2 ASN 70 7.080 17.485 -0.535 316 HB3 ASN 70 HB3 ASN 70 6.635 18.843 0.482 317 HD21 ASN 70 HD21 ASN 70 9.091 16.554 -0.200 318 HD22 ASN 70 HD22 ASN 70 10.131 16.971 1.154 Start of MODEL 8 1 H1 GLY 24 H1 GLY 24 -12.780 -25.583 0.011 2 H2 GLY 24 H2 GLY 24 -11.289 -26.099 0.455 3 H3 GLY 24 H3 GLY 24 -12.096 -25.029 1.395 4 HA2 GLY 24 HA2 GLY 24 -11.102 -24.490 -1.328 5 HA3 GLY 24 HA3 GLY 24 -11.987 -23.336 -0.312 6 H ALA 25 H ALA 25 -9.099 -23.497 -1.444 7 HA ALA 25 HA ALA 25 -7.361 -23.701 0.869 8 HB1 ALA 25 HB1 ALA 25 -6.688 -24.262 -1.470 9 HB2 ALA 25 HB2 ALA 25 -6.791 -22.530 -1.890 10 HB3 ALA 25 HB3 ALA 25 -5.610 -23.090 -0.675 11 H SER 26 H SER 26 -7.887 -22.258 2.477 12 HA SER 26 HA SER 26 -8.443 -19.476 2.193 13 HB2 SER 26 HB2 SER 26 -7.180 -20.967 4.529 14 HB3 SER 26 HB3 SER 26 -7.880 -19.338 4.592 15 HG SER 26 HG SER 26 -9.377 -20.922 5.286 16 H GLU 27 H GLU 27 -7.141 -17.659 2.864 17 HA GLU 27 HA GLU 27 -4.213 -17.909 2.886 18 HB2 GLU 27 HB2 GLU 27 -3.818 -16.331 1.123 19 HB3 GLU 27 HB3 GLU 27 -4.763 -17.670 0.481 20 HG2 GLU 27 HG2 GLU 27 -6.840 -16.246 0.721 21 HG3 GLU 27 HG3 GLU 27 -5.809 -14.897 1.203 22 H GLU 28 H GLU 28 -3.164 -15.807 3.401 23 HA GLU 28 HA GLU 28 -4.872 -13.930 4.984 24 HB2 GLU 28 HB2 GLU 28 -2.325 -15.297 5.926 25 HB3 GLU 28 HB3 GLU 28 -3.050 -13.865 6.684 26 HG2 GLU 28 HG2 GLU 28 -5.158 -15.148 7.047 27 HG3 GLU 28 HG3 GLU 28 -4.372 -16.592 6.399 28 H ASN 29 H ASN 29 -4.778 -12.535 3.219 29 HA ASN 29 HA ASN 29 -2.255 -10.988 3.033 30 HB2 ASN 29 HB2 ASN 29 -2.368 -10.845 0.673 31 HB3 ASN 29 HB3 ASN 29 -2.433 -12.550 1.077 32 HD21 ASN 29 HD21 ASN 29 -3.226 -11.384 -1.422 33 HD22 ASN 29 HD22 ASN 29 -4.948 -11.687 -1.597 34 H ILE 30 H ILE 30 -2.464 -8.793 2.713 35 HA ILE 30 HA ILE 30 -5.115 -7.632 3.415 36 HB ILE 30 HB ILE 30 -2.285 -6.567 3.470 37 HG12 ILE 30 HG12 ILE 30 -4.291 -6.750 5.754 38 HG13 ILE 30 HG13 ILE 30 -3.282 -8.135 5.328 39 HG21 ILE 30 HG21 ILE 30 -4.906 -5.075 3.979 40 HG22 ILE 30 HG22 ILE 30 -3.331 -4.489 4.520 41 HG23 ILE 30 HG23 ILE 30 -3.636 -4.665 2.796 42 HD11 ILE 30 HD11 ILE 30 -2.260 -5.423 6.240 43 HD12 ILE 30 HD12 ILE 30 -2.319 -6.915 7.188 44 HD13 ILE 30 HD13 ILE 30 -1.250 -6.824 5.784 45 H HIS 31 H HIS 31 -6.189 -6.191 2.181 46 HA HIS 31 HA HIS 31 -5.310 -5.652 -0.599 47 HB2 HIS 31 HB2 HIS 31 -7.409 -6.640 -1.490 48 HB3 HIS 31 HB3 HIS 31 -6.288 -7.807 -0.822 49 HD1 HIS 31 HD1 HIS 31 -7.092 -9.128 1.438 50 HD2 HIS 31 HD2 HIS 31 -9.818 -6.413 -0.317 51 HE1 HIS 31 HE1 HIS 31 -9.387 -9.602 2.506 52 HE2 HIS 31 HE2 HIS 31 -11.043 -7.944 1.431 53 H PHE 32 H PHE 32 -5.177 -3.500 0.386 54 HA PHE 32 HA PHE 32 -7.594 -1.996 0.993 55 HB2 PHE 32 HB2 PHE 32 -4.806 -1.163 0.118 56 HB3 PHE 32 HB3 PHE 32 -6.075 -0.026 0.565 57 HD1 PHE 32 HD1 PHE 32 -3.269 -1.821 1.781 58 HD2 PHE 32 HD2 PHE 32 -7.213 -0.491 2.927 59 HE1 PHE 32 HE1 PHE 32 -2.657 -2.050 4.178 60 HE2 PHE 32 HE2 PHE 32 -6.599 -0.738 5.320 61 HZ PHE 32 HZ PHE 32 -4.332 -1.530 5.944 62 H SER 33 H SER 33 -8.930 -0.814 -0.322 63 HA SER 33 HA SER 33 -9.146 -1.466 -3.125 64 HB2 SER 33 HB2 SER 33 -10.913 0.299 -3.085 65 HB3 SER 33 HB3 SER 33 -11.114 -0.954 -1.841 66 HG SER 33 HG SER 33 -11.427 1.192 -1.037 67 H SER 34 H SER 34 -8.047 1.403 -1.399 68 HA SER 34 HA SER 34 -6.231 2.259 -3.560 69 HB2 SER 34 HB2 SER 34 -8.630 3.914 -2.633 70 HB3 SER 34 HB3 SER 34 -7.213 4.632 -3.413 71 HG SER 34 HG SER 34 -8.589 2.481 -4.627 72 H CYS 35 H CYS 35 -4.691 3.849 -2.805 73 HA CYS 35 HA CYS 35 -3.861 3.762 -0.139 74 HB2 CYS 35 HB2 CYS 35 -3.328 5.653 -2.412 75 HB3 CYS 35 HB3 CYS 35 -2.785 6.099 -0.801 76 H LYS 36 H LYS 36 -6.438 5.861 -1.373 77 HA LYS 36 HA LYS 36 -6.594 7.730 0.779 78 HB2 LYS 36 HB2 LYS 36 -8.757 6.446 -0.937 79 HB3 LYS 36 HB3 LYS 36 -9.086 7.657 0.300 80 HG2 LYS 36 HG2 LYS 36 -7.362 9.167 -0.913 81 HG3 LYS 36 HG3 LYS 36 -7.434 7.991 -2.233 82 HD2 LYS 36 HD2 LYS 36 -8.988 9.717 -2.794 83 HD3 LYS 36 HD3 LYS 36 -9.966 8.342 -2.261 84 HE2 LYS 36 HE2 LYS 36 -10.014 9.441 0.062 85 HE3 LYS 36 HE3 LYS 36 -9.222 10.838 -0.660 86 HZ1 LYS 36 HZ1 LYS 36 -11.620 11.131 -0.591 87 HZ2 LYS 36 HZ2 LYS 36 -11.883 9.767 -1.444 88 HZ3 LYS 36 HZ3 LYS 36 -11.155 11.050 -2.153 89 H GLU 37 H GLU 37 -7.848 4.395 0.653 90 HA GLU 37 HA GLU 37 -9.064 4.534 3.301 91 HB2 GLU 37 HB2 GLU 37 -9.787 3.015 1.443 92 HB3 GLU 37 HB3 GLU 37 -8.281 2.105 1.628 93 HG2 GLU 37 HG2 GLU 37 -8.899 1.483 3.919 94 HG3 GLU 37 HG3 GLU 37 -10.315 2.536 3.858 95 H ALA 38 H ALA 38 -5.928 3.436 2.009 96 HA ALA 38 HA ALA 38 -4.877 2.341 4.433 97 HB1 ALA 38 HB1 ALA 38 -3.378 3.627 2.114 98 HB2 ALA 38 HB2 ALA 38 -2.767 2.396 3.227 99 HB3 ALA 38 HB3 ALA 38 -4.043 1.976 2.082 100 H TRP 39 H TRP 39 -4.460 5.645 3.006 101 HA TRP 39 HA TRP 39 -3.032 6.810 5.157 102 HB2 TRP 39 HB2 TRP 39 -4.873 7.946 3.030 103 HB3 TRP 39 HB3 TRP 39 -4.127 8.974 4.236 104 HD1 TRP 39 HD1 TRP 39 -1.207 7.919 4.322 105 HE1 TRP 39 HE1 TRP 39 0.391 8.318 2.351 106 HE3 TRP 39 HE3 TRP 39 -4.651 8.708 0.616 107 HZ2 TRP 39 HZ2 TRP 39 0.203 8.992 -0.436 108 HZ3 TRP 39 HZ3 TRP 39 -3.908 9.198 -1.708 109 HH2 TRP 39 HH2 TRP 39 -1.484 9.335 -2.243 110 H ALA 40 H ALA 40 -6.594 6.486 4.776 111 HA ALA 40 HA ALA 40 -7.317 8.039 7.046 112 HB1 ALA 40 HB1 ALA 40 -8.714 5.603 5.843 113 HB2 ALA 40 HB2 ALA 40 -9.450 6.827 6.911 114 HB3 ALA 40 HB3 ALA 40 -8.887 7.294 5.287 115 H ASN 41 H ASN 41 -5.898 4.849 6.914 116 HA ASN 41 HA ASN 41 -6.325 4.378 9.828 117 HB2 ASN 41 HB2 ASN 41 -5.413 2.609 7.514 118 HB3 ASN 41 HB3 ASN 41 -5.371 2.108 9.201 119 HD21 ASN 41 HD21 ASN 41 -7.537 2.803 6.476 120 HD22 ASN 41 HD22 ASN 41 -8.952 2.151 7.288 121 H GLY 42 H GLY 42 -4.132 6.099 8.066 122 HA2 GLY 42 HA2 GLY 42 -2.132 7.019 8.752 123 HA3 GLY 42 HA3 GLY 42 -2.051 5.900 10.111 124 H TYR 43 H TYR 43 -2.471 4.443 6.954 125 HA TYR 43 HA TYR 43 0.215 3.224 7.099 126 HB2 TYR 43 HB2 TYR 43 -2.153 2.791 5.276 127 HB3 TYR 43 HB3 TYR 43 -0.598 2.042 5.019 128 HD1 TYR 43 HD1 TYR 43 -0.809 -0.228 5.374 129 HD2 TYR 43 HD2 TYR 43 -2.723 2.464 8.148 130 HE1 TYR 43 HE1 TYR 43 -1.641 -2.168 6.716 131 HE2 TYR 43 HE2 TYR 43 -3.492 0.539 9.496 132 HH TYR 43 HH TYR 43 -2.834 -2.846 8.538 133 H SER 44 H SER 44 1.564 4.941 6.729 134 HA SER 44 HA SER 44 1.665 6.054 3.954 135 HB2 SER 44 HB2 SER 44 2.668 8.099 5.002 136 HB3 SER 44 HB3 SER 44 0.961 7.829 5.380 137 HG SER 44 HG SER 44 3.233 7.463 7.046 138 H ASP 45 H ASP 45 3.731 6.620 3.153 139 HA ASP 45 HA ASP 45 5.856 6.081 2.536 140 HB2 ASP 45 HB2 ASP 45 6.455 6.146 5.513 141 HB3 ASP 45 HB3 ASP 45 7.606 6.352 4.202 142 H ILE 46 H ILE 46 4.212 3.803 2.620 143 HA ILE 46 HA ILE 46 5.104 1.576 4.110 144 HB ILE 46 HB ILE 46 3.882 1.675 1.345 145 HG12 ILE 46 HG12 ILE 46 2.406 1.239 3.981 146 HG13 ILE 46 HG13 ILE 46 2.518 2.816 3.212 147 HG21 ILE 46 HG21 ILE 46 3.435 -0.648 3.212 148 HG22 ILE 46 HG22 ILE 46 3.318 -0.587 1.451 149 HG23 ILE 46 HG23 ILE 46 4.895 -0.637 2.220 150 HD11 ILE 46 HD11 ILE 46 0.387 1.534 2.731 151 HD12 ILE 46 HD12 ILE 46 1.264 2.139 1.308 152 HD13 ILE 46 HD13 ILE 46 1.348 0.427 1.727 153 H HIS 47 H HIS 47 6.853 0.317 4.019 154 HA HIS 47 HA HIS 47 8.701 0.393 1.644 155 HB2 HIS 47 HB2 HIS 47 9.126 -0.276 4.586 156 HB3 HIS 47 HB3 HIS 47 10.337 -0.585 3.353 157 HD1 HIS 47 HD1 HIS 47 11.282 1.271 5.526 158 HD2 HIS 47 HD2 HIS 47 9.242 2.566 2.061 159 HE1 HIS 47 HE1 HIS 47 11.943 3.737 5.168 160 HE2 HIS 47 HE2 HIS 47 10.689 4.514 3.055 161 H GLU 48 H GLU 48 9.979 -1.681 1.351 162 HA GLU 48 HA GLU 48 8.317 -3.759 0.458 163 HB2 GLU 48 HB2 GLU 48 10.648 -3.352 -0.273 164 HB3 GLU 48 HB3 GLU 48 11.243 -3.899 1.300 165 HG2 GLU 48 HG2 GLU 48 10.373 -6.153 0.897 166 HG3 GLU 48 HG3 GLU 48 9.561 -5.616 -0.574 167 H GLY 49 H GLY 49 7.296 -5.413 1.342 168 HA2 GLY 49 HA2 GLY 49 7.038 -7.280 2.787 169 HA3 GLY 49 HA3 GLY 49 8.056 -6.509 4.003 170 H GLU 50 H GLU 50 6.387 -3.898 3.549 171 HA GLU 50 HA GLU 50 4.188 -4.508 5.416 172 HB2 GLU 50 HB2 GLU 50 5.221 -2.001 4.070 173 HB3 GLU 50 HB3 GLU 50 3.624 -2.030 4.810 174 HG2 GLU 50 HG2 GLU 50 4.528 -2.640 6.944 175 HG3 GLU 50 HG3 GLU 50 6.176 -2.669 6.276 176 HA PRO 51 HA PRO 51 1.017 -5.158 2.397 177 HB2 PRO 51 HB2 PRO 51 -1.186 -4.011 3.542 178 HB3 PRO 51 HB3 PRO 51 -0.409 -5.510 4.148 179 HG2 PRO 51 HG2 PRO 51 0.014 -2.675 5.145 180 HG3 PRO 51 HG3 PRO 51 -0.366 -4.133 6.120 181 HD2 PRO 51 HD2 PRO 51 2.156 -3.267 5.842 182 HD3 PRO 51 HD3 PRO 51 1.801 -5.017 5.805 183 H GLY 52 H GLY 52 0.588 -4.213 0.520 184 HA2 GLY 52 HA2 GLY 52 -0.406 -2.570 -0.856 185 HA3 GLY 52 HA3 GLY 52 -0.051 -1.311 0.326 186 H TYR 53 H TYR 53 2.853 -2.791 0.245 187 HA TYR 53 HA TYR 53 4.258 -0.981 -1.394 188 HB2 TYR 53 HB2 TYR 53 5.322 -2.274 0.323 189 HB3 TYR 53 HB3 TYR 53 4.777 -3.792 -0.369 190 HD1 TYR 53 HD1 TYR 53 5.999 -4.944 -2.068 191 HD2 TYR 53 HD2 TYR 53 7.155 -0.967 -0.846 192 HE1 TYR 53 HE1 TYR 53 8.185 -5.231 -3.223 193 HE2 TYR 53 HE2 TYR 53 9.373 -1.289 -1.971 194 HH TYR 53 HH TYR 53 10.221 -4.289 -3.713 195 H SER 54 H SER 54 2.534 -3.858 -2.269 196 HA SER 54 HA SER 54 3.885 -4.535 -4.728 197 HB2 SER 54 HB2 SER 54 1.285 -5.302 -3.389 198 HB3 SER 54 HB3 SER 54 1.669 -5.915 -4.997 199 HG SER 54 HG SER 54 3.536 -6.879 -4.139 200 H ALA 55 H ALA 55 3.096 -4.468 -6.859 201 HA ALA 55 HA ALA 55 2.156 -2.038 -7.877 202 HB1 ALA 55 HB1 ALA 55 1.954 -4.814 -9.132 203 HB2 ALA 55 HB2 ALA 55 1.958 -3.258 -9.994 204 HB3 ALA 55 HB3 ALA 55 3.409 -3.795 -9.127 205 H LYS 56 H LYS 56 0.242 -4.730 -6.718 206 HA LYS 56 HA LYS 56 -2.334 -4.175 -7.718 207 HB2 LYS 56 HB2 LYS 56 -3.155 -5.429 -5.826 208 HB3 LYS 56 HB3 LYS 56 -1.666 -6.185 -6.422 209 HG2 LYS 56 HG2 LYS 56 -0.487 -4.762 -4.561 210 HG3 LYS 56 HG3 LYS 56 -2.099 -4.530 -3.914 211 HD2 LYS 56 HD2 LYS 56 -0.734 -7.223 -4.326 212 HD3 LYS 56 HD3 LYS 56 -0.880 -6.349 -2.793 213 HE2 LYS 56 HE2 LYS 56 -3.393 -6.436 -3.046 214 HE3 LYS 56 HE3 LYS 56 -3.168 -7.466 -4.468 215 HZ1 LYS 56 HZ1 LYS 56 -3.520 -8.814 -2.503 216 HZ2 LYS 56 HZ2 LYS 56 -2.289 -8.103 -1.699 217 HZ3 LYS 56 HZ3 LYS 56 -1.980 -9.047 -3.005 218 H LEU 57 H LEU 57 -0.539 -2.293 -5.363 219 HA LEU 57 HA LEU 57 -2.954 -0.611 -4.820 220 HB2 LEU 57 HB2 LEU 57 -0.773 -1.722 -3.145 221 HB3 LEU 57 HB3 LEU 57 -0.885 0.015 -2.992 222 HG LEU 57 HG LEU 57 -2.116 -0.955 -1.251 223 HD11 LEU 57 HD11 LEU 57 -4.267 -0.068 -3.212 224 HD12 LEU 57 HD12 LEU 57 -3.080 1.069 -2.519 225 HD13 LEU 57 HD13 LEU 57 -4.194 0.195 -1.467 226 HD21 LEU 57 HD21 LEU 57 -4.016 -2.471 -1.581 227 HD22 LEU 57 HD22 LEU 57 -2.517 -3.160 -2.231 228 HD23 LEU 57 HD23 LEU 57 -3.739 -2.468 -3.332 229 H ASP 58 H ASP 58 0.552 -0.549 -5.461 230 HA ASP 58 HA ASP 58 0.466 2.363 -5.928 231 HB2 ASP 58 HB2 ASP 58 2.165 1.155 -4.483 232 HB3 ASP 58 HB3 ASP 58 2.877 0.513 -5.959 233 H ARG 59 H ARG 59 -0.617 2.588 -7.873 234 HA ARG 59 HA ARG 59 -0.356 1.160 -10.254 235 HB2 ARG 59 HB2 ARG 59 -1.148 3.222 -11.401 236 HB3 ARG 59 HB3 ARG 59 -2.113 2.771 -9.999 237 HG2 ARG 59 HG2 ARG 59 -1.152 4.521 -8.642 238 HG3 ARG 59 HG3 ARG 59 0.078 4.894 -9.850 239 HD2 ARG 59 HD2 ARG 59 -2.907 5.214 -10.330 240 HD3 ARG 59 HD3 ARG 59 -1.880 6.504 -9.715 241 HE ARG 59 HE ARG 59 -2.064 5.568 -12.459 242 HH11 ARG 59 HH11 ARG 59 0.161 7.174 -10.265 243 HH12 ARG 59 HH12 ARG 59 1.012 7.956 -11.568 244 HH21 ARG 59 HH21 ARG 59 -0.938 6.614 -14.057 245 HH22 ARG 59 HH22 ARG 59 0.401 7.645 -13.650 246 H ASP 60 H ASP 60 1.842 3.633 -9.114 247 HA ASP 60 HA ASP 60 3.429 3.697 -11.578 248 HB2 ASP 60 HB2 ASP 60 4.793 5.320 -10.276 249 HB3 ASP 60 HB3 ASP 60 3.095 5.745 -10.411 250 H HIS 61 H HIS 61 3.330 1.591 -8.963 251 HA HIS 61 HA HIS 61 4.801 0.384 -7.744 252 HB2 HIS 61 HB2 HIS 61 3.914 -0.907 -9.703 253 HB3 HIS 61 HB3 HIS 61 5.442 -0.623 -10.530 254 HD1 HIS 61 HD1 HIS 61 6.359 -3.085 -10.514 255 HD2 HIS 61 HD2 HIS 61 5.069 -1.671 -6.745 256 HE1 HIS 61 HE1 HIS 61 7.048 -4.871 -8.789 257 HE2 HIS 61 HE2 HIS 61 6.293 -3.979 -6.493 258 H ASP 62 H ASP 62 6.029 2.599 -7.522 259 HA ASP 62 HA ASP 62 8.822 2.500 -8.483 260 HB2 ASP 62 HB2 ASP 62 9.034 4.717 -7.606 261 HB3 ASP 62 HB3 ASP 62 7.525 4.606 -8.508 262 H GLY 63 H GLY 63 7.418 0.828 -6.091 263 HA2 GLY 63 HA2 GLY 63 8.358 -0.383 -4.355 264 HA3 GLY 63 HA3 GLY 63 9.869 0.518 -4.512 265 H VAL 64 H VAL 64 7.133 2.603 -4.229 266 HA VAL 64 HA VAL 64 7.107 2.563 -1.248 267 HB VAL 64 HB VAL 64 7.192 5.186 -2.797 268 HG11 VAL 64 HG11 VAL 64 7.644 6.113 -0.544 269 HG12 VAL 64 HG12 VAL 64 6.111 5.233 -0.567 270 HG13 VAL 64 HG13 VAL 64 7.550 4.482 0.154 271 HG21 VAL 64 HG21 VAL 64 9.490 5.500 -1.898 272 HG22 VAL 64 HG22 VAL 64 9.507 3.780 -1.426 273 HG23 VAL 64 HG23 VAL 64 9.379 4.251 -3.143 274 H ALA 65 H ALA 65 5.039 2.523 -0.543 275 HA ALA 65 HA ALA 65 2.926 3.445 -2.447 276 HB1 ALA 65 HB1 ALA 65 2.859 1.111 -0.502 277 HB2 ALA 65 HB2 ALA 65 1.462 1.717 -1.424 278 HB3 ALA 65 HB3 ALA 65 2.870 1.049 -2.268 279 H CYS 66 H CYS 66 1.322 4.666 -1.784 280 HA CYS 66 HA CYS 66 0.402 6.419 -0.758 281 HB2 CYS 66 HB2 CYS 66 0.530 4.866 1.812 282 HB3 CYS 66 HB3 CYS 66 -0.710 5.973 1.254 283 H GLU 67 H GLU 67 2.971 6.848 -1.218 284 HA GLU 67 HA GLU 67 4.632 7.826 0.851 285 HB2 GLU 67 HB2 GLU 67 5.660 9.181 -1.011 286 HB3 GLU 67 HB3 GLU 67 5.621 7.449 -1.240 287 HG2 GLU 67 HG2 GLU 67 3.378 9.044 -2.478 288 HG3 GLU 67 HG3 GLU 67 4.987 9.199 -3.158 289 H LEU 68 H LEU 68 5.054 9.794 1.766 290 HA LEU 68 HA LEU 68 2.975 11.941 1.523 291 HB2 LEU 68 HB2 LEU 68 4.491 10.691 3.766 292 HB3 LEU 68 HB3 LEU 68 4.436 12.431 3.842 293 HG LEU 68 HG LEU 68 2.665 11.275 5.134 294 HD11 LEU 68 HD11 LEU 68 2.412 13.625 4.441 295 HD12 LEU 68 HD12 LEU 68 0.853 12.788 4.508 296 HD13 LEU 68 HD13 LEU 68 1.618 13.109 2.937 297 HD21 LEU 68 HD21 LEU 68 0.766 10.270 4.109 298 HD22 LEU 68 HD22 LEU 68 2.195 9.491 3.391 299 HD23 LEU 68 HD23 LEU 68 1.301 10.714 2.476 300 H LYS 69 H LYS 69 6.421 11.404 1.357 301 HA LYS 69 HA LYS 69 6.916 14.248 0.536 302 HB2 LYS 69 HB2 LYS 69 8.931 14.209 1.947 303 HB3 LYS 69 HB3 LYS 69 7.445 13.991 2.873 304 HG2 LYS 69 HG2 LYS 69 7.873 11.488 2.866 305 HG3 LYS 69 HG3 LYS 69 9.437 11.802 2.090 306 HD2 LYS 69 HD2 LYS 69 10.175 13.109 3.987 307 HD3 LYS 69 HD3 LYS 69 8.570 13.052 4.731 308 HE2 LYS 69 HE2 LYS 69 10.310 10.594 4.205 309 HE3 LYS 69 HE3 LYS 69 10.268 11.479 5.733 310 HZ1 LYS 69 HZ1 LYS 69 8.762 9.648 5.889 311 HZ2 LYS 69 HZ2 LYS 69 7.970 10.017 4.512 312 HZ3 LYS 69 HZ3 LYS 69 7.844 10.989 5.828 313 H ASN 70 H ASN 70 7.614 10.917 -0.074 314 HA ASN 70 HA ASN 70 10.121 11.271 -1.476 315 HB2 ASN 70 HB2 ASN 70 9.347 9.169 -0.269 316 HB3 ASN 70 HB3 ASN 70 8.187 8.911 -1.576 317 HD21 ASN 70 HD21 ASN 70 11.679 9.255 -0.862 318 HD22 ASN 70 HD22 ASN 70 12.197 8.290 -2.235 Start of MODEL 9 1 H1 GLY 24 H1 GLY 24 -2.842 -25.445 0.848 2 H2 GLY 24 H2 GLY 24 -2.061 -24.033 0.569 3 H3 GLY 24 H3 GLY 24 -1.568 -25.405 -0.180 4 HA2 GLY 24 HA2 GLY 24 -0.930 -26.396 1.928 5 HA3 GLY 24 HA3 GLY 24 -0.042 -24.899 1.588 6 H ALA 25 H ALA 25 0.309 -24.076 3.589 7 HA ALA 25 HA ALA 25 -1.508 -24.124 5.797 8 HB1 ALA 25 HB1 ALA 25 0.958 -23.887 5.969 9 HB2 ALA 25 HB2 ALA 25 0.856 -22.281 5.210 10 HB3 ALA 25 HB3 ALA 25 0.120 -22.568 6.797 11 H SER 26 H SER 26 -2.380 -22.209 6.906 12 HA SER 26 HA SER 26 -4.143 -20.605 5.270 13 HB2 SER 26 HB2 SER 26 -3.390 -20.417 8.214 14 HB3 SER 26 HB3 SER 26 -4.655 -19.455 7.432 15 HG SER 26 HG SER 26 -4.571 -22.307 7.627 16 H GLU 27 H GLU 27 -4.176 -18.382 4.912 17 HA GLU 27 HA GLU 27 -1.974 -16.625 5.710 18 HB2 GLU 27 HB2 GLU 27 -1.153 -17.864 3.666 19 HB3 GLU 27 HB3 GLU 27 -2.493 -17.175 2.750 20 HG2 GLU 27 HG2 GLU 27 -1.599 -14.924 3.055 21 HG3 GLU 27 HG3 GLU 27 -0.406 -15.505 4.221 22 H GLU 28 H GLU 28 -2.446 -14.353 5.153 23 HA GLU 28 HA GLU 28 -5.302 -13.739 4.578 24 HB2 GLU 28 HB2 GLU 28 -4.690 -14.158 7.088 25 HB3 GLU 28 HB3 GLU 28 -3.960 -12.569 7.034 26 HG2 GLU 28 HG2 GLU 28 -6.855 -13.290 6.371 27 HG3 GLU 28 HG3 GLU 28 -6.295 -12.615 7.890 28 H ASN 29 H ASN 29 -4.143 -13.131 2.559 29 HA ASN 29 HA ASN 29 -2.389 -10.869 2.420 30 HB2 ASN 29 HB2 ASN 29 -2.539 -12.471 0.597 31 HB3 ASN 29 HB3 ASN 29 -4.263 -12.140 0.381 32 HD21 ASN 29 HD21 ASN 29 -1.086 -10.390 0.367 33 HD22 ASN 29 HD22 ASN 29 -1.586 -9.281 -0.899 34 H ILE 30 H ILE 30 -2.859 -8.894 3.123 35 HA ILE 30 HA ILE 30 -5.481 -7.681 3.240 36 HB ILE 30 HB ILE 30 -2.653 -6.590 3.425 37 HG12 ILE 30 HG12 ILE 30 -4.820 -6.818 5.564 38 HG13 ILE 30 HG13 ILE 30 -3.643 -8.094 5.268 39 HG21 ILE 30 HG21 ILE 30 -4.006 -4.734 2.581 40 HG22 ILE 30 HG22 ILE 30 -5.276 -5.061 3.789 41 HG23 ILE 30 HG23 ILE 30 -3.687 -4.459 4.280 42 HD11 ILE 30 HD11 ILE 30 -2.943 -5.273 6.172 43 HD12 ILE 30 HD12 ILE 30 -2.956 -6.742 7.158 44 HD13 ILE 30 HD13 ILE 30 -1.791 -6.591 5.834 45 H HIS 31 H HIS 31 -6.559 -6.453 1.853 46 HA HIS 31 HA HIS 31 -5.331 -5.540 -0.698 47 HB2 HIS 31 HB2 HIS 31 -6.421 -7.696 -1.166 48 HB3 HIS 31 HB3 HIS 31 -7.926 -7.121 -0.463 49 HD1 HIS 31 HD1 HIS 31 -5.950 -6.998 -3.691 50 HD2 HIS 31 HD2 HIS 31 -9.305 -5.185 -1.877 51 HE1 HIS 31 HE1 HIS 31 -7.233 -5.789 -5.575 52 HE2 HIS 31 HE2 HIS 31 -9.274 -4.685 -4.457 53 H PHE 32 H PHE 32 -5.386 -3.409 -0.310 54 HA PHE 32 HA PHE 32 -7.787 -2.024 0.744 55 HB2 PHE 32 HB2 PHE 32 -5.064 -1.103 -0.215 56 HB3 PHE 32 HB3 PHE 32 -6.336 0.010 0.258 57 HD1 PHE 32 HD1 PHE 32 -7.330 -0.241 2.633 58 HD2 PHE 32 HD2 PHE 32 -3.543 -1.920 1.432 59 HE1 PHE 32 HE1 PHE 32 -6.629 -0.361 5.014 60 HE2 PHE 32 HE2 PHE 32 -2.849 -2.046 3.816 61 HZ PHE 32 HZ PHE 32 -4.393 -1.267 5.605 62 H SER 33 H SER 33 -9.145 -0.739 -0.471 63 HA SER 33 HA SER 33 -9.393 -1.210 -3.325 64 HB2 SER 33 HB2 SER 33 -11.279 -0.749 -1.766 65 HB3 SER 33 HB3 SER 33 -10.703 0.920 -1.592 66 HG SER 33 HG SER 33 -12.363 0.656 -3.200 67 H SER 34 H SER 34 -7.953 1.382 -1.381 68 HA SER 34 HA SER 34 -6.340 2.381 -3.588 69 HB2 SER 34 HB2 SER 34 -8.402 3.573 -4.103 70 HB3 SER 34 HB3 SER 34 -8.590 4.080 -2.417 71 HG SER 34 HG SER 34 -7.606 5.587 -4.074 72 H CYS 35 H CYS 35 -4.734 3.935 -2.833 73 HA CYS 35 HA CYS 35 -3.815 3.765 -0.130 74 HB2 CYS 35 HB2 CYS 35 -3.241 5.565 -2.477 75 HB3 CYS 35 HB3 CYS 35 -2.681 6.048 -0.881 76 H LYS 36 H LYS 36 -6.354 5.750 -1.516 77 HA LYS 36 HA LYS 36 -6.419 7.789 0.505 78 HB2 LYS 36 HB2 LYS 36 -7.608 7.542 -1.825 79 HB3 LYS 36 HB3 LYS 36 -8.910 6.794 -0.898 80 HG2 LYS 36 HG2 LYS 36 -9.102 8.806 0.492 81 HG3 LYS 36 HG3 LYS 36 -7.698 9.541 -0.282 82 HD2 LYS 36 HD2 LYS 36 -10.200 8.813 -1.869 83 HD3 LYS 36 HD3 LYS 36 -10.042 10.319 -0.977 84 HE2 LYS 36 HE2 LYS 36 -9.442 10.922 -3.135 85 HE3 LYS 36 HE3 LYS 36 -7.920 10.821 -2.260 86 HZ1 LYS 36 HZ1 LYS 36 -9.000 8.765 -4.122 87 HZ2 LYS 36 HZ2 LYS 36 -7.584 8.618 -3.308 88 HZ3 LYS 36 HZ3 LYS 36 -7.762 9.776 -4.435 89 H GLU 37 H GLU 37 -7.648 4.502 0.510 90 HA GLU 37 HA GLU 37 -8.994 4.746 3.126 91 HB2 GLU 37 HB2 GLU 37 -9.789 3.232 1.340 92 HB3 GLU 37 HB3 GLU 37 -8.269 2.333 1.411 93 HG2 GLU 37 HG2 GLU 37 -8.759 1.579 3.678 94 HG3 GLU 37 HG3 GLU 37 -10.168 2.642 3.765 95 H ALA 38 H ALA 38 -5.832 3.628 1.871 96 HA ALA 38 HA ALA 38 -4.832 2.516 4.305 97 HB1 ALA 38 HB1 ALA 38 -3.846 2.181 2.041 98 HB2 ALA 38 HB2 ALA 38 -3.308 3.879 2.051 99 HB3 ALA 38 HB3 ALA 38 -2.648 2.738 3.214 100 H TRP 39 H TRP 39 -4.487 5.882 2.995 101 HA TRP 39 HA TRP 39 -3.134 6.971 5.239 102 HB2 TRP 39 HB2 TRP 39 -4.963 8.204 3.152 103 HB3 TRP 39 HB3 TRP 39 -4.186 9.163 4.402 104 HD1 TRP 39 HD1 TRP 39 -1.317 7.931 4.415 105 HE1 TRP 39 HE1 TRP 39 0.311 8.334 2.476 106 HE3 TRP 39 HE3 TRP 39 -4.697 9.164 0.775 107 HZ2 TRP 39 HZ2 TRP 39 0.182 9.252 -0.216 108 HZ3 TRP 39 HZ3 TRP 39 -3.907 9.782 -1.504 109 HH2 TRP 39 HH2 TRP 39 -1.474 9.835 -2.016 110 H ALA 40 H ALA 40 -6.655 6.498 4.823 111 HA ALA 40 HA ALA 40 -7.445 7.914 7.182 112 HB1 ALA 40 HB1 ALA 40 -9.009 7.302 5.402 113 HB2 ALA 40 HB2 ALA 40 -8.759 5.573 5.736 114 HB3 ALA 40 HB3 ALA 40 -9.535 6.610 6.946 115 H ASN 41 H ASN 41 -5.834 4.852 6.860 116 HA ASN 41 HA ASN 41 -6.308 4.144 9.725 117 HB2 ASN 41 HB2 ASN 41 -5.306 2.557 7.314 118 HB3 ASN 41 HB3 ASN 41 -5.275 1.952 8.966 119 HD21 ASN 41 HD21 ASN 41 -7.454 2.849 6.282 120 HD22 ASN 41 HD22 ASN 41 -8.845 2.071 7.014 121 H GLY 42 H GLY 42 -4.136 6.020 8.062 122 HA2 GLY 42 HA2 GLY 42 -2.063 6.847 8.637 123 HA3 GLY 42 HA3 GLY 42 -2.020 5.785 10.046 124 H TYR 43 H TYR 43 -2.571 4.206 6.990 125 HA TYR 43 HA TYR 43 0.070 2.876 7.062 126 HB2 TYR 43 HB2 TYR 43 -2.449 2.502 5.427 127 HB3 TYR 43 HB3 TYR 43 -0.931 1.757 4.979 128 HD1 TYR 43 HD1 TYR 43 -2.595 2.096 8.386 129 HD2 TYR 43 HD2 TYR 43 -1.215 -0.519 5.241 130 HE1 TYR 43 HE1 TYR 43 -3.227 0.130 9.747 131 HE2 TYR 43 HE2 TYR 43 -1.888 -2.489 6.607 132 HH TYR 43 HH TYR 43 -2.787 -3.228 8.572 133 H SER 44 H SER 44 1.574 4.359 6.503 134 HA SER 44 HA SER 44 1.463 5.669 3.814 135 HB2 SER 44 HB2 SER 44 2.501 7.019 6.323 136 HB3 SER 44 HB3 SER 44 2.186 7.739 4.734 137 HG SER 44 HG SER 44 0.586 8.168 6.417 138 H ASP 45 H ASP 45 3.540 6.310 2.989 139 HA ASP 45 HA ASP 45 5.642 5.735 2.301 140 HB2 ASP 45 HB2 ASP 45 6.250 6.026 5.263 141 HB3 ASP 45 HB3 ASP 45 7.431 6.091 3.957 142 H ILE 46 H ILE 46 4.102 3.481 2.439 143 HA ILE 46 HA ILE 46 4.995 1.318 4.033 144 HB ILE 46 HB ILE 46 3.662 1.450 1.333 145 HG12 ILE 46 HG12 ILE 46 2.341 0.633 3.931 146 HG13 ILE 46 HG13 ILE 46 2.431 2.325 3.439 147 HG21 ILE 46 HG21 ILE 46 4.373 -0.719 1.159 148 HG22 ILE 46 HG22 ILE 46 4.511 -0.953 2.906 149 HG23 ILE 46 HG23 ILE 46 2.940 -1.043 2.139 150 HD11 ILE 46 HD11 ILE 46 1.148 1.971 1.470 151 HD12 ILE 46 HD12 ILE 46 1.248 0.214 1.582 152 HD13 ILE 46 HD13 ILE 46 0.293 1.124 2.772 153 H HIS 47 H HIS 47 6.656 -0.047 3.949 154 HA HIS 47 HA HIS 47 8.640 0.093 1.703 155 HB2 HIS 47 HB2 HIS 47 8.918 -0.724 4.629 156 HB3 HIS 47 HB3 HIS 47 10.200 -0.891 3.443 157 HD1 HIS 47 HD1 HIS 47 10.476 0.972 6.033 158 HD2 HIS 47 HD2 HIS 47 9.566 2.147 2.080 159 HE1 HIS 47 HE1 HIS 47 11.247 3.419 5.804 160 HE2 HIS 47 HE2 HIS 47 10.679 4.126 3.393 161 H GLU 48 H GLU 48 9.910 -1.973 1.418 162 HA GLU 48 HA GLU 48 8.304 -4.040 0.399 163 HB2 GLU 48 HB2 GLU 48 10.672 -3.594 -0.203 164 HB3 GLU 48 HB3 GLU 48 11.185 -4.161 1.390 165 HG2 GLU 48 HG2 GLU 48 10.250 -6.420 0.868 166 HG3 GLU 48 HG3 GLU 48 9.735 -5.830 -0.712 167 H GLY 49 H GLY 49 7.196 -5.659 1.241 168 HA2 GLY 49 HA2 GLY 49 6.883 -7.570 2.620 169 HA3 GLY 49 HA3 GLY 49 7.885 -6.851 3.879 170 H GLU 50 H GLU 50 6.297 -4.206 3.504 171 HA GLU 50 HA GLU 50 4.074 -4.847 5.332 172 HB2 GLU 50 HB2 GLU 50 5.487 -2.378 4.413 173 HB3 GLU 50 HB3 GLU 50 3.771 -2.201 4.745 174 HG2 GLU 50 HG2 GLU 50 5.174 -1.645 6.675 175 HG3 GLU 50 HG3 GLU 50 4.015 -2.919 6.994 176 HA PRO 51 HA PRO 51 0.972 -5.396 2.354 177 HB2 PRO 51 HB2 PRO 51 -1.296 -4.386 3.509 178 HB3 PRO 51 HB3 PRO 51 -0.445 -5.854 4.090 179 HG2 PRO 51 HG2 PRO 51 -0.179 -3.016 5.130 180 HG3 PRO 51 HG3 PRO 51 -0.460 -4.511 6.081 181 HD2 PRO 51 HD2 PRO 51 2.010 -3.457 5.791 182 HD3 PRO 51 HD3 PRO 51 1.769 -5.232 5.762 183 H GLY 52 H GLY 52 0.615 -4.453 0.466 184 HA2 GLY 52 HA2 GLY 52 -0.394 -2.827 -0.940 185 HA3 GLY 52 HA3 GLY 52 -0.135 -1.572 0.271 186 H TYR 53 H TYR 53 2.823 -3.105 0.200 187 HA TYR 53 HA TYR 53 4.255 -1.221 -1.340 188 HB2 TYR 53 HB2 TYR 53 5.282 -2.667 0.307 189 HB3 TYR 53 HB3 TYR 53 4.757 -4.110 -0.534 190 HD1 TYR 53 HD1 TYR 53 6.058 -5.108 -2.263 191 HD2 TYR 53 HD2 TYR 53 7.065 -1.182 -0.772 192 HE1 TYR 53 HE1 TYR 53 8.275 -5.247 -3.399 193 HE2 TYR 53 HE2 TYR 53 9.307 -1.358 -1.868 194 HH TYR 53 HH TYR 53 10.694 -2.608 -3.186 195 H SER 54 H SER 54 2.501 -4.058 -2.373 196 HA SER 54 HA SER 54 3.750 -4.616 -4.865 197 HB2 SER 54 HB2 SER 54 0.936 -5.136 -3.820 198 HB3 SER 54 HB3 SER 54 1.569 -5.833 -5.312 199 HG SER 54 HG SER 54 3.230 -6.833 -4.070 200 H ALA 55 H ALA 55 3.097 -4.297 -6.988 201 HA ALA 55 HA ALA 55 2.170 -1.813 -7.913 202 HB1 ALA 55 HB1 ALA 55 2.004 -4.539 -9.278 203 HB2 ALA 55 HB2 ALA 55 2.003 -2.953 -10.079 204 HB3 ALA 55 HB3 ALA 55 3.449 -3.511 -9.219 205 H LYS 56 H LYS 56 0.268 -4.514 -6.800 206 HA LYS 56 HA LYS 56 -2.298 -3.982 -7.888 207 HB2 LYS 56 HB2 LYS 56 -1.703 -5.008 -5.081 208 HB3 LYS 56 HB3 LYS 56 -3.171 -5.258 -6.030 209 HG2 LYS 56 HG2 LYS 56 -1.801 -6.577 -7.698 210 HG3 LYS 56 HG3 LYS 56 -0.411 -6.416 -6.608 211 HD2 LYS 56 HD2 LYS 56 -1.834 -7.500 -4.781 212 HD3 LYS 56 HD3 LYS 56 -3.067 -7.778 -6.015 213 HE2 LYS 56 HE2 LYS 56 -1.906 -9.814 -5.877 214 HE3 LYS 56 HE3 LYS 56 -1.316 -9.055 -7.356 215 HZ1 LYS 56 HZ1 LYS 56 0.102 -9.031 -4.735 216 HZ2 LYS 56 HZ2 LYS 56 0.677 -8.368 -6.117 217 HZ3 LYS 56 HZ3 LYS 56 0.491 -9.980 -5.999 218 H LEU 57 H LEU 57 -0.551 -2.221 -5.423 219 HA LEU 57 HA LEU 57 -2.924 -0.489 -4.827 220 HB2 LEU 57 HB2 LEU 57 -0.696 -1.659 -3.241 221 HB3 LEU 57 HB3 LEU 57 -0.787 0.072 -3.050 222 HG LEU 57 HG LEU 57 -1.966 -1.004 -1.295 223 HD11 LEU 57 HD11 LEU 57 -2.803 1.173 -2.376 224 HD12 LEU 57 HD12 LEU 57 -3.907 0.330 -1.305 225 HD13 LEU 57 HD13 LEU 57 -4.122 0.197 -3.063 226 HD21 LEU 57 HD21 LEU 57 -2.523 -3.096 -2.554 227 HD22 LEU 57 HD22 LEU 57 -3.837 -2.218 -3.366 228 HD23 LEU 57 HD23 LEU 57 -3.874 -2.448 -1.607 229 H ASP 58 H ASP 58 0.601 -0.467 -5.309 230 HA ASP 58 HA ASP 58 0.692 2.416 -5.690 231 HB2 ASP 58 HB2 ASP 58 2.299 1.018 -4.382 232 HB3 ASP 58 HB3 ASP 58 2.874 0.290 -5.868 233 H ARG 59 H ARG 59 -0.441 2.814 -7.620 234 HA ARG 59 HA ARG 59 -0.347 1.445 -10.041 235 HB2 ARG 59 HB2 ARG 59 -0.483 4.482 -9.975 236 HB3 ARG 59 HB3 ARG 59 -1.252 3.386 -11.106 237 HG2 ARG 59 HG2 ARG 59 -1.961 3.878 -8.200 238 HG3 ARG 59 HG3 ARG 59 -2.876 4.381 -9.612 239 HD2 ARG 59 HD2 ARG 59 -2.486 1.532 -8.604 240 HD3 ARG 59 HD3 ARG 59 -3.976 2.460 -8.567 241 HE ARG 59 HE ARG 59 -2.890 0.942 -10.787 242 HH11 ARG 59 HH11 ARG 59 -5.015 3.665 -10.156 243 HH12 ARG 59 HH12 ARG 59 -5.799 3.514 -11.704 244 HH21 ARG 59 HH21 ARG 59 -3.930 0.819 -12.728 245 HH22 ARG 59 HH22 ARG 59 -5.204 1.939 -13.110 246 H ASP 60 H ASP 60 1.741 4.073 -9.082 247 HA ASP 60 HA ASP 60 3.385 4.135 -11.450 248 HB2 ASP 60 HB2 ASP 60 4.806 5.642 -10.201 249 HB3 ASP 60 HB3 ASP 60 3.113 6.049 -9.948 250 H HIS 61 H HIS 61 3.385 1.897 -8.892 251 HA HIS 61 HA HIS 61 4.868 0.637 -7.799 252 HB2 HIS 61 HB2 HIS 61 3.911 -0.620 -9.730 253 HB3 HIS 61 HB3 HIS 61 5.413 -0.341 -10.608 254 HD1 HIS 61 HD1 HIS 61 6.461 -2.741 -10.599 255 HD2 HIS 61 HD2 HIS 61 5.038 -1.446 -6.835 256 HE1 HIS 61 HE1 HIS 61 7.196 -4.521 -8.887 257 HE2 HIS 61 HE2 HIS 61 6.352 -3.704 -6.594 258 H ASP 62 H ASP 62 6.139 3.021 -7.876 259 HA ASP 62 HA ASP 62 8.958 2.713 -8.557 260 HB2 ASP 62 HB2 ASP 62 9.275 4.830 -7.396 261 HB3 ASP 62 HB3 ASP 62 7.937 4.899 -8.535 262 H GLY 63 H GLY 63 7.210 1.234 -6.103 263 HA2 GLY 63 HA2 GLY 63 8.131 -0.292 -4.556 264 HA3 GLY 63 HA3 GLY 63 9.694 0.521 -4.634 265 H VAL 64 H VAL 64 7.099 2.739 -4.227 266 HA VAL 64 HA VAL 64 7.024 2.488 -1.255 267 HB VAL 64 HB VAL 64 7.199 5.217 -2.588 268 HG11 VAL 64 HG11 VAL 64 6.130 5.075 -0.343 269 HG12 VAL 64 HG12 VAL 64 7.574 4.258 0.288 270 HG13 VAL 64 HG13 VAL 64 7.671 5.940 -0.274 271 HG21 VAL 64 HG21 VAL 64 9.505 5.393 -1.720 272 HG22 VAL 64 HG22 VAL 64 9.472 3.652 -1.329 273 HG23 VAL 64 HG23 VAL 64 9.353 4.205 -3.020 274 H ALA 65 H ALA 65 4.984 2.438 -0.585 275 HA ALA 65 HA ALA 65 2.870 3.416 -2.441 276 HB1 ALA 65 HB1 ALA 65 2.589 1.105 -2.303 277 HB2 ALA 65 HB2 ALA 65 3.024 1.006 -0.620 278 HB3 ALA 65 HB3 ALA 65 1.450 1.693 -1.089 279 H CYS 66 H CYS 66 1.281 4.660 -1.782 280 HA CYS 66 HA CYS 66 0.360 6.423 -0.769 281 HB2 CYS 66 HB2 CYS 66 0.454 4.909 1.821 282 HB3 CYS 66 HB3 CYS 66 -0.798 5.972 1.196 283 H GLU 67 H GLU 67 2.955 6.808 -1.180 284 HA GLU 67 HA GLU 67 4.576 7.705 0.963 285 HB2 GLU 67 HB2 GLU 67 5.799 8.952 -0.822 286 HB3 GLU 67 HB3 GLU 67 5.601 7.242 -1.122 287 HG2 GLU 67 HG2 GLU 67 3.541 9.065 -2.351 288 HG3 GLU 67 HG3 GLU 67 5.173 9.142 -2.987 289 H LEU 68 H LEU 68 5.131 9.703 1.766 290 HA LEU 68 HA LEU 68 3.077 11.875 1.535 291 HB2 LEU 68 HB2 LEU 68 4.864 10.853 3.763 292 HB3 LEU 68 HB3 LEU 68 4.097 12.428 3.877 293 HG LEU 68 HG LEU 68 2.530 9.851 3.425 294 HD11 LEU 68 HD11 LEU 68 3.032 11.410 5.984 295 HD12 LEU 68 HD12 LEU 68 3.650 9.789 5.582 296 HD13 LEU 68 HD13 LEU 68 1.911 10.040 5.786 297 HD21 LEU 68 HD21 LEU 68 0.968 11.399 2.812 298 HD22 LEU 68 HD22 LEU 68 1.808 12.749 3.597 299 HD23 LEU 68 HD23 LEU 68 0.799 11.657 4.552 300 H LYS 69 H LYS 69 5.633 11.470 -0.118 301 HA LYS 69 HA LYS 69 6.990 14.075 0.311 302 HB2 LYS 69 HB2 LYS 69 7.323 12.014 -1.913 303 HB3 LYS 69 HB3 LYS 69 8.340 13.425 -1.629 304 HG2 LYS 69 HG2 LYS 69 8.082 10.972 0.159 305 HG3 LYS 69 HG3 LYS 69 9.457 11.448 -0.832 306 HD2 LYS 69 HD2 LYS 69 9.654 13.555 0.606 307 HD3 LYS 69 HD3 LYS 69 8.393 12.882 1.643 308 HE2 LYS 69 HE2 LYS 69 10.491 12.419 2.668 309 HE3 LYS 69 HE3 LYS 69 9.807 10.898 2.100 310 HZ1 LYS 69 HZ1 LYS 69 11.316 11.002 0.194 311 HZ2 LYS 69 HZ2 LYS 69 12.186 11.118 1.566 312 HZ3 LYS 69 HZ3 LYS 69 11.903 12.450 0.672 313 H ASN 70 H ASN 70 6.370 15.874 -0.536 314 HA ASN 70 HA ASN 70 4.901 16.053 -3.112 315 HB2 ASN 70 HB2 ASN 70 3.199 15.971 -1.277 316 HB3 ASN 70 HB3 ASN 70 3.975 17.354 -0.512 317 HD21 ASN 70 HD21 ASN 70 1.784 18.299 -0.672 318 HD22 ASN 70 HD22 ASN 70 1.315 19.046 -2.192 Start of MODEL 10 1 H1 GLY 24 H1 GLY 24 -15.571 -15.582 3.745 2 H2 GLY 24 H2 GLY 24 -16.470 -16.746 3.026 3 H3 GLY 24 H3 GLY 24 -16.938 -16.124 4.469 4 HA2 GLY 24 HA2 GLY 24 -15.044 -17.061 5.587 5 HA3 GLY 24 HA3 GLY 24 -15.981 -18.321 4.764 6 H ALA 25 H ALA 25 -13.176 -18.374 5.519 7 HA ALA 25 HA ALA 25 -11.096 -18.824 4.790 8 HB1 ALA 25 HB1 ALA 25 -12.377 -20.811 4.087 9 HB2 ALA 25 HB2 ALA 25 -12.590 -20.097 2.470 10 HB3 ALA 25 HB3 ALA 25 -10.967 -20.524 3.052 11 H SER 26 H SER 26 -11.928 -16.166 4.022 12 HA SER 26 HA SER 26 -11.079 -15.423 1.409 13 HB2 SER 26 HB2 SER 26 -11.060 -13.785 3.973 14 HB3 SER 26 HB3 SER 26 -11.004 -13.148 2.318 15 HG SER 26 HG SER 26 -13.137 -13.126 3.175 16 H GLU 27 H GLU 27 -9.212 -14.119 0.822 17 HA GLU 27 HA GLU 27 -6.757 -15.412 1.281 18 HB2 GLU 27 HB2 GLU 27 -7.502 -13.997 -0.679 19 HB3 GLU 27 HB3 GLU 27 -7.132 -12.558 0.282 20 HG2 GLU 27 HG2 GLU 27 -4.778 -13.303 0.484 21 HG3 GLU 27 HG3 GLU 27 -5.149 -14.773 -0.416 22 H GLU 28 H GLU 28 -5.256 -15.315 2.874 23 HA GLU 28 HA GLU 28 -5.639 -13.656 5.178 24 HB2 GLU 28 HB2 GLU 28 -3.748 -14.772 6.113 25 HB3 GLU 28 HB3 GLU 28 -4.735 -15.914 5.241 26 HG2 GLU 28 HG2 GLU 28 -2.660 -16.624 4.625 27 HG3 GLU 28 HG3 GLU 28 -3.083 -15.613 3.255 28 H ASN 29 H ASN 29 -3.772 -13.104 2.286 29 HA ASN 29 HA ASN 29 -2.066 -11.014 3.352 30 HB2 ASN 29 HB2 ASN 29 -2.903 -11.817 0.543 31 HB3 ASN 29 HB3 ASN 29 -1.902 -10.408 0.852 32 HD21 ASN 29 HD21 ASN 29 -1.666 -13.622 0.033 33 HD22 ASN 29 HD22 ASN 29 -0.058 -13.917 0.681 34 H ILE 30 H ILE 30 -2.318 -8.900 3.449 35 HA ILE 30 HA ILE 30 -4.926 -7.688 3.626 36 HB ILE 30 HB ILE 30 -2.092 -6.618 3.654 37 HG12 ILE 30 HG12 ILE 30 -4.086 -6.727 5.953 38 HG13 ILE 30 HG13 ILE 30 -3.065 -8.113 5.575 39 HG21 ILE 30 HG21 ILE 30 -3.432 -4.751 2.896 40 HG22 ILE 30 HG22 ILE 30 -4.699 -5.094 4.103 41 HG23 ILE 30 HG23 ILE 30 -3.113 -4.497 4.607 42 HD11 ILE 30 HD11 ILE 30 -1.039 -6.739 5.923 43 HD12 ILE 30 HD12 ILE 30 -2.076 -5.362 6.392 44 HD13 ILE 30 HD13 ILE 30 -2.064 -6.844 7.360 45 H HIS 31 H HIS 31 -6.026 -6.422 2.269 46 HA HIS 31 HA HIS 31 -5.033 -5.902 -0.482 47 HB2 HIS 31 HB2 HIS 31 -7.116 -6.924 -1.404 48 HB3 HIS 31 HB3 HIS 31 -5.979 -8.060 -0.702 49 HD1 HIS 31 HD1 HIS 31 -6.756 -9.319 1.602 50 HD2 HIS 31 HD2 HIS 31 -9.538 -6.719 -0.249 51 HE1 HIS 31 HE1 HIS 31 -9.043 -9.759 2.724 52 HE2 HIS 31 HE2 HIS 31 -10.729 -8.174 1.583 53 H PHE 32 H PHE 32 -4.951 -3.718 0.083 54 HA PHE 32 HA PHE 32 -7.343 -2.264 0.949 55 HB2 PHE 32 HB2 PHE 32 -4.603 -1.405 -0.008 56 HB3 PHE 32 HB3 PHE 32 -5.861 -0.262 0.423 57 HD1 PHE 32 HD1 PHE 32 -6.948 -0.583 2.799 58 HD2 PHE 32 HD2 PHE 32 -3.061 -2.076 1.663 59 HE1 PHE 32 HE1 PHE 32 -6.282 -0.676 5.191 60 HE2 PHE 32 HE2 PHE 32 -2.397 -2.152 4.058 61 HZ PHE 32 HZ PHE 32 -4.013 -1.461 5.819 62 H SER 33 H SER 33 -8.861 -1.329 -0.278 63 HA SER 33 HA SER 33 -9.034 -1.705 -3.127 64 HB2 SER 33 HB2 SER 33 -10.942 -1.474 -1.463 65 HB3 SER 33 HB3 SER 33 -10.594 0.261 -1.406 66 HG SER 33 HG SER 33 -11.486 -1.320 -3.603 67 H SER 34 H SER 34 -7.873 0.971 -1.136 68 HA SER 34 HA SER 34 -6.456 2.218 -3.353 69 HB2 SER 34 HB2 SER 34 -8.683 3.245 -3.671 70 HB3 SER 34 HB3 SER 34 -8.750 3.672 -1.955 71 HG SER 34 HG SER 34 -7.176 4.778 -4.021 72 H CYS 35 H CYS 35 -4.848 3.695 -2.578 73 HA CYS 35 HA CYS 35 -3.919 3.596 0.108 74 HB2 CYS 35 HB2 CYS 35 -3.474 5.486 -2.199 75 HB3 CYS 35 HB3 CYS 35 -2.878 5.906 -0.599 76 H LYS 36 H LYS 36 -6.565 5.534 -1.231 77 HA LYS 36 HA LYS 36 -6.747 7.527 0.823 78 HB2 LYS 36 HB2 LYS 36 -8.922 6.169 -0.809 79 HB3 LYS 36 HB3 LYS 36 -9.160 7.595 0.214 80 HG2 LYS 36 HG2 LYS 36 -7.420 8.815 -1.120 81 HG3 LYS 36 HG3 LYS 36 -7.325 7.440 -2.224 82 HD2 LYS 36 HD2 LYS 36 -9.817 9.108 -1.667 83 HD3 LYS 36 HD3 LYS 36 -8.768 9.251 -3.085 84 HE2 LYS 36 HE2 LYS 36 -9.280 6.879 -3.687 85 HE3 LYS 36 HE3 LYS 36 -10.379 6.778 -2.306 86 HZ1 LYS 36 HZ1 LYS 36 -11.594 7.301 -4.332 87 HZ2 LYS 36 HZ2 LYS 36 -10.698 8.637 -4.602 88 HZ3 LYS 36 HZ3 LYS 36 -11.701 8.570 -3.312 89 H GLU 37 H GLU 37 -7.885 4.166 0.825 90 HA GLU 37 HA GLU 37 -9.165 4.385 3.450 91 HB2 GLU 37 HB2 GLU 37 -9.693 2.717 1.518 92 HB3 GLU 37 HB3 GLU 37 -8.248 1.856 2.034 93 HG2 GLU 37 HG2 GLU 37 -9.956 0.732 3.136 94 HG3 GLU 37 HG3 GLU 37 -9.352 1.796 4.397 95 H ALA 38 H ALA 38 -6.004 3.312 2.201 96 HA ALA 38 HA ALA 38 -4.964 2.256 4.641 97 HB1 ALA 38 HB1 ALA 38 -3.415 3.482 2.324 98 HB2 ALA 38 HB2 ALA 38 -2.877 2.210 3.431 99 HB3 ALA 38 HB3 ALA 38 -4.153 1.862 2.270 100 H TRP 39 H TRP 39 -4.583 5.541 3.174 101 HA TRP 39 HA TRP 39 -3.059 6.721 5.248 102 HB2 TRP 39 HB2 TRP 39 -5.007 7.833 3.205 103 HB3 TRP 39 HB3 TRP 39 -4.219 8.878 4.370 104 HD1 TRP 39 HD1 TRP 39 -1.292 7.829 4.339 105 HE1 TRP 39 HE1 TRP 39 0.218 8.150 2.294 106 HE3 TRP 39 HE3 TRP 39 -4.889 8.595 0.779 107 HZ2 TRP 39 HZ2 TRP 39 -0.089 8.742 -0.507 108 HZ3 TRP 39 HZ3 TRP 39 -4.249 9.001 -1.591 109 HH2 TRP 39 HH2 TRP 39 -1.850 9.071 -2.243 110 H ALA 40 H ALA 40 -6.622 6.366 5.042 111 HA ALA 40 HA ALA 40 -7.224 7.918 7.363 112 HB1 ALA 40 HB1 ALA 40 -8.724 5.552 6.163 113 HB2 ALA 40 HB2 ALA 40 -9.386 6.772 7.269 114 HB3 ALA 40 HB3 ALA 40 -8.869 7.246 5.641 115 H ASN 41 H ASN 41 -5.869 4.709 7.088 116 HA ASN 41 HA ASN 41 -6.198 4.144 9.996 117 HB2 ASN 41 HB2 ASN 41 -5.278 2.477 7.609 118 HB3 ASN 41 HB3 ASN 41 -5.153 1.933 9.277 119 HD21 ASN 41 HD21 ASN 41 -7.474 2.669 6.670 120 HD22 ASN 41 HD22 ASN 41 -8.816 1.912 7.512 121 H GLY 42 H GLY 42 -4.092 5.978 8.224 122 HA2 GLY 42 HA2 GLY 42 -2.118 6.962 8.910 123 HA3 GLY 42 HA3 GLY 42 -1.974 5.810 10.238 124 H TYR 43 H TYR 43 -2.428 4.365 7.096 125 HA TYR 43 HA TYR 43 0.299 3.242 7.147 126 HB2 TYR 43 HB2 TYR 43 -2.109 2.801 5.378 127 HB3 TYR 43 HB3 TYR 43 -0.541 2.127 5.021 128 HD1 TYR 43 HD1 TYR 43 -2.511 2.324 8.278 129 HD2 TYR 43 HD2 TYR 43 -0.673 -0.170 5.269 130 HE1 TYR 43 HE1 TYR 43 -3.060 0.327 9.613 131 HE2 TYR 43 HE2 TYR 43 -1.290 -2.189 6.609 132 HH TYR 43 HH TYR 43 -2.971 -1.957 9.750 133 H SER 44 H SER 44 1.849 4.567 6.502 134 HA SER 44 HA SER 44 1.760 5.849 3.835 135 HB2 SER 44 HB2 SER 44 2.721 7.925 4.849 136 HB3 SER 44 HB3 SER 44 1.025 7.637 5.274 137 HG SER 44 HG SER 44 2.283 8.267 7.092 138 H ASP 45 H ASP 45 3.860 6.493 3.070 139 HA ASP 45 HA ASP 45 5.961 5.848 2.449 140 HB2 ASP 45 HB2 ASP 45 6.403 7.478 4.246 141 HB3 ASP 45 HB3 ASP 45 6.468 6.173 5.427 142 H ILE 46 H ILE 46 4.356 3.684 2.452 143 HA ILE 46 HA ILE 46 5.201 1.429 4.023 144 HB ILE 46 HB ILE 46 3.925 1.558 1.284 145 HG12 ILE 46 HG12 ILE 46 2.514 1.045 3.934 146 HG13 ILE 46 HG13 ILE 46 2.577 2.635 3.187 147 HG21 ILE 46 HG21 ILE 46 3.380 -0.737 1.423 148 HG22 ILE 46 HG22 ILE 46 5.014 -0.733 2.036 149 HG23 ILE 46 HG23 ILE 46 3.651 -0.806 3.162 150 HD11 ILE 46 HD11 ILE 46 1.215 2.042 1.394 151 HD12 ILE 46 HD12 ILE 46 1.490 0.312 1.563 152 HD13 ILE 46 HD13 ILE 46 0.486 1.163 2.754 153 H HIS 47 H HIS 47 7.037 0.312 3.899 154 HA HIS 47 HA HIS 47 8.752 0.406 1.438 155 HB2 HIS 47 HB2 HIS 47 9.444 -0.263 4.330 156 HB3 HIS 47 HB3 HIS 47 10.569 -0.348 2.983 157 HD1 HIS 47 HD1 HIS 47 11.411 1.523 5.248 158 HD2 HIS 47 HD2 HIS 47 8.946 2.703 2.030 159 HE1 HIS 47 HE1 HIS 47 11.536 4.096 5.126 160 HE2 HIS 47 HE2 HIS 47 9.941 4.795 3.213 161 H GLU 48 H GLU 48 10.027 -1.584 1.093 162 HA GLU 48 HA GLU 48 8.560 -3.819 0.378 163 HB2 GLU 48 HB2 GLU 48 10.737 -4.963 0.227 164 HB3 GLU 48 HB3 GLU 48 10.781 -3.326 -0.427 165 HG2 GLU 48 HG2 GLU 48 11.667 -2.628 1.934 166 HG3 GLU 48 HG3 GLU 48 12.011 -4.346 2.138 167 H GLY 49 H GLY 49 7.678 -5.528 1.288 168 HA2 GLY 49 HA2 GLY 49 7.479 -7.325 2.821 169 HA3 GLY 49 HA3 GLY 49 8.429 -6.443 4.013 170 H GLU 50 H GLU 50 6.672 -3.938 3.503 171 HA GLU 50 HA GLU 50 4.475 -4.661 5.344 172 HB2 GLU 50 HB2 GLU 50 5.478 -2.048 4.167 173 HB3 GLU 50 HB3 GLU 50 3.954 -2.130 5.012 174 HG2 GLU 50 HG2 GLU 50 6.607 -2.965 6.241 175 HG3 GLU 50 HG3 GLU 50 5.871 -1.374 6.408 176 HA PRO 51 HA PRO 51 1.361 -5.314 2.366 177 HB2 PRO 51 HB2 PRO 51 -0.898 -4.224 3.474 178 HB3 PRO 51 HB3 PRO 51 -0.081 -5.693 4.103 179 HG2 PRO 51 HG2 PRO 51 0.262 -2.831 5.059 180 HG3 PRO 51 HG3 PRO 51 -0.095 -4.278 6.057 181 HD2 PRO 51 HD2 PRO 51 2.404 -3.380 5.809 182 HD3 PRO 51 HD3 PRO 51 2.092 -5.139 5.746 183 H GLY 52 H GLY 52 0.802 -4.435 0.487 184 HA2 GLY 52 HA2 GLY 52 -0.148 -2.843 -0.952 185 HA3 GLY 52 HA3 GLY 52 0.109 -1.565 0.237 186 H TYR 53 H TYR 53 3.086 -2.994 0.196 187 HA TYR 53 HA TYR 53 4.431 -1.110 -1.440 188 HB2 TYR 53 HB2 TYR 53 5.548 -2.362 0.289 189 HB3 TYR 53 HB3 TYR 53 5.091 -3.899 -0.422 190 HD1 TYR 53 HD1 TYR 53 6.332 -4.910 -2.225 191 HD2 TYR 53 HD2 TYR 53 7.376 -0.990 -0.743 192 HE1 TYR 53 HE1 TYR 53 8.515 -5.051 -3.409 193 HE2 TYR 53 HE2 TYR 53 9.576 -1.155 -1.919 194 HH TYR 53 HH TYR 53 10.516 -4.013 -3.846 195 H SER 54 H SER 54 2.790 -4.041 -2.287 196 HA SER 54 HA SER 54 4.082 -4.667 -4.799 197 HB2 SER 54 HB2 SER 54 1.504 -5.488 -3.436 198 HB3 SER 54 HB3 SER 54 1.887 -6.030 -5.072 199 HG SER 54 HG SER 54 3.522 -6.415 -2.758 200 H ALA 55 H ALA 55 3.234 -4.554 -6.895 201 HA ALA 55 HA ALA 55 2.199 -2.112 -7.811 202 HB1 ALA 55 HB1 ALA 55 2.023 -3.259 -9.965 203 HB2 ALA 55 HB2 ALA 55 3.506 -3.764 -9.137 204 HB3 ALA 55 HB3 ALA 55 2.095 -4.844 -9.163 205 H LYS 56 H LYS 56 0.369 -4.842 -6.595 206 HA LYS 56 HA LYS 56 -2.229 -4.298 -7.596 207 HB2 LYS 56 HB2 LYS 56 -3.062 -5.403 -5.567 208 HB3 LYS 56 HB3 LYS 56 -1.797 -6.331 -6.363 209 HG2 LYS 56 HG2 LYS 56 -0.368 -6.183 -4.600 210 HG3 LYS 56 HG3 LYS 56 -0.772 -4.510 -4.244 211 HD2 LYS 56 HD2 LYS 56 -1.519 -5.615 -2.341 212 HD3 LYS 56 HD3 LYS 56 -2.986 -5.382 -3.277 213 HE2 LYS 56 HE2 LYS 56 -3.178 -7.582 -2.538 214 HE3 LYS 56 HE3 LYS 56 -2.590 -7.781 -4.192 215 HZ1 LYS 56 HZ1 LYS 56 -0.892 -7.859 -1.744 216 HZ2 LYS 56 HZ2 LYS 56 -0.348 -8.117 -3.267 217 HZ3 LYS 56 HZ3 LYS 56 -1.381 -9.171 -2.576 218 H LEU 57 H LEU 57 -0.402 -2.414 -5.292 219 HA LEU 57 HA LEU 57 -2.804 -0.725 -4.677 220 HB2 LEU 57 HB2 LEU 57 -0.492 -1.747 -3.124 221 HB3 LEU 57 HB3 LEU 57 -0.640 -0.012 -2.999 222 HG LEU 57 HG LEU 57 -1.723 -1.031 -1.166 223 HD11 LEU 57 HD11 LEU 57 -3.992 -0.061 -2.937 224 HD12 LEU 57 HD12 LEU 57 -2.720 1.031 -2.340 225 HD13 LEU 57 HD13 LEU 57 -3.752 0.186 -1.197 226 HD21 LEU 57 HD21 LEU 57 -3.391 -2.690 -1.277 227 HD22 LEU 57 HD22 LEU 57 -2.206 -3.188 -2.480 228 HD23 LEU 57 HD23 LEU 57 -3.710 -2.399 -3.002 229 H ASP 58 H ASP 58 0.710 -0.601 -5.327 230 HA ASP 58 HA ASP 58 0.560 2.277 -5.847 231 HB2 ASP 58 HB2 ASP 58 2.328 1.159 -4.479 232 HB3 ASP 58 HB3 ASP 58 2.967 0.419 -5.946 233 H ARG 59 H ARG 59 -0.513 2.597 -7.729 234 HA ARG 59 HA ARG 59 -0.426 1.206 -10.131 235 HB2 ARG 59 HB2 ARG 59 -1.364 3.193 -11.151 236 HB3 ARG 59 HB3 ARG 59 -2.044 2.959 -9.539 237 HG2 ARG 59 HG2 ARG 59 -0.390 4.698 -8.670 238 HG3 ARG 59 HG3 ARG 59 0.106 4.974 -10.341 239 HD2 ARG 59 HD2 ARG 59 -2.760 5.147 -10.298 240 HD3 ARG 59 HD3 ARG 59 -2.185 6.004 -8.878 241 HE ARG 59 HE ARG 59 -1.193 7.634 -10.215 242 HH11 ARG 59 HH11 ARG 59 -2.259 5.043 -12.324 243 HH12 ARG 59 HH12 ARG 59 -1.942 5.964 -13.768 244 HH21 ARG 59 HH21 ARG 59 -0.826 8.756 -12.100 245 HH22 ARG 59 HH22 ARG 59 -1.164 8.013 -13.636 246 H ASP 60 H ASP 60 1.940 3.521 -9.055 247 HA ASP 60 HA ASP 60 3.423 3.492 -11.612 248 HB2 ASP 60 HB2 ASP 60 4.833 5.190 -10.490 249 HB3 ASP 60 HB3 ASP 60 3.127 5.613 -10.545 250 H HIS 61 H HIS 61 3.382 1.525 -8.907 251 HA HIS 61 HA HIS 61 4.911 0.474 -7.593 252 HB2 HIS 61 HB2 HIS 61 3.970 -1.003 -9.382 253 HB3 HIS 61 HB3 HIS 61 5.476 -0.808 -10.274 254 HD1 HIS 61 HD1 HIS 61 5.106 -1.540 -6.429 255 HD2 HIS 61 HD2 HIS 61 6.582 -3.159 -10.046 256 HE1 HIS 61 HE1 HIS 61 6.407 -3.660 -5.795 257 HE2 HIS 61 HE2 HIS 61 7.277 -4.663 -8.008 258 H ASP 62 H ASP 62 6.138 2.689 -7.583 259 HA ASP 62 HA ASP 62 8.936 2.467 -8.494 260 HB2 ASP 62 HB2 ASP 62 9.215 4.705 -7.712 261 HB3 ASP 62 HB3 ASP 62 7.728 4.605 -8.639 262 H GLY 63 H GLY 63 7.555 0.821 -6.145 263 HA2 GLY 63 HA2 GLY 63 8.448 -0.332 -4.350 264 HA3 GLY 63 HA3 GLY 63 9.946 0.597 -4.476 265 H VAL 64 H VAL 64 7.184 2.646 -4.316 266 HA VAL 64 HA VAL 64 7.111 2.691 -1.331 267 HB VAL 64 HB VAL 64 7.097 5.253 -2.973 268 HG11 VAL 64 HG11 VAL 64 7.474 4.654 -0.002 269 HG12 VAL 64 HG12 VAL 64 7.535 6.265 -0.748 270 HG13 VAL 64 HG13 VAL 64 6.022 5.349 -0.750 271 HG21 VAL 64 HG21 VAL 64 9.380 5.687 -2.137 272 HG22 VAL 64 HG22 VAL 64 9.460 4.013 -1.528 273 HG23 VAL 64 HG23 VAL 64 9.323 4.339 -3.275 274 H ALA 65 H ALA 65 5.091 2.623 -0.602 275 HA ALA 65 HA ALA 65 2.883 3.383 -2.460 276 HB1 ALA 65 HB1 ALA 65 2.748 1.060 -2.322 277 HB2 ALA 65 HB2 ALA 65 3.198 0.992 -0.634 278 HB3 ALA 65 HB3 ALA 65 1.585 1.589 -1.098 279 H CYS 66 H CYS 66 1.231 4.515 -1.751 280 HA CYS 66 HA CYS 66 0.252 6.243 -0.752 281 HB2 CYS 66 HB2 CYS 66 0.543 4.743 1.841 282 HB3 CYS 66 HB3 CYS 66 -0.749 5.817 1.334 283 H GLU 67 H GLU 67 2.713 6.942 -1.310 284 HA GLU 67 HA GLU 67 4.232 8.114 0.841 285 HB2 GLU 67 HB2 GLU 67 5.412 9.276 -1.013 286 HB3 GLU 67 HB3 GLU 67 5.379 7.536 -1.147 287 HG2 GLU 67 HG2 GLU 67 3.277 9.082 -2.661 288 HG3 GLU 67 HG3 GLU 67 4.939 9.178 -3.208 289 H LEU 68 H LEU 68 4.543 10.282 1.442 290 HA LEU 68 HA LEU 68 2.287 12.185 0.891 291 HB2 LEU 68 HB2 LEU 68 4.014 11.645 3.335 292 HB3 LEU 68 HB3 LEU 68 3.222 13.184 3.143 293 HG LEU 68 HG LEU 68 1.976 11.795 4.622 294 HD11 LEU 68 HD11 LEU 68 0.741 13.416 3.195 295 HD12 LEU 68 HD12 LEU 68 -0.239 12.021 3.685 296 HD13 LEU 68 HD13 LEU 68 0.400 12.110 2.035 297 HD21 LEU 68 HD21 LEU 68 1.354 9.917 2.334 298 HD22 LEU 68 HD22 LEU 68 0.893 9.770 4.044 299 HD23 LEU 68 HD23 LEU 68 2.599 9.599 3.555 300 H LYS 69 H LYS 69 5.028 11.736 -0.485 301 HA LYS 69 HA LYS 69 6.554 14.150 -0.072 302 HB2 LYS 69 HB2 LYS 69 6.565 12.256 -2.460 303 HB3 LYS 69 HB3 LYS 69 7.828 13.408 -2.034 304 HG2 LYS 69 HG2 LYS 69 6.997 11.015 -0.319 305 HG3 LYS 69 HG3 LYS 69 8.328 11.004 -1.449 306 HD2 LYS 69 HD2 LYS 69 8.225 13.035 0.819 307 HD3 LYS 69 HD3 LYS 69 8.798 11.402 1.097 308 HE2 LYS 69 HE2 LYS 69 9.953 13.160 -1.105 309 HE3 LYS 69 HE3 LYS 69 10.548 13.217 0.557 310 HZ1 LYS 69 HZ1 LYS 69 11.840 11.660 -0.786 311 HZ2 LYS 69 HZ2 LYS 69 10.519 10.760 -1.116 312 HZ3 LYS 69 HZ3 LYS 69 11.081 10.860 0.414 313 H ASN 70 H ASN 70 6.024 16.070 -0.590 314 HA ASN 70 HA ASN 70 4.420 16.728 -3.034 315 HB2 ASN 70 HB2 ASN 70 3.111 17.049 -0.967 316 HB3 ASN 70 HB3 ASN 70 4.402 18.028 -0.271 317 HD21 ASN 70 HD21 ASN 70 2.258 17.937 -3.168 318 HD22 ASN 70 HD22 ASN 70 2.072 19.684 -3.236 Start of MODEL 11 1 H1 GLY 24 H1 GLY 24 -13.748 -23.714 -0.927 2 H2 GLY 24 H2 GLY 24 -13.523 -22.510 -2.015 3 H3 GLY 24 H3 GLY 24 -12.356 -23.635 -1.788 4 HA2 GLY 24 HA2 GLY 24 -13.238 -21.658 0.214 5 HA3 GLY 24 HA3 GLY 24 -11.984 -22.885 0.472 6 H ALA 25 H ALA 25 -11.228 -20.406 0.975 7 HA ALA 25 HA ALA 25 -9.226 -19.810 -1.106 8 HB1 ALA 25 HB1 ALA 25 -11.158 -18.377 -1.708 9 HB2 ALA 25 HB2 ALA 25 -11.190 -17.714 -0.058 10 HB3 ALA 25 HB3 ALA 25 -9.804 -17.400 -1.124 11 H SER 26 H SER 26 -7.671 -18.142 -0.318 12 HA SER 26 HA SER 26 -7.142 -18.286 2.625 13 HB2 SER 26 HB2 SER 26 -5.160 -18.822 0.382 14 HB3 SER 26 HB3 SER 26 -4.774 -18.748 2.110 15 HG SER 26 HG SER 26 -6.087 -20.550 2.462 16 H GLU 27 H GLU 27 -8.348 -16.134 1.679 17 HA GLU 27 HA GLU 27 -6.636 -13.992 0.788 18 HB2 GLU 27 HB2 GLU 27 -9.142 -14.355 0.406 19 HB3 GLU 27 HB3 GLU 27 -9.393 -13.751 2.043 20 HG2 GLU 27 HG2 GLU 27 -8.299 -11.602 1.371 21 HG3 GLU 27 HG3 GLU 27 -7.969 -12.265 -0.222 22 H GLU 28 H GLU 28 -5.383 -15.093 3.001 23 HA GLU 28 HA GLU 28 -5.756 -13.573 5.445 24 HB2 GLU 28 HB2 GLU 28 -4.610 -15.896 4.927 25 HB3 GLU 28 HB3 GLU 28 -3.173 -14.940 4.616 26 HG2 GLU 28 HG2 GLU 28 -4.821 -14.926 7.194 27 HG3 GLU 28 HG3 GLU 28 -3.415 -15.942 6.924 28 H ASN 29 H ASN 29 -3.869 -13.108 2.483 29 HA ASN 29 HA ASN 29 -2.158 -10.989 3.392 30 HB2 ASN 29 HB2 ASN 29 -3.144 -11.849 0.637 31 HB3 ASN 29 HB3 ASN 29 -2.051 -10.491 0.872 32 HD21 ASN 29 HD21 ASN 29 -1.057 -12.318 -0.732 33 HD22 ASN 29 HD22 ASN 29 0.159 -13.282 0.097 34 H ILE 30 H ILE 30 -2.376 -8.854 3.496 35 HA ILE 30 HA ILE 30 -4.959 -7.588 3.614 36 HB ILE 30 HB ILE 30 -2.120 -6.517 3.646 37 HG12 ILE 30 HG12 ILE 30 -4.201 -6.754 5.874 38 HG13 ILE 30 HG13 ILE 30 -2.978 -7.981 5.568 39 HG21 ILE 30 HG21 ILE 30 -4.733 -4.994 4.108 40 HG22 ILE 30 HG22 ILE 30 -3.126 -4.369 4.496 41 HG23 ILE 30 HG23 ILE 30 -3.533 -4.690 2.824 42 HD11 ILE 30 HD11 ILE 30 -2.303 -6.569 7.414 43 HD12 ILE 30 HD12 ILE 30 -1.176 -6.403 6.063 44 HD13 ILE 30 HD13 ILE 30 -2.367 -5.120 6.401 45 H HIS 31 H HIS 31 -6.026 -6.308 2.253 46 HA HIS 31 HA HIS 31 -5.087 -5.890 -0.531 47 HB2 HIS 31 HB2 HIS 31 -7.193 -6.980 -1.365 48 HB3 HIS 31 HB3 HIS 31 -6.000 -8.066 -0.678 49 HD1 HIS 31 HD1 HIS 31 -6.642 -9.262 1.698 50 HD2 HIS 31 HD2 HIS 31 -9.584 -6.825 -0.121 51 HE1 HIS 31 HE1 HIS 31 -8.854 -9.725 2.943 52 HE2 HIS 31 HE2 HIS 31 -10.645 -8.263 1.808 53 H PHE 32 H PHE 32 -5.047 -3.671 0.079 54 HA PHE 32 HA PHE 32 -7.490 -2.257 0.853 55 HB2 PHE 32 HB2 PHE 32 -4.777 -1.358 -0.140 56 HB3 PHE 32 HB3 PHE 32 -6.066 -0.232 0.252 57 HD1 PHE 32 HD1 PHE 32 -7.118 -0.446 2.640 58 HD2 PHE 32 HD2 PHE 32 -3.228 -1.963 1.547 59 HE1 PHE 32 HE1 PHE 32 -6.440 -0.437 5.030 60 HE2 PHE 32 HE2 PHE 32 -2.562 -1.969 3.941 61 HZ PHE 32 HZ PHE 32 -4.168 -1.199 5.681 62 H SER 33 H SER 33 -8.971 -1.268 -0.400 63 HA SER 33 HA SER 33 -9.131 -1.715 -3.255 64 HB2 SER 33 HB2 SER 33 -11.072 -1.447 -1.688 65 HB3 SER 33 HB3 SER 33 -10.656 0.264 -1.516 66 HG SER 33 HG SER 33 -11.558 -1.139 -3.825 67 H SER 34 H SER 34 -8.137 1.055 -1.256 68 HA SER 34 HA SER 34 -6.595 2.283 -3.448 69 HB2 SER 34 HB2 SER 34 -8.910 3.691 -2.030 70 HB3 SER 34 HB3 SER 34 -7.659 4.540 -2.943 71 HG SER 34 HG SER 34 -8.323 3.383 -4.812 72 H CYS 35 H CYS 35 -4.939 3.672 -2.649 73 HA CYS 35 HA CYS 35 -4.014 3.519 0.001 74 HB2 CYS 35 HB2 CYS 35 -3.538 5.438 -2.269 75 HB3 CYS 35 HB3 CYS 35 -2.936 5.852 -0.673 76 H LYS 36 H LYS 36 -6.596 5.610 -1.161 77 HA LYS 36 HA LYS 36 -6.687 7.538 0.928 78 HB2 LYS 36 HB2 LYS 36 -9.044 6.250 -0.505 79 HB3 LYS 36 HB3 LYS 36 -9.047 7.777 0.386 80 HG2 LYS 36 HG2 LYS 36 -7.321 8.658 -1.253 81 HG3 LYS 36 HG3 LYS 36 -7.540 7.173 -2.195 82 HD2 LYS 36 HD2 LYS 36 -10.024 7.738 -2.349 83 HD3 LYS 36 HD3 LYS 36 -9.651 9.268 -1.548 84 HE2 LYS 36 HE2 LYS 36 -9.669 9.855 -3.807 85 HE3 LYS 36 HE3 LYS 36 -7.952 9.694 -3.435 86 HZ1 LYS 36 HZ1 LYS 36 -8.046 7.450 -4.447 87 HZ2 LYS 36 HZ2 LYS 36 -8.523 8.582 -5.517 88 HZ3 LYS 36 HZ3 LYS 36 -9.635 7.643 -4.788 89 H GLU 37 H GLU 37 -7.898 4.212 0.913 90 HA GLU 37 HA GLU 37 -9.077 4.353 3.586 91 HB2 GLU 37 HB2 GLU 37 -9.850 2.860 1.752 92 HB3 GLU 37 HB3 GLU 37 -8.321 1.975 1.834 93 HG2 GLU 37 HG2 GLU 37 -8.831 1.200 4.087 94 HG3 GLU 37 HG3 GLU 37 -10.240 2.266 4.178 95 H ALA 38 H ALA 38 -5.941 3.344 2.224 96 HA ALA 38 HA ALA 38 -4.845 2.239 4.637 97 HB1 ALA 38 HB1 ALA 38 -2.772 2.256 3.400 98 HB2 ALA 38 HB2 ALA 38 -4.056 1.877 2.257 99 HB3 ALA 38 HB3 ALA 38 -3.358 3.514 2.306 100 H TRP 39 H TRP 39 -4.504 5.544 3.181 101 HA TRP 39 HA TRP 39 -3.039 6.730 5.296 102 HB2 TRP 39 HB2 TRP 39 -4.967 7.857 3.242 103 HB3 TRP 39 HB3 TRP 39 -4.167 8.881 4.416 104 HD1 TRP 39 HD1 TRP 39 -1.249 7.835 4.374 105 HE1 TRP 39 HE1 TRP 39 0.264 8.243 2.339 106 HE3 TRP 39 HE3 TRP 39 -4.846 8.619 0.818 107 HZ2 TRP 39 HZ2 TRP 39 -0.043 8.869 -0.451 108 HZ3 TRP 39 HZ3 TRP 39 -4.204 9.089 -1.540 109 HH2 TRP 39 HH2 TRP 39 -1.806 9.212 -2.184 110 H ALA 40 H ALA 40 -6.596 6.309 5.044 111 HA ALA 40 HA ALA 40 -7.266 7.818 7.367 112 HB1 ALA 40 HB1 ALA 40 -9.380 6.584 7.271 113 HB2 ALA 40 HB2 ALA 40 -8.878 7.078 5.643 114 HB3 ALA 40 HB3 ALA 40 -8.667 5.392 6.168 115 H ASN 41 H ASN 41 -5.789 4.661 7.118 116 HA ASN 41 HA ASN 41 -6.097 4.113 10.034 117 HB2 ASN 41 HB2 ASN 41 -5.191 2.436 7.649 118 HB3 ASN 41 HB3 ASN 41 -5.041 1.903 9.319 119 HD21 ASN 41 HD21 ASN 41 -7.385 2.580 6.729 120 HD22 ASN 41 HD22 ASN 41 -8.720 1.834 7.592 121 H GLY 42 H GLY 42 -4.066 6.006 8.287 122 HA2 GLY 42 HA2 GLY 42 -2.052 6.961 8.858 123 HA3 GLY 42 HA3 GLY 42 -1.893 5.851 10.220 124 H TYR 43 H TYR 43 -2.415 4.302 7.140 125 HA TYR 43 HA TYR 43 0.315 3.192 7.141 126 HB2 TYR 43 HB2 TYR 43 -2.128 2.698 5.438 127 HB3 TYR 43 HB3 TYR 43 -0.556 2.043 5.050 128 HD1 TYR 43 HD1 TYR 43 -2.051 2.201 8.539 129 HD2 TYR 43 HD2 TYR 43 -1.046 -0.225 5.106 130 HE1 TYR 43 HE1 TYR 43 -2.591 0.168 9.824 131 HE2 TYR 43 HE2 TYR 43 -1.628 -2.268 6.411 132 HH TYR 43 HH TYR 43 -2.727 -2.124 9.809 133 H SER 44 H SER 44 1.544 5.030 6.781 134 HA SER 44 HA SER 44 1.692 5.933 3.938 135 HB2 SER 44 HB2 SER 44 2.686 8.039 4.794 136 HB3 SER 44 HB3 SER 44 1.001 7.821 5.286 137 HG SER 44 HG SER 44 2.303 8.512 7.042 138 H ASP 45 H ASP 45 3.897 6.554 3.294 139 HA ASP 45 HA ASP 45 6.012 5.910 2.789 140 HB2 ASP 45 HB2 ASP 45 6.367 5.941 5.802 141 HB3 ASP 45 HB3 ASP 45 7.639 6.114 4.592 142 H ILE 46 H ILE 46 4.294 3.721 2.694 143 HA ILE 46 HA ILE 46 5.216 1.344 3.958 144 HB ILE 46 HB ILE 46 3.922 1.758 1.257 145 HG12 ILE 46 HG12 ILE 46 2.533 0.830 3.793 146 HG13 ILE 46 HG13 ILE 46 2.571 2.524 3.299 147 HG21 ILE 46 HG21 ILE 46 3.212 -0.824 2.125 148 HG22 ILE 46 HG22 ILE 46 4.388 -0.397 0.870 149 HG23 ILE 46 HG23 ILE 46 4.903 -0.706 2.530 150 HD11 ILE 46 HD11 ILE 46 1.373 2.082 1.262 151 HD12 ILE 46 HD12 ILE 46 1.469 0.336 1.474 152 HD13 ILE 46 HD13 ILE 46 0.487 1.312 2.588 153 H HIS 47 H HIS 47 7.012 0.223 3.743 154 HA HIS 47 HA HIS 47 8.788 0.471 1.335 155 HB2 HIS 47 HB2 HIS 47 9.394 -0.253 4.239 156 HB3 HIS 47 HB3 HIS 47 10.571 -0.346 2.938 157 HD1 HIS 47 HD1 HIS 47 10.614 1.668 5.581 158 HD2 HIS 47 HD2 HIS 47 9.914 2.511 1.501 159 HE1 HIS 47 HE1 HIS 47 11.294 4.128 5.218 160 HE2 HIS 47 HE2 HIS 47 10.856 4.632 2.729 161 H GLU 48 H GLU 48 10.185 -1.629 1.118 162 HA GLU 48 HA GLU 48 8.568 -3.808 0.336 163 HB2 GLU 48 HB2 GLU 48 10.824 -3.476 -0.504 164 HB3 GLU 48 HB3 GLU 48 11.498 -3.650 1.111 165 HG2 GLU 48 HG2 GLU 48 11.947 -5.635 -0.124 166 HG3 GLU 48 HG3 GLU 48 10.824 -6.023 1.167 167 H GLY 49 H GLY 49 7.891 -5.659 1.247 168 HA2 GLY 49 HA2 GLY 49 7.473 -7.267 2.876 169 HA3 GLY 49 HA3 GLY 49 8.416 -6.357 4.056 170 H GLU 50 H GLU 50 6.671 -3.849 3.363 171 HA GLU 50 HA GLU 50 4.517 -4.464 5.287 172 HB2 GLU 50 HB2 GLU 50 5.716 -1.962 4.137 173 HB3 GLU 50 HB3 GLU 50 4.031 -1.903 4.624 174 HG2 GLU 50 HG2 GLU 50 5.333 -1.149 6.441 175 HG3 GLU 50 HG3 GLU 50 4.644 -2.706 6.878 176 HA PRO 51 HA PRO 51 1.304 -5.214 2.430 177 HB2 PRO 51 HB2 PRO 51 -0.918 -4.140 3.619 178 HB3 PRO 51 HB3 PRO 51 -0.058 -5.592 4.228 179 HG2 PRO 51 HG2 PRO 51 0.278 -2.717 5.148 180 HG3 PRO 51 HG3 PRO 51 -0.009 -4.165 6.165 181 HD2 PRO 51 HD2 PRO 51 2.472 -3.203 5.785 182 HD3 PRO 51 HD3 PRO 51 2.188 -4.971 5.776 183 H GLY 52 H GLY 52 0.939 -4.345 0.518 184 HA2 GLY 52 HA2 GLY 52 -0.138 -2.800 -0.925 185 HA3 GLY 52 HA3 GLY 52 0.125 -1.490 0.226 186 H TYR 53 H TYR 53 3.103 -2.948 0.172 187 HA TYR 53 HA TYR 53 4.443 -1.105 -1.508 188 HB2 TYR 53 HB2 TYR 53 5.556 -2.403 0.210 189 HB3 TYR 53 HB3 TYR 53 5.104 -3.917 -0.550 190 HD1 TYR 53 HD1 TYR 53 7.284 -0.917 -0.887 191 HD2 TYR 53 HD2 TYR 53 6.419 -4.900 -2.305 192 HE1 TYR 53 HE1 TYR 53 9.505 -1.014 -2.036 193 HE2 TYR 53 HE2 TYR 53 8.568 -4.927 -3.552 194 HH TYR 53 HH TYR 53 10.892 -2.202 -3.414 195 H SER 54 H SER 54 2.766 -4.056 -2.334 196 HA SER 54 HA SER 54 4.001 -4.691 -4.826 197 HB2 SER 54 HB2 SER 54 1.284 -5.348 -3.620 198 HB3 SER 54 HB3 SER 54 1.866 -6.046 -5.134 199 HG SER 54 HG SER 54 2.401 -7.390 -3.355 200 H ALA 55 H ALA 55 3.245 -4.511 -6.944 201 HA ALA 55 HA ALA 55 2.237 -2.073 -7.903 202 HB1 ALA 55 HB1 ALA 55 3.515 -3.798 -9.195 203 HB2 ALA 55 HB2 ALA 55 2.062 -4.816 -9.227 204 HB3 ALA 55 HB3 ALA 55 2.063 -3.237 -10.041 205 H LYS 56 H LYS 56 0.445 -4.784 -6.686 206 HA LYS 56 HA LYS 56 -2.193 -4.346 -7.628 207 HB2 LYS 56 HB2 LYS 56 -1.217 -5.323 -4.902 208 HB3 LYS 56 HB3 LYS 56 -2.845 -5.542 -5.520 209 HG2 LYS 56 HG2 LYS 56 -0.314 -6.726 -6.756 210 HG3 LYS 56 HG3 LYS 56 -1.422 -7.586 -5.704 211 HD2 LYS 56 HD2 LYS 56 -2.276 -6.374 -8.373 212 HD3 LYS 56 HD3 LYS 56 -1.685 -8.022 -8.199 213 HE2 LYS 56 HE2 LYS 56 -3.501 -8.739 -6.930 214 HE3 LYS 56 HE3 LYS 56 -3.963 -7.112 -6.429 215 HZ1 LYS 56 HZ1 LYS 56 -4.880 -6.673 -8.539 216 HZ2 LYS 56 HZ2 LYS 56 -5.379 -8.191 -8.218 217 HZ3 LYS 56 HZ3 LYS 56 -4.151 -7.944 -9.263 218 H LEU 57 H LEU 57 -0.387 -2.434 -5.346 219 HA LEU 57 HA LEU 57 -2.810 -0.767 -4.741 220 HB2 LEU 57 HB2 LEU 57 -0.517 -1.786 -3.156 221 HB3 LEU 57 HB3 LEU 57 -0.676 -0.051 -3.027 222 HG LEU 57 HG LEU 57 -1.797 -1.134 -1.221 223 HD11 LEU 57 HD11 LEU 57 -3.758 0.162 -1.237 224 HD12 LEU 57 HD12 LEU 57 -4.029 -0.065 -2.978 225 HD13 LEU 57 HD13 LEU 57 -2.723 0.986 -2.386 226 HD21 LEU 57 HD21 LEU 57 -2.282 -3.264 -2.492 227 HD22 LEU 57 HD22 LEU 57 -3.672 -2.437 -3.229 228 HD23 LEU 57 HD23 LEU 57 -3.612 -2.686 -1.476 229 H ASP 58 H ASP 58 0.672 -0.679 -5.502 230 HA ASP 58 HA ASP 58 0.538 2.226 -5.968 231 HB2 ASP 58 HB2 ASP 58 2.224 1.124 -4.495 232 HB3 ASP 58 HB3 ASP 58 2.938 0.357 -5.914 233 H ARG 59 H ARG 59 -0.581 2.360 -7.918 234 HA ARG 59 HA ARG 59 -0.233 1.017 -10.287 235 HB2 ARG 59 HB2 ARG 59 -1.333 2.772 -11.397 236 HB3 ARG 59 HB3 ARG 59 -1.992 2.714 -9.775 237 HG2 ARG 59 HG2 ARG 59 0.001 4.768 -10.852 238 HG3 ARG 59 HG3 ARG 59 -1.724 5.003 -10.596 239 HD2 ARG 59 HD2 ARG 59 -1.386 4.614 -8.140 240 HD3 ARG 59 HD3 ARG 59 0.366 4.550 -8.437 241 HE ARG 59 HE ARG 59 -0.711 6.957 -9.548 242 HH11 ARG 59 HH11 ARG 59 0.188 5.613 -6.440 243 HH12 ARG 59 HH12 ARG 59 0.275 7.179 -5.684 244 HH21 ARG 59 HH21 ARG 59 -0.506 8.926 -8.539 245 HH22 ARG 59 HH22 ARG 59 -0.067 9.003 -6.858 246 H ASP 60 H ASP 60 2.000 3.415 -9.138 247 HA ASP 60 HA ASP 60 3.540 3.454 -11.666 248 HB2 ASP 60 HB2 ASP 60 4.882 5.174 -10.514 249 HB3 ASP 60 HB3 ASP 60 3.168 5.562 -10.588 250 H HIS 61 H HIS 61 3.465 1.471 -8.981 251 HA HIS 61 HA HIS 61 4.940 0.402 -7.646 252 HB2 HIS 61 HB2 HIS 61 4.091 -1.021 -9.535 253 HB3 HIS 61 HB3 HIS 61 5.649 -0.814 -10.327 254 HD1 HIS 61 HD1 HIS 61 6.411 -3.345 -10.097 255 HD2 HIS 61 HD2 HIS 61 5.231 -1.513 -6.475 256 HE1 HIS 61 HE1 HIS 61 7.036 -4.982 -8.209 257 HE2 HIS 61 HE2 HIS 61 6.358 -3.828 -6.004 258 H ASP 62 H ASP 62 6.156 2.706 -7.669 259 HA ASP 62 HA ASP 62 8.960 2.506 -8.508 260 HB2 ASP 62 HB2 ASP 62 9.195 4.755 -7.756 261 HB3 ASP 62 HB3 ASP 62 7.704 4.618 -8.672 262 H GLY 63 H GLY 63 7.575 0.921 -6.079 263 HA2 GLY 63 HA2 GLY 63 8.543 -0.211 -4.309 264 HA3 GLY 63 HA3 GLY 63 10.013 0.757 -4.453 265 H VAL 64 H VAL 64 7.167 2.693 -4.281 266 HA VAL 64 HA VAL 64 7.072 2.724 -1.305 267 HB VAL 64 HB VAL 64 7.023 5.330 -2.870 268 HG11 VAL 64 HG11 VAL 64 7.430 6.280 -0.621 269 HG12 VAL 64 HG12 VAL 64 5.966 5.289 -0.619 270 HG13 VAL 64 HG13 VAL 64 7.468 4.647 0.074 271 HG21 VAL 64 HG21 VAL 64 9.275 4.479 -3.215 272 HG22 VAL 64 HG22 VAL 64 9.294 5.806 -2.050 273 HG23 VAL 64 HG23 VAL 64 9.436 4.125 -1.476 274 H ALA 65 H ALA 65 5.013 2.692 -0.609 275 HA ALA 65 HA ALA 65 2.866 3.458 -2.541 276 HB1 ALA 65 HB1 ALA 65 1.523 1.606 -1.604 277 HB2 ALA 65 HB2 ALA 65 3.029 1.030 -2.347 278 HB3 ALA 65 HB3 ALA 65 2.902 1.117 -0.596 279 H CYS 66 H CYS 66 1.085 4.451 -1.777 280 HA CYS 66 HA CYS 66 0.163 6.222 -0.761 281 HB2 CYS 66 HB2 CYS 66 0.409 4.679 1.808 282 HB3 CYS 66 HB3 CYS 66 -0.878 5.752 1.287 283 H GLU 67 H GLU 67 2.773 6.714 -1.235 284 HA GLU 67 HA GLU 67 4.385 7.751 0.825 285 HB2 GLU 67 HB2 GLU 67 5.286 9.243 -1.027 286 HB3 GLU 67 HB3 GLU 67 5.426 7.516 -1.226 287 HG2 GLU 67 HG2 GLU 67 3.080 8.885 -2.539 288 HG3 GLU 67 HG3 GLU 67 4.687 9.132 -3.198 289 H LEU 68 H LEU 68 4.436 9.523 2.093 290 HA LEU 68 HA LEU 68 2.524 11.760 1.606 291 HB2 LEU 68 HB2 LEU 68 1.730 9.813 3.194 292 HB3 LEU 68 HB3 LEU 68 2.871 10.510 4.337 293 HG LEU 68 HG LEU 68 1.582 12.758 3.920 294 HD11 LEU 68 HD11 LEU 68 -0.593 10.859 3.003 295 HD12 LEU 68 HD12 LEU 68 0.307 11.932 1.914 296 HD13 LEU 68 HD13 LEU 68 -0.696 12.614 3.202 297 HD21 LEU 68 HD21 LEU 68 0.174 10.458 5.324 298 HD22 LEU 68 HD22 LEU 68 -0.139 12.191 5.570 299 HD23 LEU 68 HD23 LEU 68 1.429 11.510 6.022 300 H LYS 69 H LYS 69 5.445 11.602 1.305 301 HA LYS 69 HA LYS 69 6.323 13.815 3.124 302 HB2 LYS 69 HB2 LYS 69 7.914 11.390 2.196 303 HB3 LYS 69 HB3 LYS 69 8.610 12.775 3.034 304 HG2 LYS 69 HG2 LYS 69 6.504 10.919 4.198 305 HG3 LYS 69 HG3 LYS 69 8.241 10.875 4.527 306 HD2 LYS 69 HD2 LYS 69 8.045 13.247 5.405 307 HD3 LYS 69 HD3 LYS 69 6.278 13.087 5.242 308 HE2 LYS 69 HE2 LYS 69 6.362 11.066 6.724 309 HE3 LYS 69 HE3 LYS 69 8.103 11.291 6.897 310 HZ1 LYS 69 HZ1 LYS 69 7.556 12.571 8.651 311 HZ2 LYS 69 HZ2 LYS 69 5.983 12.679 8.240 312 HZ3 LYS 69 HZ3 LYS 69 7.067 13.720 7.602 313 H ASN 70 H ASN 70 5.171 14.669 0.995 314 HA ASN 70 HA ASN 70 6.789 15.116 -1.343 315 HB2 ASN 70 HB2 ASN 70 4.322 15.471 -1.270 316 HB3 ASN 70 HB3 ASN 70 4.549 16.809 -0.138 317 HD21 ASN 70 HD21 ASN 70 5.641 15.733 -3.404 318 HD22 ASN 70 HD22 ASN 70 5.623 17.355 -4.081 Start of MODEL 12 1 H1 GLY 24 H1 GLY 24 -16.653 -18.724 11.036 2 H2 GLY 24 H2 GLY 24 -15.468 -19.602 10.328 3 H3 GLY 24 H3 GLY 24 -15.256 -19.008 11.840 4 HA2 GLY 24 HA2 GLY 24 -15.518 -17.378 9.390 5 HA3 GLY 24 HA3 GLY 24 -15.306 -16.741 11.030 6 H ALA 25 H ALA 25 -13.718 -17.992 8.238 7 HA ALA 25 HA ALA 25 -11.107 -18.420 9.554 8 HB1 ALA 25 HB1 ALA 25 -10.419 -19.219 7.392 9 HB2 ALA 25 HB2 ALA 25 -12.028 -19.886 7.700 10 HB3 ALA 25 HB3 ALA 25 -11.837 -18.503 6.598 11 H SER 26 H SER 26 -9.184 -17.428 8.269 12 HA SER 26 HA SER 26 -9.616 -14.637 7.341 13 HB2 SER 26 HB2 SER 26 -7.634 -15.404 9.524 14 HB3 SER 26 HB3 SER 26 -7.758 -13.820 8.747 15 HG SER 26 HG SER 26 -9.891 -13.648 9.599 16 H GLU 27 H GLU 27 -8.390 -14.159 5.638 17 HA GLU 27 HA GLU 27 -6.382 -16.003 4.552 18 HB2 GLU 27 HB2 GLU 27 -7.531 -13.316 3.699 19 HB3 GLU 27 HB3 GLU 27 -6.146 -14.023 2.887 20 HG2 GLU 27 HG2 GLU 27 -8.083 -14.593 1.629 21 HG3 GLU 27 HG3 GLU 27 -7.398 -16.049 2.338 22 H GLU 28 H GLU 28 -4.264 -15.105 3.789 23 HA GLU 28 HA GLU 28 -2.891 -13.562 5.958 24 HB2 GLU 28 HB2 GLU 28 -1.765 -15.711 4.125 25 HB3 GLU 28 HB3 GLU 28 -0.899 -14.852 5.406 26 HG2 GLU 28 HG2 GLU 28 -2.597 -15.768 7.058 27 HG3 GLU 28 HG3 GLU 28 -3.209 -16.797 5.759 28 H ASN 29 H ASN 29 -4.225 -12.466 3.516 29 HA ASN 29 HA ASN 29 -1.947 -10.891 2.427 30 HB2 ASN 29 HB2 ASN 29 -2.696 -12.926 0.972 31 HB3 ASN 29 HB3 ASN 29 -4.151 -11.998 0.638 32 HD21 ASN 29 HD21 ASN 29 -1.478 -12.857 -0.849 33 HD22 ASN 29 HD22 ASN 29 -1.067 -11.376 -1.698 34 H ILE 30 H ILE 30 -2.394 -8.756 2.259 35 HA ILE 30 HA ILE 30 -5.104 -7.784 3.071 36 HB ILE 30 HB ILE 30 -2.329 -6.596 3.241 37 HG12 ILE 30 HG12 ILE 30 -4.445 -6.980 5.404 38 HG13 ILE 30 HG13 ILE 30 -3.248 -8.218 5.027 39 HG21 ILE 30 HG21 ILE 30 -3.763 -4.746 2.517 40 HG22 ILE 30 HG22 ILE 30 -4.995 -5.178 3.731 41 HG23 ILE 30 HG23 ILE 30 -3.418 -4.548 4.223 42 HD11 ILE 30 HD11 ILE 30 -2.593 -5.424 6.054 43 HD12 ILE 30 HD12 ILE 30 -2.592 -6.928 6.986 44 HD13 ILE 30 HD13 ILE 30 -1.424 -6.718 5.677 45 H HIS 31 H HIS 31 -6.349 -6.757 1.733 46 HA HIS 31 HA HIS 31 -5.338 -5.738 -0.894 47 HB2 HIS 31 HB2 HIS 31 -7.883 -7.326 -0.355 48 HB3 HIS 31 HB3 HIS 31 -7.484 -6.543 -1.878 49 HD1 HIS 31 HD1 HIS 31 -4.853 -7.501 -2.812 50 HD2 HIS 31 HD2 HIS 31 -7.448 -9.870 -0.482 51 HE1 HIS 31 HE1 HIS 31 -4.202 -9.956 -3.273 52 HE2 HIS 31 HE2 HIS 31 -5.806 -11.392 -1.859 53 H PHE 32 H PHE 32 -5.278 -3.613 -0.264 54 HA PHE 32 HA PHE 32 -7.723 -2.242 0.704 55 HB2 PHE 32 HB2 PHE 32 -4.981 -1.253 -0.133 56 HB3 PHE 32 HB3 PHE 32 -6.283 -0.196 0.392 57 HD1 PHE 32 HD1 PHE 32 -3.360 -1.805 1.469 58 HD2 PHE 32 HD2 PHE 32 -7.392 -0.937 2.746 59 HE1 PHE 32 HE1 PHE 32 -2.675 -2.081 3.837 60 HE2 PHE 32 HE2 PHE 32 -6.699 -1.216 5.114 61 HZ PHE 32 HZ PHE 32 -4.348 -1.790 5.661 62 H SER 33 H SER 33 -9.084 -1.058 -0.558 63 HA SER 33 HA SER 33 -9.225 -1.456 -3.398 64 HB2 SER 33 HB2 SER 33 -11.156 -1.008 -1.925 65 HB3 SER 33 HB3 SER 33 -10.567 0.640 -1.644 66 HG SER 33 HG SER 33 -12.165 0.520 -3.307 67 H SER 34 H SER 34 -8.072 1.289 -1.436 68 HA SER 34 HA SER 34 -6.322 2.317 -3.567 69 HB2 SER 34 HB2 SER 34 -8.700 3.879 -2.454 70 HB3 SER 34 HB3 SER 34 -7.306 4.661 -3.215 71 HG SER 34 HG SER 34 -9.040 4.303 -4.683 72 H CYS 35 H CYS 35 -4.700 3.741 -2.730 73 HA CYS 35 HA CYS 35 -3.906 3.591 -0.039 74 HB2 CYS 35 HB2 CYS 35 -3.250 5.447 -2.312 75 HB3 CYS 35 HB3 CYS 35 -2.712 5.876 -0.696 76 H LYS 36 H LYS 36 -6.297 5.829 -1.378 77 HA LYS 36 HA LYS 36 -6.482 7.735 0.721 78 HB2 LYS 36 HB2 LYS 36 -8.578 6.476 -1.085 79 HB3 LYS 36 HB3 LYS 36 -8.977 7.731 0.077 80 HG2 LYS 36 HG2 LYS 36 -6.983 8.062 -2.206 81 HG3 LYS 36 HG3 LYS 36 -8.663 8.617 -2.189 82 HD2 LYS 36 HD2 LYS 36 -8.013 9.931 -0.039 83 HD3 LYS 36 HD3 LYS 36 -6.341 9.655 -0.523 84 HE2 LYS 36 HE2 LYS 36 -8.498 11.079 -2.147 85 HE3 LYS 36 HE3 LYS 36 -7.203 11.856 -1.232 86 HZ1 LYS 36 HZ1 LYS 36 -5.597 10.746 -2.724 87 HZ2 LYS 36 HZ2 LYS 36 -6.599 11.732 -3.544 88 HZ3 LYS 36 HZ3 LYS 36 -6.824 10.121 -3.613 89 H GLU 37 H GLU 37 -7.761 4.425 0.686 90 HA GLU 37 HA GLU 37 -9.042 4.742 3.316 91 HB2 GLU 37 HB2 GLU 37 -9.928 3.292 1.514 92 HB3 GLU 37 HB3 GLU 37 -8.499 2.257 1.635 93 HG2 GLU 37 HG2 GLU 37 -9.101 1.558 3.866 94 HG3 GLU 37 HG3 GLU 37 -10.332 2.820 3.999 95 H ALA 38 H ALA 38 -5.963 3.461 2.069 96 HA ALA 38 HA ALA 38 -5.056 2.264 4.512 97 HB1 ALA 38 HB1 ALA 38 -2.957 2.092 3.365 98 HB2 ALA 38 HB2 ALA 38 -4.202 1.890 2.137 99 HB3 ALA 38 HB3 ALA 38 -3.347 3.444 2.289 100 H TRP 39 H TRP 39 -4.444 5.551 3.117 101 HA TRP 39 HA TRP 39 -2.921 6.606 5.252 102 HB2 TRP 39 HB2 TRP 39 -4.781 7.871 3.216 103 HB3 TRP 39 HB3 TRP 39 -3.964 8.840 4.425 104 HD1 TRP 39 HD1 TRP 39 -1.090 7.681 4.407 105 HE1 TRP 39 HE1 TRP 39 0.467 8.037 2.404 106 HE3 TRP 39 HE3 TRP 39 -4.589 8.644 0.814 107 HZ2 TRP 39 HZ2 TRP 39 0.234 8.786 -0.376 108 HZ3 TRP 39 HZ3 TRP 39 -3.897 9.109 -1.536 109 HH2 TRP 39 HH2 TRP 39 -1.486 9.188 -2.133 110 H ALA 40 H ALA 40 -6.496 6.447 4.981 111 HA ALA 40 HA ALA 40 -7.056 7.963 7.336 112 HB1 ALA 40 HB1 ALA 40 -8.702 7.437 5.565 113 HB2 ALA 40 HB2 ALA 40 -8.663 5.721 6.037 114 HB3 ALA 40 HB3 ALA 40 -9.277 6.944 7.169 115 H ASN 41 H ASN 41 -5.938 4.662 6.985 116 HA ASN 41 HA ASN 41 -6.365 4.019 9.858 117 HB2 ASN 41 HB2 ASN 41 -5.448 2.413 7.429 118 HB3 ASN 41 HB3 ASN 41 -5.372 1.794 9.072 119 HD21 ASN 41 HD21 ASN 41 -7.614 2.712 6.462 120 HD22 ASN 41 HD22 ASN 41 -8.998 1.972 7.249 121 H GLY 42 H GLY 42 -4.122 5.829 8.246 122 HA2 GLY 42 HA2 GLY 42 -2.135 6.692 9.057 123 HA3 GLY 42 HA3 GLY 42 -2.068 5.448 10.307 124 H TYR 43 H TYR 43 -2.520 4.141 7.125 125 HA TYR 43 HA TYR 43 0.199 3.000 7.134 126 HB2 TYR 43 HB2 TYR 43 -2.216 2.621 5.361 127 HB3 TYR 43 HB3 TYR 43 -0.647 1.968 4.969 128 HD1 TYR 43 HD1 TYR 43 -2.218 1.986 8.432 129 HD2 TYR 43 HD2 TYR 43 -1.150 -0.310 4.928 130 HE1 TYR 43 HE1 TYR 43 -2.766 -0.092 9.632 131 HE2 TYR 43 HE2 TYR 43 -1.762 -2.403 6.149 132 HH TYR 43 HH TYR 43 -2.885 -2.382 9.536 133 H SER 44 H SER 44 1.682 4.491 6.664 134 HA SER 44 HA SER 44 1.710 5.714 3.960 135 HB2 SER 44 HB2 SER 44 2.650 7.786 4.919 136 HB3 SER 44 HB3 SER 44 0.994 7.491 5.473 137 HG SER 44 HG SER 44 2.371 8.111 7.204 138 H ASP 45 H ASP 45 3.927 6.400 3.341 139 HA ASP 45 HA ASP 45 6.043 5.703 2.787 140 HB2 ASP 45 HB2 ASP 45 6.192 5.997 5.804 141 HB3 ASP 45 HB3 ASP 45 7.605 5.540 4.870 142 H ILE 46 H ILE 46 4.277 3.566 2.596 143 HA ILE 46 HA ILE 46 5.102 1.185 3.964 144 HB ILE 46 HB ILE 46 3.828 1.529 1.258 145 HG12 ILE 46 HG12 ILE 46 2.408 0.844 3.862 146 HG13 ILE 46 HG13 ILE 46 2.487 2.482 3.217 147 HG21 ILE 46 HG21 ILE 46 3.567 -0.704 1.033 148 HG22 ILE 46 HG22 ILE 46 4.888 -0.870 2.172 149 HG23 ILE 46 HG23 ILE 46 3.234 -0.983 2.745 150 HD11 ILE 46 HD11 ILE 46 0.376 1.165 2.651 151 HD12 ILE 46 HD12 ILE 46 1.217 1.944 1.295 152 HD13 ILE 46 HD13 ILE 46 1.369 0.205 1.535 153 H HIS 47 H HIS 47 6.969 0.209 3.847 154 HA HIS 47 HA HIS 47 8.736 0.328 1.443 155 HB2 HIS 47 HB2 HIS 47 9.260 -0.625 4.294 156 HB3 HIS 47 HB3 HIS 47 10.464 -0.521 3.017 157 HD1 HIS 47 HD1 HIS 47 10.180 1.219 5.917 158 HD2 HIS 47 HD2 HIS 47 9.810 2.432 1.889 159 HE1 HIS 47 HE1 HIS 47 10.688 3.745 5.869 160 HE2 HIS 47 HE2 HIS 47 10.463 4.473 3.411 161 H GLU 48 H GLU 48 10.029 -1.791 1.148 162 HA GLU 48 HA GLU 48 8.358 -3.863 0.254 163 HB2 GLU 48 HB2 GLU 48 10.396 -5.199 0.030 164 HB3 GLU 48 HB3 GLU 48 10.554 -3.570 -0.585 165 HG2 GLU 48 HG2 GLU 48 12.575 -3.908 0.442 166 HG3 GLU 48 HG3 GLU 48 11.690 -2.904 1.573 167 H GLY 49 H GLY 49 7.634 -5.777 0.962 168 HA2 GLY 49 HA2 GLY 49 7.166 -7.526 2.431 169 HA3 GLY 49 HA3 GLY 49 8.127 -6.753 3.690 170 H GLU 50 H GLU 50 6.455 -4.142 3.234 171 HA GLU 50 HA GLU 50 4.259 -4.865 5.065 172 HB2 GLU 50 HB2 GLU 50 5.348 -2.256 3.977 173 HB3 GLU 50 HB3 GLU 50 3.800 -2.296 4.787 174 HG2 GLU 50 HG2 GLU 50 6.399 -3.278 6.029 175 HG3 GLU 50 HG3 GLU 50 5.722 -1.665 6.239 176 HA PRO 51 HA PRO 51 1.074 -5.358 2.143 177 HB2 PRO 51 HB2 PRO 51 -1.145 -4.310 3.359 178 HB3 PRO 51 HB3 PRO 51 -0.314 -5.806 3.903 179 HG2 PRO 51 HG2 PRO 51 0.073 -2.987 4.966 180 HG3 PRO 51 HG3 PRO 51 -0.281 -4.472 5.911 181 HD2 PRO 51 HD2 PRO 51 2.229 -3.585 5.631 182 HD3 PRO 51 HD3 PRO 51 1.897 -5.337 5.503 183 H GLY 52 H GLY 52 0.707 -4.385 0.290 184 HA2 GLY 52 HA2 GLY 52 -0.324 -2.726 -1.063 185 HA3 GLY 52 HA3 GLY 52 0.012 -1.484 0.143 186 H TYR 53 H TYR 53 2.911 -3.014 0.043 187 HA TYR 53 HA TYR 53 4.327 -1.143 -1.520 188 HB2 TYR 53 HB2 TYR 53 5.394 -2.508 0.140 189 HB3 TYR 53 HB3 TYR 53 4.870 -3.996 -0.628 190 HD1 TYR 53 HD1 TYR 53 6.077 -5.007 -2.442 191 HD2 TYR 53 HD2 TYR 53 7.247 -1.147 -0.899 192 HE1 TYR 53 HE1 TYR 53 8.246 -5.194 -3.644 193 HE2 TYR 53 HE2 TYR 53 9.437 -1.357 -2.095 194 HH TYR 53 HH TYR 53 10.256 -4.195 -4.111 195 H SER 54 H SER 54 2.575 -3.949 -2.541 196 HA SER 54 HA SER 54 3.915 -4.545 -5.017 197 HB2 SER 54 HB2 SER 54 2.427 -6.061 -3.590 198 HB3 SER 54 HB3 SER 54 1.061 -5.158 -4.215 199 HG SER 54 HG SER 54 2.856 -6.848 -5.608 200 H ALA 55 H ALA 55 3.031 -4.397 -7.140 201 HA ALA 55 HA ALA 55 2.117 -1.868 -8.039 202 HB1 ALA 55 HB1 ALA 55 1.885 -4.577 -9.422 203 HB2 ALA 55 HB2 ALA 55 1.891 -2.978 -10.197 204 HB3 ALA 55 HB3 ALA 55 3.351 -3.575 -9.391 205 H LYS 56 H LYS 56 0.227 -4.545 -6.773 206 HA LYS 56 HA LYS 56 -2.322 -3.915 -7.878 207 HB2 LYS 56 HB2 LYS 56 -3.261 -5.315 -6.294 208 HB3 LYS 56 HB3 LYS 56 -1.650 -5.997 -6.560 209 HG2 LYS 56 HG2 LYS 56 -0.976 -4.718 -4.389 210 HG3 LYS 56 HG3 LYS 56 -2.694 -4.383 -4.215 211 HD2 LYS 56 HD2 LYS 56 -2.483 -6.246 -2.877 212 HD3 LYS 56 HD3 LYS 56 -3.073 -6.920 -4.391 213 HE2 LYS 56 HE2 LYS 56 -1.377 -8.386 -4.265 214 HE3 LYS 56 HE3 LYS 56 -0.327 -7.064 -4.765 215 HZ1 LYS 56 HZ1 LYS 56 0.003 -6.586 -2.346 216 HZ2 LYS 56 HZ2 LYS 56 0.494 -8.098 -2.733 217 HZ3 LYS 56 HZ3 LYS 56 -0.920 -7.873 -1.955 218 H LEU 57 H LEU 57 -0.535 -2.190 -5.478 219 HA LEU 57 HA LEU 57 -2.900 -0.479 -4.795 220 HB2 LEU 57 HB2 LEU 57 -0.639 -1.655 -3.266 221 HB3 LEU 57 HB3 LEU 57 -0.760 0.070 -3.034 222 HG LEU 57 HG LEU 57 -1.891 -0.905 -1.270 223 HD11 LEU 57 HD11 LEU 57 -3.969 0.185 -1.358 224 HD12 LEU 57 HD12 LEU 57 -4.218 -0.201 -3.074 225 HD13 LEU 57 HD13 LEU 57 -3.029 1.033 -2.580 226 HD21 LEU 57 HD21 LEU 57 -2.224 -3.149 -2.289 227 HD22 LEU 57 HD22 LEU 57 -3.603 -2.493 -3.209 228 HD23 LEU 57 HD23 LEU 57 -3.656 -2.550 -1.438 229 H ASP 58 H ASP 58 0.580 -0.437 -5.547 230 HA ASP 58 HA ASP 58 0.559 2.498 -5.854 231 HB2 ASP 58 HB2 ASP 58 2.206 1.281 -4.467 232 HB3 ASP 58 HB3 ASP 58 2.829 0.464 -5.899 233 H ARG 59 H ARG 59 -0.512 2.863 -7.766 234 HA ARG 59 HA ARG 59 -0.428 1.545 -10.192 235 HB2 ARG 59 HB2 ARG 59 -1.307 3.567 -11.184 236 HB3 ARG 59 HB3 ARG 59 -1.966 3.391 -9.558 237 HG2 ARG 59 HG2 ARG 59 -0.145 5.013 -8.759 238 HG3 ARG 59 HG3 ARG 59 0.255 5.279 -10.465 239 HD2 ARG 59 HD2 ARG 59 -2.056 6.079 -10.872 240 HD3 ARG 59 HD3 ARG 59 -2.431 5.810 -9.154 241 HE ARG 59 HE ARG 59 -0.092 7.521 -9.659 242 HH11 ARG 59 HH11 ARG 59 -3.555 7.619 -9.141 243 HH12 ARG 59 HH12 ARG 59 -3.516 9.278 -8.607 244 HH21 ARG 59 HH21 ARG 59 -0.112 9.621 -8.978 245 HH22 ARG 59 HH22 ARG 59 -1.610 10.380 -8.529 246 H ASP 60 H ASP 60 2.018 3.739 -9.047 247 HA ASP 60 HA ASP 60 3.495 3.759 -11.606 248 HB2 ASP 60 HB2 ASP 60 4.942 5.378 -10.498 249 HB3 ASP 60 HB3 ASP 60 3.251 5.836 -10.391 250 H HIS 61 H HIS 61 3.385 1.712 -8.958 251 HA HIS 61 HA HIS 61 4.835 0.514 -7.706 252 HB2 HIS 61 HB2 HIS 61 3.897 -0.834 -9.576 253 HB3 HIS 61 HB3 HIS 61 5.402 -0.607 -10.461 254 HD1 HIS 61 HD1 HIS 61 6.419 -3.014 -10.356 255 HD2 HIS 61 HD2 HIS 61 5.018 -1.554 -6.645 256 HE1 HIS 61 HE1 HIS 61 7.124 -4.740 -8.578 257 HE2 HIS 61 HE2 HIS 61 6.298 -3.820 -6.317 258 H ASP 62 H ASP 62 6.137 2.829 -7.767 259 HA ASP 62 HA ASP 62 8.956 2.435 -8.479 260 HB2 ASP 62 HB2 ASP 62 9.323 4.648 -7.605 261 HB3 ASP 62 HB3 ASP 62 7.945 4.624 -8.689 262 H GLY 63 H GLY 63 7.403 0.830 -6.207 263 HA2 GLY 63 HA2 GLY 63 8.206 -0.428 -4.442 264 HA3 GLY 63 HA3 GLY 63 9.756 0.413 -4.528 265 H VAL 64 H VAL 64 7.053 2.548 -4.318 266 HA VAL 64 HA VAL 64 7.024 2.567 -1.339 267 HB VAL 64 HB VAL 64 7.175 5.167 -2.905 268 HG11 VAL 64 HG11 VAL 64 7.564 4.481 0.048 269 HG12 VAL 64 HG12 VAL 64 7.593 6.106 -0.677 270 HG13 VAL 64 HG13 VAL 64 6.089 5.178 -0.643 271 HG21 VAL 64 HG21 VAL 64 9.334 4.123 -3.226 272 HG22 VAL 64 HG22 VAL 64 9.466 5.440 -2.056 273 HG23 VAL 64 HG23 VAL 64 9.446 3.748 -1.486 274 H ALA 65 H ALA 65 5.025 2.371 -0.714 275 HA ALA 65 HA ALA 65 2.844 3.357 -2.482 276 HB1 ALA 65 HB1 ALA 65 1.487 1.571 -1.236 277 HB2 ALA 65 HB2 ALA 65 2.742 1.007 -2.358 278 HB3 ALA 65 HB3 ALA 65 3.050 0.954 -0.641 279 H CYS 66 H CYS 66 1.141 4.431 -1.666 280 HA CYS 66 HA CYS 66 0.275 6.214 -0.623 281 HB2 CYS 66 HB2 CYS 66 0.554 4.619 1.911 282 HB3 CYS 66 HB3 CYS 66 -0.730 5.715 1.436 283 H GLU 67 H GLU 67 2.672 6.936 -1.210 284 HA GLU 67 HA GLU 67 4.398 7.809 0.917 285 HB2 GLU 67 HB2 GLU 67 5.547 9.032 -0.938 286 HB3 GLU 67 HB3 GLU 67 5.373 7.311 -1.148 287 HG2 GLU 67 HG2 GLU 67 3.143 8.645 -2.470 288 HG3 GLU 67 HG3 GLU 67 4.650 9.390 -2.951 289 H LEU 68 H LEU 68 4.638 9.716 1.991 290 HA LEU 68 HA LEU 68 2.808 12.014 1.405 291 HB2 LEU 68 HB2 LEU 68 3.594 10.720 4.039 292 HB3 LEU 68 HB3 LEU 68 2.895 12.328 3.968 293 HG LEU 68 HG LEU 68 1.495 9.831 2.976 294 HD11 LEU 68 HD11 LEU 68 1.825 9.969 5.444 295 HD12 LEU 68 HD12 LEU 68 0.115 10.124 4.985 296 HD13 LEU 68 HD13 LEU 68 1.054 11.562 5.449 297 HD21 LEU 68 HD21 LEU 68 0.675 11.837 1.778 298 HD22 LEU 68 HD22 LEU 68 0.523 12.715 3.317 299 HD23 LEU 68 HD23 LEU 68 -0.520 11.320 2.966 300 H LYS 69 H LYS 69 5.605 11.587 0.581 301 HA LYS 69 HA LYS 69 6.801 14.111 1.682 302 HB2 LYS 69 HB2 LYS 69 9.014 13.136 1.578 303 HB3 LYS 69 HB3 LYS 69 7.990 12.277 2.703 304 HG2 LYS 69 HG2 LYS 69 8.384 11.253 -0.138 305 HG3 LYS 69 HG3 LYS 69 9.598 10.985 1.108 306 HD2 LYS 69 HD2 LYS 69 7.724 9.946 2.539 307 HD3 LYS 69 HD3 LYS 69 6.732 9.980 1.081 308 HE2 LYS 69 HE2 LYS 69 7.605 7.832 1.047 309 HE3 LYS 69 HE3 LYS 69 8.643 8.709 -0.091 310 HZ1 LYS 69 HZ1 LYS 69 10.256 8.941 1.784 311 HZ2 LYS 69 HZ2 LYS 69 9.952 7.365 1.468 312 HZ3 LYS 69 HZ3 LYS 69 9.236 8.090 2.757 313 H ASN 70 H ASN 70 5.624 12.841 -1.120 314 HA ASN 70 HA ASN 70 7.296 14.631 -2.827 315 HB2 ASN 70 HB2 ASN 70 6.315 11.854 -3.635 316 HB3 ASN 70 HB3 ASN 70 7.265 12.964 -4.614 317 HD21 ASN 70 HD21 ASN 70 9.415 13.695 -3.224 318 HD22 ASN 70 HD22 ASN 70 10.302 12.282 -2.669 Start of MODEL 13 1 H1 GLY 24 H1 GLY 24 0.585 -24.073 11.028 2 H2 GLY 24 H2 GLY 24 0.100 -25.469 11.734 3 H3 GLY 24 H3 GLY 24 0.751 -25.496 10.231 4 HA2 GLY 24 HA2 GLY 24 -1.636 -25.785 10.106 5 HA3 GLY 24 HA3 GLY 24 -1.816 -24.241 10.963 6 H ALA 25 H ALA 25 -2.568 -22.787 9.531 7 HA ALA 25 HA ALA 25 -1.006 -22.237 7.068 8 HB1 ALA 25 HB1 ALA 25 -2.911 -23.641 6.361 9 HB2 ALA 25 HB2 ALA 25 -4.043 -22.538 7.177 10 HB3 ALA 25 HB3 ALA 25 -3.102 -21.979 5.777 11 H SER 26 H SER 26 -1.277 -20.084 6.276 12 HA SER 26 HA SER 26 -2.525 -18.042 8.022 13 HB2 SER 26 HB2 SER 26 -0.247 -18.465 8.951 14 HB3 SER 26 HB3 SER 26 0.453 -18.077 7.371 15 HG SER 26 HG SER 26 0.422 -16.289 8.853 16 H GLU 27 H GLU 27 -3.514 -16.648 6.741 17 HA GLU 27 HA GLU 27 -2.619 -16.179 3.936 18 HB2 GLU 27 HB2 GLU 27 -4.277 -18.119 4.173 19 HB3 GLU 27 HB3 GLU 27 -5.451 -16.941 4.732 20 HG2 GLU 27 HG2 GLU 27 -5.983 -17.170 2.499 21 HG3 GLU 27 HG3 GLU 27 -5.005 -15.715 2.455 22 H GLU 28 H GLU 28 -2.049 -14.362 5.723 23 HA GLU 28 HA GLU 28 -4.056 -12.328 6.178 24 HB2 GLU 28 HB2 GLU 28 -1.022 -12.257 6.427 25 HB3 GLU 28 HB3 GLU 28 -2.128 -11.036 7.060 26 HG2 GLU 28 HG2 GLU 28 -1.931 -13.942 7.952 27 HG3 GLU 28 HG3 GLU 28 -1.381 -12.528 8.836 28 H ASN 29 H ASN 29 -4.231 -12.804 3.528 29 HA ASN 29 HA ASN 29 -2.686 -11.012 1.846 30 HB2 ASN 29 HB2 ASN 29 -5.152 -12.732 1.365 31 HB3 ASN 29 HB3 ASN 29 -4.374 -11.774 0.109 32 HD21 ASN 29 HD21 ASN 29 -4.631 -14.475 -0.270 33 HD22 ASN 29 HD22 ASN 29 -3.041 -15.217 -0.144 34 H ILE 30 H ILE 30 -3.101 -9.085 3.191 35 HA ILE 30 HA ILE 30 -5.554 -7.632 3.171 36 HB ILE 30 HB ILE 30 -2.658 -6.735 3.277 37 HG12 ILE 30 HG12 ILE 30 -4.767 -6.883 5.481 38 HG13 ILE 30 HG13 ILE 30 -3.630 -8.184 5.155 39 HG21 ILE 30 HG21 ILE 30 -3.923 -4.799 2.491 40 HG22 ILE 30 HG22 ILE 30 -5.173 -5.057 3.739 41 HG23 ILE 30 HG23 ILE 30 -3.536 -4.556 4.178 42 HD11 ILE 30 HD11 ILE 30 -2.841 -6.892 7.021 43 HD12 ILE 30 HD12 ILE 30 -1.726 -6.705 5.657 44 HD13 ILE 30 HD13 ILE 30 -2.860 -5.395 6.085 45 H HIS 31 H HIS 31 -6.469 -6.163 1.851 46 HA HIS 31 HA HIS 31 -5.467 -5.757 -0.904 47 HB2 HIS 31 HB2 HIS 31 -7.602 -6.730 -1.826 48 HB3 HIS 31 HB3 HIS 31 -6.471 -7.880 -1.144 49 HD1 HIS 31 HD1 HIS 31 -7.237 -9.189 1.098 50 HD2 HIS 31 HD2 HIS 31 -10.007 -6.466 -0.575 51 HE1 HIS 31 HE1 HIS 31 -9.502 -9.651 2.243 52 HE2 HIS 31 HE2 HIS 31 -11.184 -7.986 1.219 53 H PHE 32 H PHE 32 -5.375 -3.575 0.167 54 HA PHE 32 HA PHE 32 -7.776 -2.053 0.624 55 HB2 PHE 32 HB2 PHE 32 -4.981 -1.206 -0.196 56 HB3 PHE 32 HB3 PHE 32 -6.254 -0.080 0.236 57 HD1 PHE 32 HD1 PHE 32 -7.387 -0.496 2.603 58 HD2 PHE 32 HD2 PHE 32 -3.467 -1.897 1.461 59 HE1 PHE 32 HE1 PHE 32 -6.759 -0.705 4.998 60 HE2 PHE 32 HE2 PHE 32 -2.843 -2.089 3.852 61 HZ PHE 32 HZ PHE 32 -4.491 -1.495 5.625 62 H SER 33 H SER 33 -9.044 -0.816 -0.711 63 HA SER 33 HA SER 33 -9.068 -1.331 -3.568 64 HB2 SER 33 HB2 SER 33 -11.076 -0.918 -2.129 65 HB3 SER 33 HB3 SER 33 -10.591 0.782 -1.996 66 HG SER 33 HG SER 33 -12.119 0.362 -3.701 67 H SER 34 H SER 34 -8.082 1.447 -1.562 68 HA SER 34 HA SER 34 -6.287 2.505 -3.645 69 HB2 SER 34 HB2 SER 34 -8.548 4.175 -2.438 70 HB3 SER 34 HB3 SER 34 -7.237 4.804 -3.445 71 HG SER 34 HG SER 34 -8.035 3.460 -5.159 72 H CYS 35 H CYS 35 -4.686 3.922 -2.760 73 HA CYS 35 HA CYS 35 -3.945 3.689 -0.062 74 HB2 CYS 35 HB2 CYS 35 -3.220 5.609 -2.262 75 HB3 CYS 35 HB3 CYS 35 -2.689 5.954 -0.622 76 H LYS 36 H LYS 36 -6.358 5.935 -1.336 77 HA LYS 36 HA LYS 36 -6.448 7.794 0.832 78 HB2 LYS 36 HB2 LYS 36 -8.716 6.701 -0.878 79 HB3 LYS 36 HB3 LYS 36 -8.844 8.047 0.256 80 HG2 LYS 36 HG2 LYS 36 -6.957 9.197 -1.075 81 HG3 LYS 36 HG3 LYS 36 -7.163 7.919 -2.282 82 HD2 LYS 36 HD2 LYS 36 -8.496 9.732 -3.057 83 HD3 LYS 36 HD3 LYS 36 -9.638 8.563 -2.377 84 HE2 LYS 36 HE2 LYS 36 -9.395 9.969 -0.165 85 HE3 LYS 36 HE3 LYS 36 -8.645 11.192 -1.191 86 HZ1 LYS 36 HZ1 LYS 36 -10.714 11.200 -2.522 87 HZ2 LYS 36 HZ2 LYS 36 -11.021 11.578 -0.963 88 HZ3 LYS 36 HZ3 LYS 36 -11.389 10.093 -1.524 89 H GLU 37 H GLU 37 -7.846 4.538 0.628 90 HA GLU 37 HA GLU 37 -9.156 4.710 3.227 91 HB2 GLU 37 HB2 GLU 37 -9.739 3.191 1.214 92 HB3 GLU 37 HB3 GLU 37 -8.368 2.200 1.695 93 HG2 GLU 37 HG2 GLU 37 -10.404 1.252 2.589 94 HG3 GLU 37 HG3 GLU 37 -9.410 1.834 3.920 95 H ALA 38 H ALA 38 -6.017 3.508 2.037 96 HA ALA 38 HA ALA 38 -5.107 2.350 4.489 97 HB1 ALA 38 HB1 ALA 38 -3.472 3.541 2.213 98 HB2 ALA 38 HB2 ALA 38 -2.957 2.297 3.358 99 HB3 ALA 38 HB3 ALA 38 -4.217 1.924 2.181 100 H TRP 39 H TRP 39 -4.516 5.646 3.101 101 HA TRP 39 HA TRP 39 -3.045 6.710 5.270 102 HB2 TRP 39 HB2 TRP 39 -4.859 7.976 3.191 103 HB3 TRP 39 HB3 TRP 39 -4.052 8.939 4.411 104 HD1 TRP 39 HD1 TRP 39 -1.191 7.756 4.435 105 HE1 TRP 39 HE1 TRP 39 0.405 8.060 2.456 106 HE3 TRP 39 HE3 TRP 39 -4.616 8.814 0.787 107 HZ2 TRP 39 HZ2 TRP 39 0.222 8.720 -0.337 108 HZ3 TRP 39 HZ3 TRP 39 -3.880 9.221 -1.554 109 HH2 TRP 39 HH2 TRP 39 -1.461 9.165 -2.130 110 H ALA 40 H ALA 40 -6.617 6.542 4.897 111 HA ALA 40 HA ALA 40 -7.229 8.021 7.266 112 HB1 ALA 40 HB1 ALA 40 -8.810 5.818 5.880 113 HB2 ALA 40 HB2 ALA 40 -9.448 7.018 7.025 114 HB3 ALA 40 HB3 ALA 40 -8.830 7.546 5.448 115 H ASN 41 H ASN 41 -6.065 4.743 6.896 116 HA ASN 41 HA ASN 41 -6.536 4.083 9.763 117 HB2 ASN 41 HB2 ASN 41 -5.645 2.469 7.331 118 HB3 ASN 41 HB3 ASN 41 -5.576 1.844 8.974 119 HD21 ASN 41 HD21 ASN 41 -7.805 2.834 6.381 120 HD22 ASN 41 HD22 ASN 41 -9.211 2.133 7.161 121 H GLY 42 H GLY 42 -4.304 5.910 8.205 122 HA2 GLY 42 HA2 GLY 42 -2.319 6.764 9.010 123 HA3 GLY 42 HA3 GLY 42 -2.261 5.519 10.257 124 H TYR 43 H TYR 43 -2.680 4.067 7.186 125 HA TYR 43 HA TYR 43 0.038 2.961 7.224 126 HB2 TYR 43 HB2 TYR 43 -2.386 2.559 5.465 127 HB3 TYR 43 HB3 TYR 43 -0.818 1.906 5.052 128 HD1 TYR 43 HD1 TYR 43 -2.294 1.950 8.551 129 HD2 TYR 43 HD2 TYR 43 -1.344 -0.359 5.022 130 HE1 TYR 43 HE1 TYR 43 -2.851 -0.123 9.762 131 HE2 TYR 43 HE2 TYR 43 -1.932 -2.444 6.259 132 HH TYR 43 HH TYR 43 -3.019 -2.409 9.662 133 H SER 44 H SER 44 1.595 4.326 6.645 134 HA SER 44 HA SER 44 1.538 5.613 3.965 135 HB2 SER 44 HB2 SER 44 2.677 7.092 6.345 136 HB3 SER 44 HB3 SER 44 2.260 7.704 4.737 137 HG SER 44 HG SER 44 0.528 6.971 6.872 138 H ASP 45 H ASP 45 3.711 6.235 3.237 139 HA ASP 45 HA ASP 45 5.860 5.680 2.704 140 HB2 ASP 45 HB2 ASP 45 6.266 5.670 5.715 141 HB3 ASP 45 HB3 ASP 45 7.507 5.905 4.487 142 H ILE 46 H ILE 46 4.197 3.453 2.621 143 HA ILE 46 HA ILE 46 5.036 1.123 3.998 144 HB ILE 46 HB ILE 46 3.844 1.458 1.235 145 HG12 ILE 46 HG12 ILE 46 2.345 0.822 3.815 146 HG13 ILE 46 HG13 ILE 46 2.487 2.456 3.183 147 HG21 ILE 46 HG21 ILE 46 4.801 -0.896 1.741 148 HG22 ILE 46 HG22 ILE 46 3.502 -1.022 2.945 149 HG23 ILE 46 HG23 ILE 46 3.131 -0.800 1.238 150 HD11 ILE 46 HD11 ILE 46 0.336 1.376 2.570 151 HD12 ILE 46 HD12 ILE 46 1.286 1.892 1.164 152 HD13 ILE 46 HD13 ILE 46 1.213 0.186 1.595 153 H HIS 47 H HIS 47 6.785 -0.119 3.833 154 HA HIS 47 HA HIS 47 8.635 0.053 1.473 155 HB2 HIS 47 HB2 HIS 47 9.141 -0.786 4.361 156 HB3 HIS 47 HB3 HIS 47 10.331 -0.882 3.073 157 HD1 HIS 47 HD1 HIS 47 10.935 0.861 5.600 158 HD2 HIS 47 HD2 HIS 47 9.292 2.235 1.958 159 HE1 HIS 47 HE1 HIS 47 11.516 3.366 5.437 160 HE2 HIS 47 HE2 HIS 47 10.505 4.194 3.217 161 H GLU 48 H GLU 48 9.876 -2.053 1.149 162 HA GLU 48 HA GLU 48 8.209 -4.085 0.198 163 HB2 GLU 48 HB2 GLU 48 10.601 -3.711 -0.415 164 HB3 GLU 48 HB3 GLU 48 11.091 -4.315 1.169 165 HG2 GLU 48 HG2 GLU 48 10.009 -6.527 0.600 166 HG3 GLU 48 HG3 GLU 48 9.630 -5.890 -0.998 167 H GLY 49 H GLY 49 7.133 -5.743 1.010 168 HA2 GLY 49 HA2 GLY 49 6.782 -7.628 2.394 169 HA3 GLY 49 HA3 GLY 49 7.798 -6.924 3.652 170 H GLU 50 H GLU 50 6.213 -4.261 3.298 171 HA GLU 50 HA GLU 50 3.983 -4.932 5.113 172 HB2 GLU 50 HB2 GLU 50 5.112 -2.345 3.998 173 HB3 GLU 50 HB3 GLU 50 3.593 -2.377 4.871 174 HG2 GLU 50 HG2 GLU 50 6.225 -3.384 6.024 175 HG3 GLU 50 HG3 GLU 50 5.582 -1.762 6.254 176 HA PRO 51 HA PRO 51 0.874 -5.390 2.089 177 HB2 PRO 51 HB2 PRO 51 -1.364 -4.314 3.242 178 HB3 PRO 51 HB3 PRO 51 -0.588 -5.835 3.794 179 HG2 PRO 51 HG2 PRO 51 -0.185 -3.037 4.903 180 HG3 PRO 51 HG3 PRO 51 -0.580 -4.528 5.820 181 HD2 PRO 51 HD2 PRO 51 1.949 -3.664 5.627 182 HD3 PRO 51 HD3 PRO 51 1.601 -5.411 5.469 183 H GLY 52 H GLY 52 0.432 -4.387 0.236 184 HA2 GLY 52 HA2 GLY 52 -0.521 -2.679 -1.099 185 HA3 GLY 52 HA3 GLY 52 -0.162 -1.467 0.129 186 H TYR 53 H TYR 53 2.726 -3.049 0.011 187 HA TYR 53 HA TYR 53 4.171 -1.184 -1.526 188 HB2 TYR 53 HB2 TYR 53 5.212 -2.586 0.122 189 HB3 TYR 53 HB3 TYR 53 4.646 -4.053 -0.650 190 HD1 TYR 53 HD1 TYR 53 7.063 -1.238 -0.980 191 HD2 TYR 53 HD2 TYR 53 5.844 -5.120 -2.423 192 HE1 TYR 53 HE1 TYR 53 9.264 -1.516 -2.138 193 HE2 TYR 53 HE2 TYR 53 8.037 -5.382 -3.580 194 HH TYR 53 HH TYR 53 10.565 -2.840 -3.467 195 H SER 54 H SER 54 2.337 -3.939 -2.637 196 HA SER 54 HA SER 54 3.907 -4.328 -5.063 197 HB2 SER 54 HB2 SER 54 2.170 -5.950 -3.634 198 HB3 SER 54 HB3 SER 54 1.214 -5.524 -5.054 199 HG SER 54 HG SER 54 2.356 -7.161 -5.820 200 H ALA 55 H ALA 55 2.991 -4.365 -7.218 201 HA ALA 55 HA ALA 55 2.059 -1.872 -8.117 202 HB1 ALA 55 HB1 ALA 55 1.877 -4.579 -9.511 203 HB2 ALA 55 HB2 ALA 55 1.860 -2.980 -10.288 204 HB3 ALA 55 HB3 ALA 55 3.320 -3.541 -9.452 205 H LYS 56 H LYS 56 0.132 -4.569 -6.990 206 HA LYS 56 HA LYS 56 -2.435 -3.922 -7.995 207 HB2 LYS 56 HB2 LYS 56 -3.298 -5.256 -6.200 208 HB3 LYS 56 HB3 LYS 56 -1.799 -5.997 -6.779 209 HG2 LYS 56 HG2 LYS 56 -0.700 -4.615 -4.788 210 HG3 LYS 56 HG3 LYS 56 -2.345 -4.526 -4.186 211 HD2 LYS 56 HD2 LYS 56 -0.866 -7.117 -4.814 212 HD3 LYS 56 HD3 LYS 56 -0.992 -6.380 -3.210 213 HE2 LYS 56 HE2 LYS 56 -3.461 -6.567 -3.296 214 HE3 LYS 56 HE3 LYS 56 -3.356 -7.311 -4.899 215 HZ1 LYS 56 HZ1 LYS 56 -2.095 -9.140 -3.891 216 HZ2 LYS 56 HZ2 LYS 56 -3.542 -8.992 -3.154 217 HZ3 LYS 56 HZ3 LYS 56 -2.194 -8.452 -2.410 218 H LEU 57 H LEU 57 -0.604 -2.184 -5.577 219 HA LEU 57 HA LEU 57 -2.964 -0.419 -5.013 220 HB2 LEU 57 HB2 LEU 57 -0.835 -1.663 -3.340 221 HB3 LEU 57 HB3 LEU 57 -0.925 0.067 -3.122 222 HG LEU 57 HG LEU 57 -2.186 -0.931 -1.437 223 HD11 LEU 57 HD11 LEU 57 -4.236 0.246 -1.626 224 HD12 LEU 57 HD12 LEU 57 -4.327 0.007 -3.378 225 HD13 LEU 57 HD13 LEU 57 -3.127 1.126 -2.674 226 HD21 LEU 57 HD21 LEU 57 -2.585 -3.111 -2.432 227 HD22 LEU 57 HD22 LEU 57 -3.766 -2.406 -3.570 228 HD23 LEU 57 HD23 LEU 57 -4.103 -2.421 -1.835 229 H ASP 58 H ASP 58 0.530 -0.533 -5.621 230 HA ASP 58 HA ASP 58 0.664 2.393 -5.826 231 HB2 ASP 58 HB2 ASP 58 2.203 0.981 -4.465 232 HB3 ASP 58 HB3 ASP 58 2.814 0.243 -5.938 233 H ARG 59 H ARG 59 -0.439 2.796 -7.742 234 HA ARG 59 HA ARG 59 -0.293 1.616 -10.224 235 HB2 ARG 59 HB2 ARG 59 -1.072 3.752 -11.158 236 HB3 ARG 59 HB3 ARG 59 -1.889 3.368 -9.643 237 HG2 ARG 59 HG2 ARG 59 -0.350 4.943 -8.442 238 HG3 ARG 59 HG3 ARG 59 0.404 5.366 -9.988 239 HD2 ARG 59 HD2 ARG 59 -1.654 6.324 -10.812 240 HD3 ARG 59 HD3 ARG 59 -2.548 5.737 -9.392 241 HE ARG 59 HE ARG 59 -0.339 7.352 -8.538 242 HH11 ARG 59 HH11 ARG 59 -3.466 7.821 -10.035 243 HH12 ARG 59 HH12 ARG 59 -3.687 9.383 -9.291 244 HH21 ARG 59 HH21 ARG 59 -0.685 9.325 -7.606 245 HH22 ARG 59 HH22 ARG 59 -2.141 10.210 -7.952 246 H ASP 60 H ASP 60 2.123 3.768 -8.953 247 HA ASP 60 HA ASP 60 3.625 3.958 -11.484 248 HB2 ASP 60 HB2 ASP 60 5.076 5.468 -10.229 249 HB3 ASP 60 HB3 ASP 60 3.383 5.924 -10.074 250 H HIS 61 H HIS 61 3.502 1.747 -8.965 251 HA HIS 61 HA HIS 61 4.918 0.520 -7.745 252 HB2 HIS 61 HB2 HIS 61 4.028 -0.772 -9.690 253 HB3 HIS 61 HB3 HIS 61 5.589 -0.568 -10.483 254 HD1 HIS 61 HD1 HIS 61 6.490 -3.028 -10.342 255 HD2 HIS 61 HD2 HIS 61 4.999 -1.505 -6.691 256 HE1 HIS 61 HE1 HIS 61 7.059 -4.774 -8.534 257 HE2 HIS 61 HE2 HIS 61 6.181 -3.815 -6.309 258 H ASP 62 H ASP 62 6.218 2.865 -7.793 259 HA ASP 62 HA ASP 62 9.045 2.558 -8.436 260 HB2 ASP 62 HB2 ASP 62 9.338 4.707 -7.336 261 HB3 ASP 62 HB3 ASP 62 8.005 4.736 -8.479 262 H GLY 63 H GLY 63 7.338 1.029 -6.048 263 HA2 GLY 63 HA2 GLY 63 8.237 -0.418 -4.438 264 HA3 GLY 63 HA3 GLY 63 9.793 0.416 -4.511 265 H VAL 64 H VAL 64 7.160 2.595 -4.185 266 HA VAL 64 HA VAL 64 7.073 2.429 -1.212 267 HB VAL 64 HB VAL 64 7.245 5.107 -2.650 268 HG11 VAL 64 HG11 VAL 64 7.580 4.298 0.276 269 HG12 VAL 64 HG12 VAL 64 7.646 5.951 -0.376 270 HG13 VAL 64 HG13 VAL 64 6.128 5.045 -0.421 271 HG21 VAL 64 HG21 VAL 64 9.522 5.359 -1.758 272 HG22 VAL 64 HG22 VAL 64 9.516 3.643 -1.271 273 HG23 VAL 64 HG23 VAL 64 9.416 4.099 -2.991 274 H ALA 65 H ALA 65 5.004 2.364 -0.579 275 HA ALA 65 HA ALA 65 2.935 3.419 -2.455 276 HB1 ALA 65 HB1 ALA 65 2.948 0.968 -2.346 277 HB2 ALA 65 HB2 ALA 65 2.761 1.011 -0.599 278 HB3 ALA 65 HB3 ALA 65 1.458 1.624 -1.638 279 H CYS 66 H CYS 66 1.190 4.459 -1.659 280 HA CYS 66 HA CYS 66 0.299 6.191 -0.582 281 HB2 CYS 66 HB2 CYS 66 0.534 4.562 1.940 282 HB3 CYS 66 HB3 CYS 66 -0.714 5.706 1.484 283 H GLU 67 H GLU 67 2.852 6.731 -1.114 284 HA GLU 67 HA GLU 67 4.494 7.671 1.024 285 HB2 GLU 67 HB2 GLU 67 5.614 8.961 -0.801 286 HB3 GLU 67 HB3 GLU 67 5.507 7.235 -1.059 287 HG2 GLU 67 HG2 GLU 67 3.310 8.844 -2.300 288 HG3 GLU 67 HG3 GLU 67 4.921 9.133 -2.920 289 H LEU 68 H LEU 68 5.047 9.763 1.733 290 HA LEU 68 HA LEU 68 2.956 11.897 1.468 291 HB2 LEU 68 HB2 LEU 68 4.407 10.801 3.898 292 HB3 LEU 68 HB3 LEU 68 3.637 12.380 3.930 293 HG LEU 68 HG LEU 68 2.126 9.811 3.343 294 HD11 LEU 68 HD11 LEU 68 1.272 10.119 5.644 295 HD12 LEU 68 HD12 LEU 68 2.348 11.518 5.862 296 HD13 LEU 68 HD13 LEU 68 3.032 9.896 5.635 297 HD21 LEU 68 HD21 LEU 68 0.985 11.798 2.401 298 HD22 LEU 68 HD22 LEU 68 1.186 12.662 3.941 299 HD23 LEU 68 HD23 LEU 68 0.136 11.234 3.839 300 H LYS 69 H LYS 69 5.404 11.608 -0.024 301 HA LYS 69 HA LYS 69 6.805 14.168 0.642 302 HB2 LYS 69 HB2 LYS 69 8.968 12.994 -0.038 303 HB3 LYS 69 HB3 LYS 69 8.272 12.633 1.517 304 HG2 LYS 69 HG2 LYS 69 9.168 10.627 0.487 305 HG3 LYS 69 HG3 LYS 69 7.456 10.487 0.808 306 HD2 LYS 69 HD2 LYS 69 7.903 9.442 -1.304 307 HD3 LYS 69 HD3 LYS 69 6.970 10.895 -1.608 308 HE2 LYS 69 HE2 LYS 69 8.621 10.827 -3.291 309 HE3 LYS 69 HE3 LYS 69 9.134 12.091 -2.173 310 HZ1 LYS 69 HZ1 LYS 69 10.970 10.626 -2.810 311 HZ2 LYS 69 HZ2 LYS 69 10.211 9.319 -2.203 312 HZ3 LYS 69 HZ3 LYS 69 10.714 10.515 -1.206 313 H ASN 70 H ASN 70 4.722 13.703 -1.256 314 HA ASN 70 HA ASN 70 4.070 13.930 -3.420 315 HB2 ASN 70 HB2 ASN 70 4.806 16.247 -2.762 316 HB3 ASN 70 HB3 ASN 70 6.355 15.933 -3.535 317 HD21 ASN 70 HD21 ASN 70 6.372 17.135 -5.410 318 HD22 ASN 70 HD22 ASN 70 5.026 17.222 -6.538 Start of MODEL 14 1 H1 GLY 24 H1 GLY 24 -7.902 -26.419 6.938 2 H2 GLY 24 H2 GLY 24 -7.660 -27.152 5.493 3 H3 GLY 24 H3 GLY 24 -6.380 -26.780 6.445 4 HA2 GLY 24 HA2 GLY 24 -6.532 -25.207 4.620 5 HA3 GLY 24 HA3 GLY 24 -8.182 -24.844 5.137 6 H ALA 25 H ALA 25 -4.765 -24.355 5.816 7 HA ALA 25 HA ALA 25 -5.126 -22.819 8.263 8 HB1 ALA 25 HB1 ALA 25 -3.017 -23.985 7.714 9 HB2 ALA 25 HB2 ALA 25 -2.817 -22.963 6.270 10 HB3 ALA 25 HB3 ALA 25 -2.756 -22.240 7.890 11 H SER 26 H SER 26 -5.154 -20.583 8.515 12 HA SER 26 HA SER 26 -6.162 -18.890 6.387 13 HB2 SER 26 HB2 SER 26 -5.026 -18.160 9.116 14 HB3 SER 26 HB3 SER 26 -5.977 -17.100 8.055 15 HG SER 26 HG SER 26 -7.274 -18.106 9.692 16 H GLU 27 H GLU 27 -5.131 -16.817 5.768 17 HA GLU 27 HA GLU 27 -2.175 -16.703 5.868 18 HB2 GLU 27 HB2 GLU 27 -2.003 -16.273 3.480 19 HB3 GLU 27 HB3 GLU 27 -2.565 -17.899 3.803 20 HG2 GLU 27 HG2 GLU 27 -4.480 -15.636 3.065 21 HG3 GLU 27 HG3 GLU 27 -3.623 -16.574 1.863 22 H GLU 28 H GLU 28 -1.264 -14.662 5.462 23 HA GLU 28 HA GLU 28 -3.013 -12.373 6.101 24 HB2 GLU 28 HB2 GLU 28 -0.895 -12.736 7.302 25 HB3 GLU 28 HB3 GLU 28 0.010 -12.530 5.799 26 HG2 GLU 28 HG2 GLU 28 -0.813 -10.205 5.605 27 HG3 GLU 28 HG3 GLU 28 -1.869 -10.439 6.997 28 H ASN 29 H ASN 29 -4.226 -12.072 4.273 29 HA ASN 29 HA ASN 29 -2.834 -11.078 1.821 30 HB2 ASN 29 HB2 ASN 29 -3.728 -13.408 1.613 31 HB3 ASN 29 HB3 ASN 29 -5.356 -12.786 1.884 32 HD21 ASN 29 HD21 ASN 29 -4.482 -14.193 -0.474 33 HD22 ASN 29 HD22 ASN 29 -4.592 -13.058 -1.811 34 H ILE 30 H ILE 30 -3.023 -9.041 2.963 35 HA ILE 30 HA ILE 30 -5.603 -7.711 3.296 36 HB ILE 30 HB ILE 30 -2.715 -6.786 3.268 37 HG12 ILE 30 HG12 ILE 30 -4.722 -6.735 5.558 38 HG13 ILE 30 HG13 ILE 30 -3.739 -8.160 5.226 39 HG21 ILE 30 HG21 ILE 30 -3.626 -4.574 4.164 40 HG22 ILE 30 HG22 ILE 30 -3.910 -4.857 2.453 41 HG23 ILE 30 HG23 ILE 30 -5.228 -5.092 3.634 42 HD11 ILE 30 HD11 ILE 30 -2.702 -5.419 6.010 43 HD12 ILE 30 HD12 ILE 30 -2.694 -6.903 6.977 44 HD13 ILE 30 HD13 ILE 30 -1.676 -6.804 5.534 45 H HIS 31 H HIS 31 -6.638 -6.311 1.948 46 HA HIS 31 HA HIS 31 -5.590 -5.810 -0.773 47 HB2 HIS 31 HB2 HIS 31 -7.672 -6.644 -1.811 48 HB3 HIS 31 HB3 HIS 31 -6.701 -7.895 -1.061 49 HD1 HIS 31 HD1 HIS 31 -10.064 -6.103 -0.573 50 HD2 HIS 31 HD2 HIS 31 -7.750 -9.247 1.005 51 HE1 HIS 31 HE1 HIS 31 -11.633 -7.445 0.979 52 HE2 HIS 31 HE2 HIS 31 -10.197 -9.348 1.962 53 H PHE 32 H PHE 32 -5.362 -3.634 -0.119 54 HA PHE 32 HA PHE 32 -7.695 -2.014 0.579 55 HB2 PHE 32 HB2 PHE 32 -4.875 -1.352 -0.321 56 HB3 PHE 32 HB3 PHE 32 -6.093 -0.124 -0.002 57 HD1 PHE 32 HD1 PHE 32 -7.216 -0.116 2.325 58 HD2 PHE 32 HD2 PHE 32 -3.498 -2.126 1.449 59 HE1 PHE 32 HE1 PHE 32 -6.646 -0.117 4.743 60 HE2 PHE 32 HE2 PHE 32 -2.910 -2.086 3.864 61 HZ PHE 32 HZ PHE 32 -4.505 -1.111 5.513 62 H SER 33 H SER 33 -9.117 -1.010 -0.756 63 HA SER 33 HA SER 33 -9.107 -1.412 -3.629 64 HB2 SER 33 HB2 SER 33 -11.152 -1.107 -2.194 65 HB3 SER 33 HB3 SER 33 -10.701 0.593 -1.984 66 HG SER 33 HG SER 33 -11.420 -0.779 -4.387 67 H SER 34 H SER 34 -7.971 1.197 -1.503 68 HA SER 34 HA SER 34 -6.331 2.345 -3.626 69 HB2 SER 34 HB2 SER 34 -7.267 4.584 -3.529 70 HB3 SER 34 HB3 SER 34 -8.552 3.455 -3.976 71 HG SER 34 HG SER 34 -9.353 4.809 -2.390 72 H CYS 35 H CYS 35 -4.818 3.978 -2.816 73 HA CYS 35 HA CYS 35 -3.918 3.667 -0.119 74 HB2 CYS 35 HB2 CYS 35 -3.306 5.605 -2.343 75 HB3 CYS 35 HB3 CYS 35 -2.760 5.971 -0.712 76 H LYS 36 H LYS 36 -6.514 5.717 -1.339 77 HA LYS 36 HA LYS 36 -6.518 7.682 0.746 78 HB2 LYS 36 HB2 LYS 36 -7.886 7.577 -1.469 79 HB3 LYS 36 HB3 LYS 36 -9.017 6.570 -0.550 80 HG2 LYS 36 HG2 LYS 36 -8.968 8.510 1.208 81 HG3 LYS 36 HG3 LYS 36 -8.200 9.463 -0.062 82 HD2 LYS 36 HD2 LYS 36 -10.920 8.089 -0.181 83 HD3 LYS 36 HD3 LYS 36 -10.664 9.808 0.077 84 HE2 LYS 36 HE2 LYS 36 -9.795 8.331 -2.450 85 HE3 LYS 36 HE3 LYS 36 -11.373 9.093 -2.263 86 HZ1 LYS 36 HZ1 LYS 36 -10.271 11.224 -1.935 87 HZ2 LYS 36 HZ2 LYS 36 -9.808 10.587 -3.359 88 HZ3 LYS 36 HZ3 LYS 36 -8.789 10.551 -2.086 89 H GLU 37 H GLU 37 -7.917 4.426 0.607 90 HA GLU 37 HA GLU 37 -9.159 4.533 3.230 91 HB2 GLU 37 HB2 GLU 37 -9.768 2.993 1.300 92 HB3 GLU 37 HB3 GLU 37 -8.275 2.114 1.600 93 HG2 GLU 37 HG2 GLU 37 -10.117 0.941 2.633 94 HG3 GLU 37 HG3 GLU 37 -9.053 1.554 3.891 95 H ALA 38 H ALA 38 -6.000 3.397 2.005 96 HA ALA 38 HA ALA 38 -4.998 2.330 4.453 97 HB1 ALA 38 HB1 ALA 38 -2.855 2.390 3.277 98 HB2 ALA 38 HB2 ALA 38 -4.129 1.910 2.150 99 HB3 ALA 38 HB3 ALA 38 -3.488 3.567 2.116 100 H TRP 39 H TRP 39 -4.537 5.629 3.020 101 HA TRP 39 HA TRP 39 -3.097 6.767 5.176 102 HB2 TRP 39 HB2 TRP 39 -4.917 7.945 3.057 103 HB3 TRP 39 HB3 TRP 39 -4.155 8.953 4.266 104 HD1 TRP 39 HD1 TRP 39 -1.255 7.821 4.342 105 HE1 TRP 39 HE1 TRP 39 0.348 8.171 2.376 106 HE3 TRP 39 HE3 TRP 39 -4.678 8.760 0.639 107 HZ2 TRP 39 HZ2 TRP 39 0.192 8.890 -0.404 108 HZ3 TRP 39 HZ3 TRP 39 -3.910 9.218 -1.682 109 HH2 TRP 39 HH2 TRP 39 -1.483 9.273 -2.214 110 H ALA 40 H ALA 40 -6.664 6.518 4.784 111 HA ALA 40 HA ALA 40 -7.332 8.025 7.106 112 HB1 ALA 40 HB1 ALA 40 -8.919 7.436 5.313 113 HB2 ALA 40 HB2 ALA 40 -8.831 5.722 5.793 114 HB3 ALA 40 HB3 ALA 40 -9.515 6.926 6.907 115 H ASN 41 H ASN 41 -5.965 4.831 6.895 116 HA ASN 41 HA ASN 41 -6.459 4.286 9.785 117 HB2 ASN 41 HB2 ASN 41 -5.536 2.551 7.455 118 HB3 ASN 41 HB3 ASN 41 -5.503 2.022 9.133 119 HD21 ASN 41 HD21 ASN 41 -7.676 2.854 6.437 120 HD22 ASN 41 HD22 ASN 41 -9.100 2.211 7.224 121 H GLY 42 H GLY 42 -4.275 6.079 8.141 122 HA2 GLY 42 HA2 GLY 42 -2.308 7.012 8.892 123 HA3 GLY 42 HA3 GLY 42 -2.222 5.834 10.201 124 H TYR 43 H TYR 43 -2.597 4.266 7.162 125 HA TYR 43 HA TYR 43 0.100 3.143 7.292 126 HB2 TYR 43 HB2 TYR 43 -2.196 2.817 5.346 127 HB3 TYR 43 HB3 TYR 43 -0.639 2.063 5.118 128 HD1 TYR 43 HD1 TYR 43 -2.760 2.299 8.287 129 HD2 TYR 43 HD2 TYR 43 -1.043 -0.216 5.219 130 HE1 TYR 43 HE1 TYR 43 -3.607 0.301 9.452 131 HE2 TYR 43 HE2 TYR 43 -1.941 -2.221 6.392 132 HH TYR 43 HH TYR 43 -3.138 -3.013 8.167 133 H SER 44 H SER 44 1.848 4.139 6.479 134 HA SER 44 HA SER 44 1.795 5.522 3.913 135 HB2 SER 44 HB2 SER 44 2.740 7.630 4.819 136 HB3 SER 44 HB3 SER 44 1.073 7.342 5.360 137 HG SER 44 HG SER 44 1.859 6.641 7.370 138 H ASP 45 H ASP 45 3.942 6.253 3.249 139 HA ASP 45 HA ASP 45 6.024 5.611 2.595 140 HB2 ASP 45 HB2 ASP 45 6.577 5.662 5.576 141 HB3 ASP 45 HB3 ASP 45 7.763 5.841 4.287 142 H ILE 46 H ILE 46 4.339 3.463 2.571 143 HA ILE 46 HA ILE 46 5.085 1.105 3.958 144 HB ILE 46 HB ILE 46 3.857 1.514 1.228 145 HG12 ILE 46 HG12 ILE 46 2.385 0.847 3.803 146 HG13 ILE 46 HG13 ILE 46 2.571 2.489 3.217 147 HG21 ILE 46 HG21 ILE 46 3.592 -0.666 0.891 148 HG22 ILE 46 HG22 ILE 46 4.757 -0.972 2.168 149 HG23 ILE 46 HG23 ILE 46 3.039 -0.989 2.540 150 HD11 ILE 46 HD11 ILE 46 1.227 0.300 1.585 151 HD12 ILE 46 HD12 ILE 46 0.378 1.495 2.589 152 HD13 ILE 46 HD13 ILE 46 1.341 2.013 1.188 153 H HIS 47 H HIS 47 6.811 -0.165 3.814 154 HA HIS 47 HA HIS 47 8.637 -0.106 1.431 155 HB2 HIS 47 HB2 HIS 47 9.073 -0.854 4.356 156 HB3 HIS 47 HB3 HIS 47 10.236 -1.226 3.097 157 HD1 HIS 47 HD1 HIS 47 11.570 0.437 5.073 158 HD2 HIS 47 HD2 HIS 47 9.110 2.106 2.075 159 HE1 HIS 47 HE1 HIS 47 12.311 2.891 4.802 160 HE2 HIS 47 HE2 HIS 47 10.800 3.900 2.978 161 H GLU 48 H GLU 48 9.755 -2.223 1.041 162 HA GLU 48 HA GLU 48 8.016 -4.193 0.126 163 HB2 GLU 48 HB2 GLU 48 10.391 -3.866 -0.531 164 HB3 GLU 48 HB3 GLU 48 10.910 -4.506 1.035 165 HG2 GLU 48 HG2 GLU 48 9.871 -6.686 0.501 166 HG3 GLU 48 HG3 GLU 48 9.265 -6.038 -1.024 167 H GLY 49 H GLY 49 6.860 -5.774 0.972 168 HA2 GLY 49 HA2 GLY 49 6.495 -7.686 2.339 169 HA3 GLY 49 HA3 GLY 49 7.549 -7.020 3.586 170 H GLU 50 H GLU 50 6.088 -4.302 3.293 171 HA GLU 50 HA GLU 50 3.828 -4.865 5.096 172 HB2 GLU 50 HB2 GLU 50 5.045 -2.337 3.943 173 HB3 GLU 50 HB3 GLU 50 3.525 -2.294 4.805 174 HG2 GLU 50 HG2 GLU 50 6.121 -3.376 5.977 175 HG3 GLU 50 HG3 GLU 50 5.537 -1.727 6.173 176 HA PRO 51 HA PRO 51 0.708 -5.238 2.072 177 HB2 PRO 51 HB2 PRO 51 -1.500 -4.102 3.230 178 HB3 PRO 51 HB3 PRO 51 -0.751 -5.632 3.792 179 HG2 PRO 51 HG2 PRO 51 -0.293 -2.832 4.881 180 HG3 PRO 51 HG3 PRO 51 -0.700 -4.309 5.810 181 HD2 PRO 51 HD2 PRO 51 1.839 -3.480 5.584 182 HD3 PRO 51 HD3 PRO 51 1.458 -5.223 5.467 183 H GLY 52 H GLY 52 0.300 -4.246 0.212 184 HA2 GLY 52 HA2 GLY 52 -0.645 -2.555 -1.143 185 HA3 GLY 52 HA3 GLY 52 -0.297 -1.334 0.081 186 H TYR 53 H TYR 53 2.579 -2.967 -0.054 187 HA TYR 53 HA TYR 53 4.066 -1.137 -1.619 188 HB2 TYR 53 HB2 TYR 53 5.055 -2.551 0.072 189 HB3 TYR 53 HB3 TYR 53 4.481 -4.008 -0.717 190 HD1 TYR 53 HD1 TYR 53 5.712 -5.093 -2.457 191 HD2 TYR 53 HD2 TYR 53 6.952 -1.229 -0.978 192 HE1 TYR 53 HE1 TYR 53 7.927 -5.376 -3.566 193 HE2 TYR 53 HE2 TYR 53 9.174 -1.536 -2.068 194 HH TYR 53 HH TYR 53 10.497 -2.885 -3.358 195 H SER 54 H SER 54 2.139 -3.855 -2.620 196 HA SER 54 HA SER 54 3.460 -4.599 -5.035 197 HB2 SER 54 HB2 SER 54 1.375 -5.859 -5.456 198 HB3 SER 54 HB3 SER 54 1.967 -6.080 -3.800 199 HG SER 54 HG SER 54 -0.229 -5.689 -3.721 200 H ALA 55 H ALA 55 2.753 -4.400 -7.187 201 HA ALA 55 HA ALA 55 1.977 -1.844 -8.142 202 HB1 ALA 55 HB1 ALA 55 1.957 -2.895 -10.305 203 HB2 ALA 55 HB2 ALA 55 3.267 -3.644 -9.369 204 HB3 ALA 55 HB3 ALA 55 1.724 -4.507 -9.584 205 H LYS 56 H LYS 56 -0.020 -4.332 -6.831 206 HA LYS 56 HA LYS 56 -2.547 -3.751 -8.097 207 HB2 LYS 56 HB2 LYS 56 -2.012 -4.784 -5.281 208 HB3 LYS 56 HB3 LYS 56 -3.529 -4.880 -6.148 209 HG2 LYS 56 HG2 LYS 56 -0.967 -6.361 -6.859 210 HG3 LYS 56 HG3 LYS 56 -2.418 -7.034 -6.118 211 HD2 LYS 56 HD2 LYS 56 -3.714 -6.346 -8.187 212 HD3 LYS 56 HD3 LYS 56 -2.175 -5.930 -8.954 213 HE2 LYS 56 HE2 LYS 56 -2.960 -8.677 -7.875 214 HE3 LYS 56 HE3 LYS 56 -3.021 -8.192 -9.564 215 HZ1 LYS 56 HZ1 LYS 56 -0.594 -7.854 -9.490 216 HZ2 LYS 56 HZ2 LYS 56 -0.991 -9.394 -9.130 217 HZ3 LYS 56 HZ3 LYS 56 -0.546 -8.374 -7.937 218 H LEU 57 H LEU 57 -0.725 -2.036 -5.627 219 HA LEU 57 HA LEU 57 -3.043 -0.190 -5.166 220 HB2 LEU 57 HB2 LEU 57 -0.877 -1.352 -3.456 221 HB3 LEU 57 HB3 LEU 57 -1.136 0.359 -3.230 222 HG LEU 57 HG LEU 57 -2.367 -0.841 -1.599 223 HD11 LEU 57 HD11 LEU 57 -4.459 0.146 -3.575 224 HD12 LEU 57 HD12 LEU 57 -3.344 1.240 -2.721 225 HD13 LEU 57 HD13 LEU 57 -4.473 0.240 -1.810 226 HD21 LEU 57 HD21 LEU 57 -3.908 -2.217 -3.829 227 HD22 LEU 57 HD22 LEU 57 -4.091 -2.467 -2.088 228 HD23 LEU 57 HD23 LEU 57 -2.595 -2.970 -2.891 229 H ASP 58 H ASP 58 0.490 -0.322 -5.662 230 HA ASP 58 HA ASP 58 0.591 2.595 -6.027 231 HB2 ASP 58 HB2 ASP 58 2.132 1.229 -4.554 232 HB3 ASP 58 HB3 ASP 58 2.876 0.570 -6.020 233 H ARG 59 H ARG 59 -0.388 2.957 -8.038 234 HA ARG 59 HA ARG 59 -0.037 1.523 -10.416 235 HB2 ARG 59 HB2 ARG 59 -0.901 3.447 -11.589 236 HB3 ARG 59 HB3 ARG 59 -1.774 3.231 -10.073 237 HG2 ARG 59 HG2 ARG 59 -0.404 5.048 -9.034 238 HG3 ARG 59 HG3 ARG 59 0.440 5.293 -10.565 239 HD2 ARG 59 HD2 ARG 59 -2.558 5.614 -10.182 240 HD3 ARG 59 HD3 ARG 59 -1.371 6.928 -10.115 241 HE ARG 59 HE ARG 59 -1.117 5.450 -12.583 242 HH11 ARG 59 HH11 ARG 59 -3.119 7.910 -11.100 243 HH12 ARG 59 HH12 ARG 59 -3.568 8.604 -12.635 244 HH21 ARG 59 HH21 ARG 59 -1.742 6.371 -14.512 245 HH22 ARG 59 HH22 ARG 59 -2.808 7.744 -14.513 246 H ASP 60 H ASP 60 2.124 3.938 -9.124 247 HA ASP 60 HA ASP 60 3.844 4.053 -11.491 248 HB2 ASP 60 HB2 ASP 60 5.197 5.559 -10.042 249 HB3 ASP 60 HB3 ASP 60 3.508 6.051 -10.229 250 H HIS 61 H HIS 61 3.551 1.848 -8.954 251 HA HIS 61 HA HIS 61 4.930 0.543 -7.730 252 HB2 HIS 61 HB2 HIS 61 4.064 -0.648 -9.758 253 HB3 HIS 61 HB3 HIS 61 5.631 -0.403 -10.523 254 HD1 HIS 61 HD1 HIS 61 6.791 -2.737 -10.417 255 HD2 HIS 61 HD2 HIS 61 4.779 -1.643 -6.864 256 HE1 HIS 61 HE1 HIS 61 7.290 -4.587 -8.695 257 HE2 HIS 61 HE2 HIS 61 6.086 -3.893 -6.525 258 H ASP 62 H ASP 62 6.220 2.694 -7.366 259 HA ASP 62 HA ASP 62 9.035 2.533 -8.260 260 HB2 ASP 62 HB2 ASP 62 9.292 4.728 -7.393 261 HB3 ASP 62 HB3 ASP 62 7.779 4.677 -8.296 262 H GLY 63 H GLY 63 7.538 0.852 -5.962 263 HA2 GLY 63 HA2 GLY 63 8.398 -0.412 -4.229 264 HA3 GLY 63 HA3 GLY 63 9.928 0.469 -4.314 265 H VAL 64 H VAL 64 7.295 2.647 -4.055 266 HA VAL 64 HA VAL 64 7.139 2.511 -1.078 267 HB VAL 64 HB VAL 64 7.385 5.155 -2.565 268 HG11 VAL 64 HG11 VAL 64 7.469 4.399 0.391 269 HG12 VAL 64 HG12 VAL 64 7.691 6.036 -0.266 270 HG13 VAL 64 HG13 VAL 64 6.130 5.223 -0.434 271 HG21 VAL 64 HG21 VAL 64 9.526 3.652 -1.033 272 HG22 VAL 64 HG22 VAL 64 9.560 4.139 -2.749 273 HG23 VAL 64 HG23 VAL 64 9.617 5.376 -1.485 274 H ALA 65 H ALA 65 5.026 2.383 -0.504 275 HA ALA 65 HA ALA 65 3.030 3.516 -2.424 276 HB1 ALA 65 HB1 ALA 65 3.048 1.039 -2.345 277 HB2 ALA 65 HB2 ALA 65 2.615 1.116 -0.628 278 HB3 ALA 65 HB3 ALA 65 1.502 1.744 -1.856 279 H CYS 66 H CYS 66 1.242 4.519 -1.691 280 HA CYS 66 HA CYS 66 0.313 6.249 -0.620 281 HB2 CYS 66 HB2 CYS 66 0.438 4.599 1.894 282 HB3 CYS 66 HB3 CYS 66 -0.802 5.728 1.374 283 H GLU 67 H GLU 67 2.908 6.721 -1.017 284 HA GLU 67 HA GLU 67 4.542 7.544 1.128 285 HB2 GLU 67 HB2 GLU 67 5.521 9.120 -0.621 286 HB3 GLU 67 HB3 GLU 67 5.593 7.407 -0.933 287 HG2 GLU 67 HG2 GLU 67 3.286 8.940 -2.145 288 HG3 GLU 67 HG3 GLU 67 4.906 9.206 -2.777 289 H LEU 68 H LEU 68 4.788 9.312 2.399 290 HA LEU 68 HA LEU 68 3.015 11.699 1.929 291 HB2 LEU 68 HB2 LEU 68 3.733 10.286 4.520 292 HB3 LEU 68 HB3 LEU 68 3.211 11.960 4.496 293 HG LEU 68 HG LEU 68 1.533 9.611 3.555 294 HD11 LEU 68 HD11 LEU 68 1.284 11.452 5.978 295 HD12 LEU 68 HD12 LEU 68 1.890 9.788 6.027 296 HD13 LEU 68 HD13 LEU 68 0.207 10.100 5.566 297 HD21 LEU 68 HD21 LEU 68 0.867 11.599 2.287 298 HD22 LEU 68 HD22 LEU 68 0.889 12.591 3.767 299 HD23 LEU 68 HD23 LEU 68 -0.327 11.313 3.553 300 H LYS 69 H LYS 69 6.254 10.602 2.878 301 HA LYS 69 HA LYS 69 7.267 13.262 3.489 302 HB2 LYS 69 HB2 LYS 69 8.640 10.619 2.873 303 HB3 LYS 69 HB3 LYS 69 9.511 12.088 3.298 304 HG2 LYS 69 HG2 LYS 69 7.359 10.862 5.066 305 HG3 LYS 69 HG3 LYS 69 9.046 10.400 5.187 306 HD2 LYS 69 HD2 LYS 69 8.272 13.332 5.486 307 HD3 LYS 69 HD3 LYS 69 8.002 12.190 6.788 308 HE2 LYS 69 HE2 LYS 69 10.067 13.133 7.294 309 HE3 LYS 69 HE3 LYS 69 10.425 11.519 6.688 310 HZ1 LYS 69 HZ1 LYS 69 11.074 12.519 4.571 311 HZ2 LYS 69 HZ2 LYS 69 11.910 13.229 5.772 312 HZ3 LYS 69 HZ3 LYS 69 10.658 14.019 5.094 313 H ASN 70 H ASN 70 6.847 14.671 1.907 314 HA ASN 70 HA ASN 70 7.187 14.276 -0.896 315 HB2 ASN 70 HB2 ASN 70 5.731 16.003 0.295 316 HB3 ASN 70 HB3 ASN 70 7.196 16.929 0.615 317 HD21 ASN 70 HD21 ASN 70 5.041 15.697 -1.929 318 HD22 ASN 70 HD22 ASN 70 5.577 16.832 -3.155 Start of MODEL 15 1 H1 GLY 24 H1 GLY 24 -4.436 -28.332 2.303 2 H2 GLY 24 H2 GLY 24 -3.104 -27.843 1.482 3 H3 GLY 24 H3 GLY 24 -3.603 -27.013 2.802 4 HA2 GLY 24 HA2 GLY 24 -5.089 -27.241 0.260 5 HA3 GLY 24 HA3 GLY 24 -5.636 -26.345 1.691 6 H ALA 25 H ALA 25 -5.545 -24.244 1.109 7 HA ALA 25 HA ALA 25 -2.909 -23.032 0.608 8 HB1 ALA 25 HB1 ALA 25 -3.805 -23.391 -1.667 9 HB2 ALA 25 HB2 ALA 25 -5.320 -22.574 -1.215 10 HB3 ALA 25 HB3 ALA 25 -3.794 -21.664 -1.266 11 H SER 26 H SER 26 -2.784 -20.878 1.280 12 HA SER 26 HA SER 26 -5.074 -19.686 2.781 13 HB2 SER 26 HB2 SER 26 -2.326 -20.219 3.978 14 HB3 SER 26 HB3 SER 26 -3.682 -19.387 4.760 15 HG SER 26 HG SER 26 -3.470 -21.624 5.362 16 H GLU 27 H GLU 27 -5.264 -17.811 1.725 17 HA GLU 27 HA GLU 27 -2.904 -16.013 1.380 18 HB2 GLU 27 HB2 GLU 27 -4.834 -16.976 -0.750 19 HB3 GLU 27 HB3 GLU 27 -4.044 -15.396 -0.882 20 HG2 GLU 27 HG2 GLU 27 -1.836 -16.406 -0.653 21 HG3 GLU 27 HG3 GLU 27 -2.560 -18.015 -0.538 22 H GLU 28 H GLU 28 -4.430 -15.780 3.518 23 HA GLU 28 HA GLU 28 -6.516 -13.750 3.181 24 HB2 GLU 28 HB2 GLU 28 -5.152 -14.799 5.695 25 HB3 GLU 28 HB3 GLU 28 -6.617 -13.814 5.636 26 HG2 GLU 28 HG2 GLU 28 -6.287 -16.669 4.640 27 HG3 GLU 28 HG3 GLU 28 -7.219 -16.122 6.023 28 H ASN 29 H ASN 29 -3.971 -12.996 2.041 29 HA ASN 29 HA ASN 29 -2.576 -11.111 3.669 30 HB2 ASN 29 HB2 ASN 29 -1.602 -10.315 1.580 31 HB3 ASN 29 HB3 ASN 29 -1.605 -12.065 1.667 32 HD21 ASN 29 HD21 ASN 29 -1.668 -12.672 -0.482 33 HD22 ASN 29 HD22 ASN 29 -2.898 -12.112 -1.604 34 H ILE 30 H ILE 30 -2.491 -8.835 3.481 35 HA ILE 30 HA ILE 30 -5.083 -7.557 3.777 36 HB ILE 30 HB ILE 30 -2.242 -6.509 3.775 37 HG12 ILE 30 HG12 ILE 30 -4.320 -6.726 6.007 38 HG13 ILE 30 HG13 ILE 30 -3.107 -7.964 5.696 39 HG21 ILE 30 HG21 ILE 30 -4.841 -4.960 4.245 40 HG22 ILE 30 HG22 ILE 30 -3.226 -4.350 4.635 41 HG23 ILE 30 HG23 ILE 30 -3.640 -4.663 2.960 42 HD11 ILE 30 HD11 ILE 30 -2.496 -5.106 6.548 43 HD12 ILE 30 HD12 ILE 30 -2.418 -6.564 7.547 44 HD13 ILE 30 HD13 ILE 30 -1.297 -6.380 6.192 45 H HIS 31 H HIS 31 -6.229 -6.452 2.424 46 HA HIS 31 HA HIS 31 -5.260 -5.749 -0.299 47 HB2 HIS 31 HB2 HIS 31 -7.401 -6.648 -1.212 48 HB3 HIS 31 HB3 HIS 31 -6.311 -7.874 -0.592 49 HD1 HIS 31 HD1 HIS 31 -7.089 -9.158 1.711 50 HD2 HIS 31 HD2 HIS 31 -9.783 -6.371 0.011 51 HE1 HIS 31 HE1 HIS 31 -9.366 -9.518 2.883 52 HE2 HIS 31 HE2 HIS 31 -10.995 -7.818 1.837 53 H PHE 32 H PHE 32 -5.357 -3.615 -0.309 54 HA PHE 32 HA PHE 32 -7.677 -2.186 0.940 55 HB2 PHE 32 HB2 PHE 32 -4.918 -1.233 0.137 56 HB3 PHE 32 HB3 PHE 32 -6.205 -0.167 0.670 57 HD1 PHE 32 HD1 PHE 32 -7.349 -1.051 3.024 58 HD2 PHE 32 HD2 PHE 32 -3.274 -1.657 1.734 59 HE1 PHE 32 HE1 PHE 32 -6.632 -1.296 5.389 60 HE2 PHE 32 HE2 PHE 32 -2.566 -1.897 4.097 61 HZ PHE 32 HZ PHE 32 -4.246 -1.713 5.927 62 H SER 33 H SER 33 -9.049 -1.051 -0.293 63 HA SER 33 HA SER 33 -9.239 -1.494 -3.108 64 HB2 SER 33 HB2 SER 33 -11.112 -1.040 -1.518 65 HB3 SER 33 HB3 SER 33 -10.591 0.652 -1.423 66 HG SER 33 HG SER 33 -12.282 0.245 -2.976 67 H SER 34 H SER 34 -7.848 1.185 -1.253 68 HA SER 34 HA SER 34 -6.236 2.123 -3.471 69 HB2 SER 34 HB2 SER 34 -8.393 3.254 -4.015 70 HB3 SER 34 HB3 SER 34 -8.458 3.910 -2.374 71 HG SER 34 HG SER 34 -6.807 4.616 -4.536 72 H CYS 35 H CYS 35 -4.626 3.668 -2.735 73 HA CYS 35 HA CYS 35 -3.781 3.689 -0.035 74 HB2 CYS 35 HB2 CYS 35 -3.225 5.412 -2.436 75 HB3 CYS 35 HB3 CYS 35 -2.710 5.984 -0.856 76 H LYS 36 H LYS 36 -6.343 5.672 -1.487 77 HA LYS 36 HA LYS 36 -6.478 7.710 0.532 78 HB2 LYS 36 HB2 LYS 36 -8.737 6.426 -1.061 79 HB3 LYS 36 HB3 LYS 36 -8.874 7.876 -0.061 80 HG2 LYS 36 HG2 LYS 36 -7.074 8.946 -1.507 81 HG3 LYS 36 HG3 LYS 36 -7.233 7.556 -2.603 82 HD2 LYS 36 HD2 LYS 36 -9.715 8.052 -2.741 83 HD3 LYS 36 HD3 LYS 36 -9.439 9.521 -1.804 84 HE2 LYS 36 HE2 LYS 36 -8.249 8.870 -4.542 85 HE3 LYS 36 HE3 LYS 36 -9.626 9.933 -4.236 86 HZ1 LYS 36 HZ1 LYS 36 -8.131 11.388 -2.955 87 HZ2 LYS 36 HZ2 LYS 36 -7.626 11.233 -4.496 88 HZ3 LYS 36 HZ3 LYS 36 -6.849 10.432 -3.309 89 H GLU 37 H GLU 37 -7.758 4.398 0.557 90 HA GLU 37 HA GLU 37 -9.087 4.664 3.142 91 HB2 GLU 37 HB2 GLU 37 -9.612 2.989 1.251 92 HB3 GLU 37 HB3 GLU 37 -8.156 2.128 1.736 93 HG2 GLU 37 HG2 GLU 37 -9.924 1.000 2.788 94 HG3 GLU 37 HG3 GLU 37 -9.183 1.933 4.077 95 H ALA 38 H ALA 38 -5.899 3.547 2.007 96 HA ALA 38 HA ALA 38 -4.945 2.486 4.469 97 HB1 ALA 38 HB1 ALA 38 -2.831 2.416 3.358 98 HB2 ALA 38 HB2 ALA 38 -4.034 2.178 2.091 99 HB3 ALA 38 HB3 ALA 38 -3.253 3.766 2.294 100 H TRP 39 H TRP 39 -4.464 5.796 3.056 101 HA TRP 39 HA TRP 39 -3.108 6.916 5.286 102 HB2 TRP 39 HB2 TRP 39 -4.868 8.121 3.133 103 HB3 TRP 39 HB3 TRP 39 -4.130 9.108 4.377 104 HD1 TRP 39 HD1 TRP 39 -1.240 8.003 4.518 105 HE1 TRP 39 HE1 TRP 39 0.421 8.366 2.580 106 HE3 TRP 39 HE3 TRP 39 -4.573 8.845 0.734 107 HZ2 TRP 39 HZ2 TRP 39 0.314 9.137 -0.170 108 HZ3 TRP 39 HZ3 TRP 39 -3.761 9.365 -1.564 109 HH2 TRP 39 HH2 TRP 39 -1.323 9.517 -2.027 110 H ALA 40 H ALA 40 -6.626 6.485 4.835 111 HA ALA 40 HA ALA 40 -7.439 8.019 7.099 112 HB1 ALA 40 HB1 ALA 40 -9.129 5.676 6.531 113 HB2 ALA 40 HB2 ALA 40 -9.493 7.408 6.427 114 HB3 ALA 40 HB3 ALA 40 -8.718 6.583 5.065 115 H ASN 41 H ASN 41 -5.942 4.882 6.927 116 HA ASN 41 HA ASN 41 -6.426 4.290 9.812 117 HB2 ASN 41 HB2 ASN 41 -5.389 2.631 7.464 118 HB3 ASN 41 HB3 ASN 41 -5.373 2.077 9.133 119 HD21 ASN 41 HD21 ASN 41 -7.538 2.892 6.405 120 HD22 ASN 41 HD22 ASN 41 -8.922 2.103 7.140 121 H GLY 42 H GLY 42 -4.299 6.171 8.175 122 HA2 GLY 42 HA2 GLY 42 -2.334 7.140 8.915 123 HA3 GLY 42 HA3 GLY 42 -2.189 5.934 10.193 124 H TYR 43 H TYR 43 -2.629 4.399 7.152 125 HA TYR 43 HA TYR 43 0.120 3.379 7.196 126 HB2 TYR 43 HB2 TYR 43 -2.296 2.833 5.469 127 HB3 TYR 43 HB3 TYR 43 -0.706 2.231 5.060 128 HD1 TYR 43 HD1 TYR 43 -1.230 -0.055 5.103 129 HD2 TYR 43 HD2 TYR 43 -2.037 2.347 8.605 130 HE1 TYR 43 HE1 TYR 43 -1.695 -2.110 6.442 131 HE2 TYR 43 HE2 TYR 43 -2.448 0.305 9.918 132 HH TYR 43 HH TYR 43 -2.537 -1.989 9.908 133 H SER 44 H SER 44 1.639 4.722 6.583 134 HA SER 44 HA SER 44 1.634 5.890 3.869 135 HB2 SER 44 HB2 SER 44 2.594 8.011 4.820 136 HB3 SER 44 HB3 SER 44 0.879 7.767 5.150 137 HG SER 44 HG SER 44 1.389 7.121 7.250 138 H ASP 45 H ASP 45 3.777 6.578 3.194 139 HA ASP 45 HA ASP 45 5.901 5.966 2.649 140 HB2 ASP 45 HB2 ASP 45 6.330 6.162 5.648 141 HB3 ASP 45 HB3 ASP 45 7.581 6.254 4.415 142 H ILE 46 H ILE 46 4.250 3.745 2.670 143 HA ILE 46 HA ILE 46 5.145 1.473 4.140 144 HB ILE 46 HB ILE 46 3.886 1.667 1.402 145 HG12 ILE 46 HG12 ILE 46 2.452 1.086 4.027 146 HG13 ILE 46 HG13 ILE 46 2.524 2.696 3.322 147 HG21 ILE 46 HG21 ILE 46 3.527 -0.577 1.316 148 HG22 ILE 46 HG22 ILE 46 4.963 -0.677 2.318 149 HG23 ILE 46 HG23 ILE 46 3.371 -0.773 3.065 150 HD11 ILE 46 HD11 ILE 46 1.227 2.110 1.449 151 HD12 ILE 46 HD12 ILE 46 1.430 0.375 1.692 152 HD13 ILE 46 HD13 ILE 46 0.426 1.311 2.817 153 H HIS 47 H HIS 47 6.942 0.339 4.019 154 HA HIS 47 HA HIS 47 8.759 0.439 1.638 155 HB2 HIS 47 HB2 HIS 47 9.263 -0.266 4.564 156 HB3 HIS 47 HB3 HIS 47 10.475 -0.376 3.297 157 HD1 HIS 47 HD1 HIS 47 10.736 1.565 5.860 158 HD2 HIS 47 HD2 HIS 47 9.593 2.578 1.922 159 HE1 HIS 47 HE1 HIS 47 11.328 4.052 5.546 160 HE2 HIS 47 HE2 HIS 47 10.622 4.660 3.145 161 H GLU 48 H GLU 48 10.092 -1.638 1.417 162 HA GLU 48 HA GLU 48 8.459 -3.742 0.540 163 HB2 GLU 48 HB2 GLU 48 10.799 -3.313 -0.165 164 HB3 GLU 48 HB3 GLU 48 11.376 -3.844 1.421 165 HG2 GLU 48 HG2 GLU 48 10.507 -6.112 1.012 166 HG3 GLU 48 HG3 GLU 48 9.765 -5.580 -0.498 167 H GLY 49 H GLY 49 7.481 -5.429 1.411 168 HA2 GLY 49 HA2 GLY 49 7.219 -7.273 2.880 169 HA3 GLY 49 HA3 GLY 49 8.185 -6.460 4.108 170 H GLU 50 H GLU 50 6.480 -3.893 3.583 171 HA GLU 50 HA GLU 50 4.292 -4.571 5.449 172 HB2 GLU 50 HB2 GLU 50 5.365 -1.990 4.276 173 HB3 GLU 50 HB3 GLU 50 3.819 -2.019 5.092 174 HG2 GLU 50 HG2 GLU 50 6.425 -2.943 6.363 175 HG3 GLU 50 HG3 GLU 50 5.739 -1.329 6.522 176 HA PRO 51 HA PRO 51 1.131 -5.182 2.518 177 HB2 PRO 51 HB2 PRO 51 -1.092 -4.073 3.666 178 HB3 PRO 51 HB3 PRO 51 -0.281 -5.554 4.279 179 HG2 PRO 51 HG2 PRO 51 0.125 -2.698 5.233 180 HG3 PRO 51 HG3 PRO 51 -0.260 -4.138 6.235 181 HD2 PRO 51 HD2 PRO 51 2.262 -3.308 5.962 182 HD3 PRO 51 HD3 PRO 51 1.906 -5.060 5.870 183 H GLY 52 H GLY 52 0.719 -4.284 0.636 184 HA2 GLY 52 HA2 GLY 52 -0.289 -2.682 -0.781 185 HA3 GLY 52 HA3 GLY 52 0.030 -1.396 0.383 186 H TYR 53 H TYR 53 2.962 -2.889 0.348 187 HA TYR 53 HA TYR 53 4.353 -1.082 -1.305 188 HB2 TYR 53 HB2 TYR 53 5.432 -2.362 0.413 189 HB3 TYR 53 HB3 TYR 53 4.900 -3.886 -0.273 190 HD1 TYR 53 HD1 TYR 53 7.197 -1.006 -0.818 191 HD2 TYR 53 HD2 TYR 53 6.128 -5.022 -1.983 192 HE1 TYR 53 HE1 TYR 53 9.414 -1.286 -1.967 193 HE2 TYR 53 HE2 TYR 53 8.309 -5.273 -3.155 194 HH TYR 53 HH TYR 53 10.310 -4.288 -3.687 195 H SER 54 H SER 54 2.615 -3.965 -2.189 196 HA SER 54 HA SER 54 4.025 -4.609 -4.622 197 HB2 SER 54 HB2 SER 54 2.542 -6.115 -3.129 198 HB3 SER 54 HB3 SER 54 1.178 -5.400 -3.979 199 HG SER 54 HG SER 54 2.214 -7.414 -4.894 200 H ALA 55 H ALA 55 3.108 -4.650 -6.745 201 HA ALA 55 HA ALA 55 2.129 -2.173 -7.764 202 HB1 ALA 55 HB1 ALA 55 2.035 -4.938 -9.045 203 HB2 ALA 55 HB2 ALA 55 1.969 -3.370 -9.880 204 HB3 ALA 55 HB3 ALA 55 3.450 -3.862 -9.041 205 H LYS 56 H LYS 56 0.329 -4.830 -6.358 206 HA LYS 56 HA LYS 56 -2.241 -4.332 -7.480 207 HB2 LYS 56 HB2 LYS 56 -3.148 -5.640 -5.814 208 HB3 LYS 56 HB3 LYS 56 -1.525 -6.309 -6.019 209 HG2 LYS 56 HG2 LYS 56 -0.880 -4.915 -3.928 210 HG3 LYS 56 HG3 LYS 56 -2.592 -4.525 -3.809 211 HD2 LYS 56 HD2 LYS 56 -2.430 -6.285 -2.322 212 HD3 LYS 56 HD3 LYS 56 -3.063 -7.036 -3.774 213 HE2 LYS 56 HE2 LYS 56 -1.443 -8.572 -3.474 214 HE3 LYS 56 HE3 LYS 56 -0.373 -7.378 -4.206 215 HZ1 LYS 56 HZ1 LYS 56 -0.829 -7.784 -1.289 216 HZ2 LYS 56 HZ2 LYS 56 0.126 -6.607 -1.890 217 HZ3 LYS 56 HZ3 LYS 56 0.527 -8.183 -2.097 218 H LEU 57 H LEU 57 -0.474 -2.417 -5.181 219 HA LEU 57 HA LEU 57 -2.879 -0.718 -4.632 220 HB2 LEU 57 HB2 LEU 57 -0.602 -1.733 -3.021 221 HB3 LEU 57 HB3 LEU 57 -0.763 0.001 -2.906 222 HG LEU 57 HG LEU 57 -1.881 -0.893 -1.083 223 HD11 LEU 57 HD11 LEU 57 -4.200 -0.334 -2.956 224 HD12 LEU 57 HD12 LEU 57 -3.052 0.947 -2.484 225 HD13 LEU 57 HD13 LEU 57 -4.004 0.122 -1.254 226 HD21 LEU 57 HD21 LEU 57 -2.168 -3.198 -1.967 227 HD22 LEU 57 HD22 LEU 57 -3.553 -2.621 -2.934 228 HD23 LEU 57 HD23 LEU 57 -3.617 -2.572 -1.161 229 H ASP 58 H ASP 58 0.609 -0.629 -5.384 230 HA ASP 58 HA ASP 58 0.464 2.272 -5.909 231 HB2 ASP 58 HB2 ASP 58 2.178 1.231 -4.433 232 HB3 ASP 58 HB3 ASP 58 2.870 0.405 -5.837 233 H ARG 59 H ARG 59 -0.631 2.438 -7.828 234 HA ARG 59 HA ARG 59 -0.404 0.958 -10.177 235 HB2 ARG 59 HB2 ARG 59 -1.390 2.869 -11.320 236 HB3 ARG 59 HB3 ARG 59 -2.142 2.633 -9.745 237 HG2 ARG 59 HG2 ARG 59 -0.718 4.504 -8.819 238 HG3 ARG 59 HG3 ARG 59 -0.014 4.723 -10.425 239 HD2 ARG 59 HD2 ARG 59 -1.637 6.398 -10.137 240 HD3 ARG 59 HD3 ARG 59 -2.265 5.255 -11.335 241 HE ARG 59 HE ARG 59 -3.346 4.340 -8.966 242 HH11 ARG 59 HH11 ARG 59 -3.429 7.493 -10.492 243 HH12 ARG 59 HH12 ARG 59 -4.963 7.903 -9.775 244 HH21 ARG 59 HH21 ARG 59 -5.313 4.919 -8.101 245 HH22 ARG 59 HH22 ARG 59 -5.998 6.474 -8.465 246 H ASP 60 H ASP 60 1.764 3.498 -9.139 247 HA ASP 60 HA ASP 60 3.315 3.570 -11.612 248 HB2 ASP 60 HB2 ASP 60 4.714 5.173 -10.284 249 HB3 ASP 60 HB3 ASP 60 3.026 5.614 -10.479 250 H HIS 61 H HIS 61 3.287 1.438 -9.019 251 HA HIS 61 HA HIS 61 4.793 0.315 -7.785 252 HB2 HIS 61 HB2 HIS 61 3.961 -1.084 -9.678 253 HB3 HIS 61 HB3 HIS 61 5.468 -0.770 -10.533 254 HD1 HIS 61 HD1 HIS 61 5.077 -1.789 -6.760 255 HD2 HIS 61 HD2 HIS 61 6.607 -3.123 -10.468 256 HE1 HIS 61 HE1 HIS 61 6.368 -3.963 -6.276 257 HE2 HIS 61 HE2 HIS 61 7.282 -4.778 -8.542 258 H ASP 62 H ASP 62 5.917 2.573 -7.597 259 HA ASP 62 HA ASP 62 8.729 2.558 -8.520 260 HB2 ASP 62 HB2 ASP 62 8.891 4.777 -7.689 261 HB3 ASP 62 HB3 ASP 62 7.380 4.635 -8.580 262 H GLY 63 H GLY 63 7.378 0.803 -6.203 263 HA2 GLY 63 HA2 GLY 63 8.300 -0.387 -4.453 264 HA3 GLY 63 HA3 GLY 63 9.804 0.526 -4.613 265 H VAL 64 H VAL 64 7.016 2.548 -4.274 266 HA VAL 64 HA VAL 64 7.056 2.511 -1.295 267 HB VAL 64 HB VAL 64 7.081 5.151 -2.815 268 HG11 VAL 64 HG11 VAL 64 7.540 4.407 0.116 269 HG12 VAL 64 HG12 VAL 64 7.574 6.051 -0.561 270 HG13 VAL 64 HG13 VAL 64 6.060 5.135 -0.548 271 HG21 VAL 64 HG21 VAL 64 9.286 4.181 -3.202 272 HG22 VAL 64 HG22 VAL 64 9.377 5.520 -2.051 273 HG23 VAL 64 HG23 VAL 64 9.460 3.837 -1.461 274 H ALA 65 H ALA 65 5.028 2.490 -0.548 275 HA ALA 65 HA ALA 65 2.847 3.392 -2.376 276 HB1 ALA 65 HB1 ALA 65 2.981 1.039 -0.471 277 HB2 ALA 65 HB2 ALA 65 1.448 1.677 -1.116 278 HB3 ALA 65 HB3 ALA 65 2.700 1.052 -2.204 279 H CYS 66 H CYS 66 1.269 4.614 -1.664 280 HA CYS 66 HA CYS 66 0.446 6.439 -0.688 281 HB2 CYS 66 HB2 CYS 66 0.506 4.982 1.929 282 HB3 CYS 66 HB3 CYS 66 -0.732 6.031 1.263 283 H GLU 67 H GLU 67 3.071 6.802 -1.091 284 HA GLU 67 HA GLU 67 4.746 7.714 0.955 285 HB2 GLU 67 HB2 GLU 67 5.758 9.124 -0.869 286 HB3 GLU 67 HB3 GLU 67 5.650 7.416 -1.192 287 HG2 GLU 67 HG2 GLU 67 3.409 9.118 -2.256 288 HG3 GLU 67 HG3 GLU 67 4.998 9.321 -2.974 289 H LEU 68 H LEU 68 5.251 9.652 1.958 290 HA LEU 68 HA LEU 68 3.341 11.960 1.622 291 HB2 LEU 68 HB2 LEU 68 4.681 10.770 4.070 292 HB3 LEU 68 HB3 LEU 68 4.104 12.428 4.067 293 HG LEU 68 HG LEU 68 2.317 10.012 3.559 294 HD11 LEU 68 HD11 LEU 68 1.484 10.460 5.832 295 HD12 LEU 68 HD12 LEU 68 2.660 11.783 6.024 296 HD13 LEU 68 HD13 LEU 68 3.221 10.105 5.869 297 HD21 LEU 68 HD21 LEU 68 0.485 11.660 4.015 298 HD22 LEU 68 HD22 LEU 68 1.373 12.044 2.539 299 HD23 LEU 68 HD23 LEU 68 1.688 12.967 4.028 300 H LYS 69 H LYS 69 6.771 11.126 2.076 301 HA LYS 69 HA LYS 69 7.562 13.987 1.772 302 HB2 LYS 69 HB2 LYS 69 9.143 11.494 2.496 303 HB3 LYS 69 HB3 LYS 69 9.855 13.092 2.290 304 HG2 LYS 69 HG2 LYS 69 7.717 12.440 4.367 305 HG3 LYS 69 HG3 LYS 69 9.457 12.437 4.654 306 HD2 LYS 69 HD2 LYS 69 9.534 14.857 3.945 307 HD3 LYS 69 HD3 LYS 69 7.757 14.849 3.897 308 HE2 LYS 69 HE2 LYS 69 7.646 14.261 6.270 309 HE3 LYS 69 HE3 LYS 69 9.401 14.046 6.338 310 HZ1 LYS 69 HZ1 LYS 69 8.794 16.199 7.224 311 HZ2 LYS 69 HZ2 LYS 69 8.018 16.631 5.855 312 HZ3 LYS 69 HZ3 LYS 69 9.642 16.432 5.853 313 H ASN 70 H ASN 70 6.558 13.827 -0.384 314 HA ASN 70 HA ASN 70 7.522 12.397 -2.600 315 HB2 ASN 70 HB2 ASN 70 6.426 15.246 -2.483 316 HB3 ASN 70 HB3 ASN 70 6.604 14.297 -3.949 317 HD21 ASN 70 HD21 ASN 70 5.225 12.403 -4.255 318 HD22 ASN 70 HD22 ASN 70 3.712 12.312 -3.362 Start of MODEL 16 1 H1 GLY 24 H1 GLY 24 4.171 -16.499 4.637 2 H2 GLY 24 H2 GLY 24 3.180 -16.007 5.843 3 H3 GLY 24 H3 GLY 24 4.786 -16.172 6.121 4 HA2 GLY 24 HA2 GLY 24 4.676 -18.549 5.799 5 HA3 GLY 24 HA3 GLY 24 3.592 -18.019 7.097 6 H ALA 25 H ALA 25 2.748 -20.276 6.425 7 HA ALA 25 HA ALA 25 1.371 -20.662 3.969 8 HB1 ALA 25 HB1 ALA 25 2.216 -22.383 5.713 9 HB2 ALA 25 HB2 ALA 25 0.693 -22.064 6.577 10 HB3 ALA 25 HB3 ALA 25 0.663 -22.705 4.922 11 H SER 26 H SER 26 0.292 -19.174 6.950 12 HA SER 26 HA SER 26 -2.503 -18.839 5.928 13 HB2 SER 26 HB2 SER 26 -1.546 -19.117 8.797 14 HB3 SER 26 HB3 SER 26 -3.214 -18.801 8.276 15 HG SER 26 HG SER 26 -2.860 -21.026 8.662 16 H GLU 27 H GLU 27 -1.118 -17.056 4.857 17 HA GLU 27 HA GLU 27 -1.058 -14.586 6.542 18 HB2 GLU 27 HB2 GLU 27 1.084 -15.359 5.487 19 HB3 GLU 27 HB3 GLU 27 0.348 -15.146 3.903 20 HG2 GLU 27 HG2 GLU 27 1.651 -13.196 4.337 21 HG3 GLU 27 HG3 GLU 27 -0.029 -12.699 4.494 22 H GLU 28 H GLU 28 -3.124 -13.888 6.436 23 HA GLU 28 HA GLU 28 -4.827 -13.821 4.152 24 HB2 GLU 28 HB2 GLU 28 -6.139 -12.179 5.474 25 HB3 GLU 28 HB3 GLU 28 -5.800 -13.709 6.270 26 HG2 GLU 28 HG2 GLU 28 -3.959 -12.580 7.584 27 HG3 GLU 28 HG3 GLU 28 -4.453 -11.043 6.875 28 H ASN 29 H ASN 29 -4.144 -12.962 2.281 29 HA ASN 29 HA ASN 29 -2.459 -10.690 1.974 30 HB2 ASN 29 HB2 ASN 29 -4.411 -12.082 0.099 31 HB3 ASN 29 HB3 ASN 29 -3.455 -10.696 -0.407 32 HD21 ASN 29 HD21 ASN 29 -3.397 -13.624 -1.244 33 HD22 ASN 29 HD22 ASN 29 -1.688 -14.015 -1.105 34 H ILE 30 H ILE 30 -2.822 -8.669 2.491 35 HA ILE 30 HA ILE 30 -5.505 -7.545 2.834 36 HB ILE 30 HB ILE 30 -2.696 -6.432 3.115 37 HG12 ILE 30 HG12 ILE 30 -4.869 -6.889 5.211 38 HG13 ILE 30 HG13 ILE 30 -3.663 -8.107 4.823 39 HG21 ILE 30 HG21 ILE 30 -3.780 -4.403 4.131 40 HG22 ILE 30 HG22 ILE 30 -4.116 -4.555 2.417 41 HG23 ILE 30 HG23 ILE 30 -5.359 -5.012 3.610 42 HD11 ILE 30 HD11 ILE 30 -3.077 -6.864 6.849 43 HD12 ILE 30 HD12 ILE 30 -1.854 -6.695 5.589 44 HD13 ILE 30 HD13 ILE 30 -2.978 -5.354 5.928 45 H HIS 31 H HIS 31 -6.653 -6.493 1.401 46 HA HIS 31 HA HIS 31 -5.397 -5.333 -1.046 47 HB2 HIS 31 HB2 HIS 31 -6.412 -7.470 -1.674 48 HB3 HIS 31 HB3 HIS 31 -7.926 -7.016 -0.902 49 HD1 HIS 31 HD1 HIS 31 -5.791 -5.036 -3.532 50 HD2 HIS 31 HD2 HIS 31 -9.644 -6.605 -2.794 51 HE1 HIS 31 HE1 HIS 31 -7.269 -4.284 -5.499 52 HE2 HIS 31 HE2 HIS 31 -9.611 -5.264 -5.054 53 H PHE 32 H PHE 32 -5.466 -3.254 -0.476 54 HA PHE 32 HA PHE 32 -7.955 -1.947 0.469 55 HB2 PHE 32 HB2 PHE 32 -5.209 -0.886 -0.262 56 HB3 PHE 32 HB3 PHE 32 -6.537 0.123 0.269 57 HD1 PHE 32 HD1 PHE 32 -7.631 -0.495 2.577 58 HD2 PHE 32 HD2 PHE 32 -3.664 -1.687 1.359 59 HE1 PHE 32 HE1 PHE 32 -6.990 -0.808 4.956 60 HE2 PHE 32 HE2 PHE 32 -3.035 -2.006 3.740 61 HZ PHE 32 HZ PHE 32 -4.695 -1.561 5.539 62 H SER 33 H SER 33 -9.289 -0.739 -0.820 63 HA SER 33 HA SER 33 -9.280 -1.015 -3.674 64 HB2 SER 33 HB2 SER 33 -10.740 1.031 -1.958 65 HB3 SER 33 HB3 SER 33 -11.173 0.530 -3.602 66 HG SER 33 HG SER 33 -11.615 -1.556 -2.802 67 H SER 34 H SER 34 -7.888 1.431 -1.559 68 HA SER 34 HA SER 34 -6.301 2.643 -3.656 69 HB2 SER 34 HB2 SER 34 -8.362 3.833 -4.153 70 HB3 SER 34 HB3 SER 34 -8.637 4.188 -2.439 71 HG SER 34 HG SER 34 -7.690 5.910 -3.801 72 H CYS 35 H CYS 35 -4.693 4.070 -2.767 73 HA CYS 35 HA CYS 35 -3.872 3.820 -0.049 74 HB2 CYS 35 HB2 CYS 35 -3.248 5.762 -2.273 75 HB3 CYS 35 HB3 CYS 35 -2.692 6.096 -0.638 76 H LYS 36 H LYS 36 -6.365 5.904 -1.428 77 HA LYS 36 HA LYS 36 -6.471 7.870 0.646 78 HB2 LYS 36 HB2 LYS 36 -7.697 7.635 -1.699 79 HB3 LYS 36 HB3 LYS 36 -8.976 6.894 -0.728 80 HG2 LYS 36 HG2 LYS 36 -8.980 8.980 0.711 81 HG3 LYS 36 HG3 LYS 36 -7.717 9.650 -0.338 82 HD2 LYS 36 HD2 LYS 36 -9.369 9.290 -2.304 83 HD3 LYS 36 HD3 LYS 36 -10.585 8.941 -1.073 84 HE2 LYS 36 HE2 LYS 36 -10.895 11.216 -1.609 85 HE3 LYS 36 HE3 LYS 36 -10.069 11.221 -0.048 86 HZ1 LYS 36 HZ1 LYS 36 -8.759 11.640 -2.692 87 HZ2 LYS 36 HZ2 LYS 36 -7.981 11.677 -1.253 88 HZ3 LYS 36 HZ3 LYS 36 -9.088 12.817 -1.615 89 H GLU 37 H GLU 37 -7.837 4.616 0.518 90 HA GLU 37 HA GLU 37 -9.214 4.801 3.099 91 HB2 GLU 37 HB2 GLU 37 -9.771 3.248 1.102 92 HB3 GLU 37 HB3 GLU 37 -8.356 2.314 1.570 93 HG2 GLU 37 HG2 GLU 37 -10.105 1.168 2.570 94 HG3 GLU 37 HG3 GLU 37 -9.475 2.111 3.910 95 H ALA 38 H ALA 38 -6.058 3.635 1.917 96 HA ALA 38 HA ALA 38 -5.166 2.410 4.332 97 HB1 ALA 38 HB1 ALA 38 -3.055 2.293 3.212 98 HB2 ALA 38 HB2 ALA 38 -4.271 2.162 1.945 99 HB3 ALA 38 HB3 ALA 38 -3.416 3.703 2.208 100 H TRP 39 H TRP 39 -4.558 5.749 3.071 101 HA TRP 39 HA TRP 39 -3.116 6.730 5.301 102 HB2 TRP 39 HB2 TRP 39 -4.844 8.053 3.191 103 HB3 TRP 39 HB3 TRP 39 -4.087 8.994 4.458 104 HD1 TRP 39 HD1 TRP 39 -1.240 7.807 4.606 105 HE1 TRP 39 HE1 TRP 39 0.451 8.139 2.692 106 HE3 TRP 39 HE3 TRP 39 -4.496 8.826 0.798 107 HZ2 TRP 39 HZ2 TRP 39 0.408 8.950 -0.034 108 HZ3 TRP 39 HZ3 TRP 39 -3.638 9.349 -1.485 109 HH2 TRP 39 HH2 TRP 39 -1.189 9.417 -1.914 110 H ALA 40 H ALA 40 -6.670 6.552 4.885 111 HA ALA 40 HA ALA 40 -7.335 8.004 7.262 112 HB1 ALA 40 HB1 ALA 40 -8.836 5.801 5.785 113 HB2 ALA 40 HB2 ALA 40 -9.527 6.876 7.016 114 HB3 ALA 40 HB3 ALA 40 -8.945 7.552 5.483 115 H ASN 41 H ASN 41 -6.026 4.796 6.892 116 HA ASN 41 HA ASN 41 -6.507 4.117 9.759 117 HB2 ASN 41 HB2 ASN 41 -5.628 2.481 7.335 118 HB3 ASN 41 HB3 ASN 41 -5.614 1.867 8.983 119 HD21 ASN 41 HD21 ASN 41 -7.758 2.883 6.318 120 HD22 ASN 41 HD22 ASN 41 -9.190 2.201 7.068 121 H GLY 42 H GLY 42 -4.276 5.910 8.147 122 HA2 GLY 42 HA2 GLY 42 -2.240 6.714 8.878 123 HA3 GLY 42 HA3 GLY 42 -2.182 5.488 10.143 124 H TYR 43 H TYR 43 -2.721 4.078 7.045 125 HA TYR 43 HA TYR 43 -0.053 2.853 7.033 126 HB2 TYR 43 HB2 TYR 43 -2.518 2.551 5.320 127 HB3 TYR 43 HB3 TYR 43 -0.984 1.851 4.864 128 HD1 TYR 43 HD1 TYR 43 -1.406 -0.428 4.917 129 HD2 TYR 43 HD2 TYR 43 -2.556 1.960 8.330 130 HE1 TYR 43 HE1 TYR 43 -2.029 -2.485 6.172 131 HE2 TYR 43 HE2 TYR 43 -3.123 -0.094 9.577 132 HH TYR 43 HH TYR 43 -2.777 -3.363 8.146 133 H SER 44 H SER 44 1.486 4.276 6.563 134 HA SER 44 HA SER 44 1.574 5.546 3.883 135 HB2 SER 44 HB2 SER 44 0.775 7.317 5.322 136 HB3 SER 44 HB3 SER 44 1.966 6.917 6.572 137 HG SER 44 HG SER 44 2.513 7.919 3.957 138 H ASP 45 H ASP 45 3.733 6.142 3.246 139 HA ASP 45 HA ASP 45 5.857 5.513 2.722 140 HB2 ASP 45 HB2 ASP 45 6.188 5.773 5.731 141 HB3 ASP 45 HB3 ASP 45 7.502 5.760 4.560 142 H ILE 46 H ILE 46 4.196 3.356 2.702 143 HA ILE 46 HA ILE 46 4.931 1.035 4.157 144 HB ILE 46 HB ILE 46 3.864 1.343 1.347 145 HG12 ILE 46 HG12 ILE 46 2.272 0.794 3.891 146 HG13 ILE 46 HG13 ILE 46 2.424 2.396 3.191 147 HG21 ILE 46 HG21 ILE 46 3.143 -1.102 2.914 148 HG22 ILE 46 HG22 ILE 46 3.395 -0.876 1.184 149 HG23 ILE 46 HG23 ILE 46 4.778 -1.059 2.246 150 HD11 ILE 46 HD11 ILE 46 1.144 1.878 1.301 151 HD12 ILE 46 HD12 ILE 46 1.322 0.132 1.499 152 HD13 ILE 46 HD13 ILE 46 0.303 1.051 2.624 153 H HIS 47 H HIS 47 6.760 -0.085 4.164 154 HA HIS 47 HA HIS 47 8.742 0.106 1.934 155 HB2 HIS 47 HB2 HIS 47 8.936 -0.814 4.833 156 HB3 HIS 47 HB3 HIS 47 10.236 -1.038 3.676 157 HD1 HIS 47 HD1 HIS 47 10.523 0.811 6.287 158 HD2 HIS 47 HD2 HIS 47 9.834 2.017 2.298 159 HE1 HIS 47 HE1 HIS 47 11.464 3.200 6.073 160 HE2 HIS 47 HE2 HIS 47 11.027 3.926 3.640 161 H GLU 48 H GLU 48 10.036 -1.990 1.615 162 HA GLU 48 HA GLU 48 8.290 -3.819 0.335 163 HB2 GLU 48 HB2 GLU 48 11.064 -4.657 1.149 164 HB3 GLU 48 HB3 GLU 48 10.158 -5.021 -0.319 165 HG2 GLU 48 HG2 GLU 48 10.420 -2.465 -0.819 166 HG3 GLU 48 HG3 GLU 48 11.634 -2.477 0.447 167 H GLY 49 H GLY 49 7.202 -5.575 0.982 168 HA2 GLY 49 HA2 GLY 49 6.863 -7.587 2.225 169 HA3 GLY 49 HA3 GLY 49 7.858 -6.964 3.537 170 H GLU 50 H GLU 50 6.249 -4.276 3.259 171 HA GLU 50 HA GLU 50 4.066 -5.022 5.098 172 HB2 GLU 50 HB2 GLU 50 5.373 -2.463 4.215 173 HB3 GLU 50 HB3 GLU 50 3.687 -2.382 4.680 174 HG2 GLU 50 HG2 GLU 50 5.138 -1.859 6.549 175 HG3 GLU 50 HG3 GLU 50 4.110 -3.244 6.859 176 HA PRO 51 HA PRO 51 0.842 -5.401 2.204 177 HB2 PRO 51 HB2 PRO 51 -1.349 -4.315 3.449 178 HB3 PRO 51 HB3 PRO 51 -0.558 -5.846 3.946 179 HG2 PRO 51 HG2 PRO 51 -0.105 -3.068 5.087 180 HG3 PRO 51 HG3 PRO 51 -0.466 -4.577 5.989 181 HD2 PRO 51 HD2 PRO 51 2.057 -3.691 5.700 182 HD3 PRO 51 HD3 PRO 51 1.705 -5.439 5.554 183 H GLY 52 H GLY 52 0.567 -4.407 0.361 184 HA2 GLY 52 HA2 GLY 52 -0.459 -2.719 -0.981 185 HA3 GLY 52 HA3 GLY 52 -0.061 -1.485 0.220 186 H TYR 53 H TYR 53 2.785 -3.126 0.113 187 HA TYR 53 HA TYR 53 4.211 -1.330 -1.537 188 HB2 TYR 53 HB2 TYR 53 5.314 -2.639 0.136 189 HB3 TYR 53 HB3 TYR 53 4.716 -4.152 -0.531 190 HD1 TYR 53 HD1 TYR 53 5.843 -5.306 -2.297 191 HD2 TYR 53 HD2 TYR 53 7.071 -1.333 -1.142 192 HE1 TYR 53 HE1 TYR 53 7.905 -5.551 -3.676 193 HE2 TYR 53 HE2 TYR 53 9.137 -1.588 -2.535 194 HH TYR 53 HH TYR 53 10.363 -2.960 -3.907 195 H SER 54 H SER 54 2.380 -4.178 -2.422 196 HA SER 54 HA SER 54 3.656 -4.761 -4.934 197 HB2 SER 54 HB2 SER 54 1.602 -5.889 -3.279 198 HB3 SER 54 HB3 SER 54 0.897 -5.665 -4.878 199 HG SER 54 HG SER 54 2.416 -7.001 -5.748 200 H ALA 55 H ALA 55 2.837 -4.533 -7.040 201 HA ALA 55 HA ALA 55 1.866 -2.027 -7.879 202 HB1 ALA 55 HB1 ALA 55 1.806 -4.739 -9.270 203 HB2 ALA 55 HB2 ALA 55 1.555 -3.172 -10.073 204 HB3 ALA 55 HB3 ALA 55 3.118 -3.537 -9.323 205 H LYS 56 H LYS 56 -0.022 -4.667 -6.652 206 HA LYS 56 HA LYS 56 -2.637 -4.058 -7.626 207 HB2 LYS 56 HB2 LYS 56 -1.819 -5.091 -4.872 208 HB3 LYS 56 HB3 LYS 56 -3.420 -5.213 -5.588 209 HG2 LYS 56 HG2 LYS 56 -0.908 -6.631 -6.569 210 HG3 LYS 56 HG3 LYS 56 -2.256 -7.342 -5.685 211 HD2 LYS 56 HD2 LYS 56 -3.784 -6.810 -7.583 212 HD3 LYS 56 HD3 LYS 56 -2.402 -6.156 -8.493 213 HE2 LYS 56 HE2 LYS 56 -1.257 -8.350 -8.342 214 HE3 LYS 56 HE3 LYS 56 -2.626 -9.012 -7.441 215 HZ1 LYS 56 HZ1 LYS 56 -4.026 -8.613 -9.391 216 HZ2 LYS 56 HZ2 LYS 56 -2.759 -9.549 -9.814 217 HZ3 LYS 56 HZ3 LYS 56 -2.773 -7.970 -10.222 218 H LEU 57 H LEU 57 -0.680 -2.278 -5.351 219 HA LEU 57 HA LEU 57 -2.993 -0.495 -4.655 220 HB2 LEU 57 HB2 LEU 57 -0.786 -1.727 -3.135 221 HB3 LEU 57 HB3 LEU 57 -0.757 0.010 -2.974 222 HG LEU 57 HG LEU 57 -1.931 -0.939 -1.157 223 HD11 LEU 57 HD11 LEU 57 -3.783 0.486 -1.108 224 HD12 LEU 57 HD12 LEU 57 -4.128 0.289 -2.841 225 HD13 LEU 57 HD13 LEU 57 -2.729 1.239 -2.292 226 HD21 LEU 57 HD21 LEU 57 -3.871 -2.322 -1.326 227 HD22 LEU 57 HD22 LEU 57 -2.632 -3.032 -2.364 228 HD23 LEU 57 HD23 LEU 57 -3.967 -2.105 -3.089 229 H ASP 58 H ASP 58 0.487 -0.548 -5.473 230 HA ASP 58 HA ASP 58 0.456 2.380 -5.906 231 HB2 ASP 58 HB2 ASP 58 2.085 1.209 -4.398 232 HB3 ASP 58 HB3 ASP 58 2.827 0.482 -5.820 233 H ARG 59 H ARG 59 -0.616 2.554 -7.862 234 HA ARG 59 HA ARG 59 -0.274 1.105 -10.218 235 HB2 ARG 59 HB2 ARG 59 -1.262 2.980 -11.376 236 HB3 ARG 59 HB3 ARG 59 -2.069 2.745 -9.827 237 HG2 ARG 59 HG2 ARG 59 -0.777 4.635 -8.849 238 HG3 ARG 59 HG3 ARG 59 0.065 4.868 -10.377 239 HD2 ARG 59 HD2 ARG 59 -2.902 5.243 -9.871 240 HD3 ARG 59 HD3 ARG 59 -1.713 6.519 -10.114 241 HE ARG 59 HE ARG 59 -3.098 5.017 -12.141 242 HH11 ARG 59 HH11 ARG 59 -0.007 6.624 -11.676 243 HH12 ARG 59 HH12 ARG 59 0.287 6.720 -13.390 244 HH21 ARG 59 HH21 ARG 59 -2.657 5.199 -14.291 245 HH22 ARG 59 HH22 ARG 59 -1.183 5.953 -14.824 246 H ASP 60 H ASP 60 1.813 3.658 -9.055 247 HA ASP 60 HA ASP 60 3.427 3.834 -11.483 248 HB2 ASP 60 HB2 ASP 60 4.777 5.400 -10.084 249 HB3 ASP 60 HB3 ASP 60 3.081 5.826 -10.246 250 H HIS 61 H HIS 61 3.370 1.651 -8.900 251 HA HIS 61 HA HIS 61 4.852 0.372 -7.786 252 HB2 HIS 61 HB2 HIS 61 3.998 -0.810 -9.826 253 HB3 HIS 61 HB3 HIS 61 5.523 -0.447 -10.629 254 HD1 HIS 61 HD1 HIS 61 6.990 -2.590 -10.559 255 HD2 HIS 61 HD2 HIS 61 4.662 -1.987 -7.086 256 HE1 HIS 61 HE1 HIS 61 7.536 -4.543 -8.970 257 HE2 HIS 61 HE2 HIS 61 6.133 -4.156 -6.847 258 H ASP 62 H ASP 62 6.010 2.694 -7.545 259 HA ASP 62 HA ASP 62 8.826 2.652 -8.420 260 HB2 ASP 62 HB2 ASP 62 9.011 4.825 -7.451 261 HB3 ASP 62 HB3 ASP 62 7.524 4.753 -8.386 262 H GLY 63 H GLY 63 7.379 0.873 -6.142 263 HA2 GLY 63 HA2 GLY 63 8.294 -0.439 -4.482 264 HA3 GLY 63 HA3 GLY 63 9.806 0.473 -4.558 265 H VAL 64 H VAL 64 7.102 2.557 -4.180 266 HA VAL 64 HA VAL 64 7.052 2.361 -1.202 267 HB VAL 64 HB VAL 64 7.157 5.060 -2.608 268 HG11 VAL 64 HG11 VAL 64 7.534 4.188 0.295 269 HG12 VAL 64 HG12 VAL 64 7.615 5.854 -0.312 270 HG13 VAL 64 HG13 VAL 64 6.086 4.970 -0.370 271 HG21 VAL 64 HG21 VAL 64 9.471 3.612 -1.289 272 HG22 VAL 64 HG22 VAL 64 9.335 4.081 -3.006 273 HG23 VAL 64 HG23 VAL 64 9.445 5.334 -1.765 274 H ALA 65 H ALA 65 4.993 2.260 -0.534 275 HA ALA 65 HA ALA 65 2.877 3.299 -2.364 276 HB1 ALA 65 HB1 ALA 65 1.420 1.551 -1.283 277 HB2 ALA 65 HB2 ALA 65 2.760 0.927 -2.264 278 HB3 ALA 65 HB3 ALA 65 2.884 0.892 -0.516 279 H CYS 66 H CYS 66 1.334 4.565 -1.652 280 HA CYS 66 HA CYS 66 0.492 6.332 -0.592 281 HB2 CYS 66 HB2 CYS 66 0.501 4.697 1.926 282 HB3 CYS 66 HB3 CYS 66 -0.691 5.858 1.365 283 H GLU 67 H GLU 67 3.141 6.659 -0.920 284 HA GLU 67 HA GLU 67 4.759 7.514 1.202 285 HB2 GLU 67 HB2 GLU 67 5.808 8.982 -0.554 286 HB3 GLU 67 HB3 GLU 67 5.736 7.278 -0.917 287 HG2 GLU 67 HG2 GLU 67 3.542 9.026 -2.035 288 HG3 GLU 67 HG3 GLU 67 5.155 9.169 -2.702 289 H LEU 68 H LEU 68 5.064 9.334 2.430 290 HA LEU 68 HA LEU 68 3.229 11.680 1.994 291 HB2 LEU 68 HB2 LEU 68 4.169 10.286 4.490 292 HB3 LEU 68 HB3 LEU 68 3.950 12.020 4.558 293 HG LEU 68 HG LEU 68 1.762 10.044 3.818 294 HD11 LEU 68 HD11 LEU 68 2.510 10.091 6.239 295 HD12 LEU 68 HD12 LEU 68 0.836 10.608 5.996 296 HD13 LEU 68 HD13 LEU 68 2.112 11.816 6.285 297 HD21 LEU 68 HD21 LEU 68 0.257 12.034 4.140 298 HD22 LEU 68 HD22 LEU 68 1.271 12.144 2.704 299 HD23 LEU 68 HD23 LEU 68 1.702 13.072 4.162 300 H LYS 69 H LYS 69 6.619 10.844 2.713 301 HA LYS 69 HA LYS 69 7.629 13.500 3.028 302 HB2 LYS 69 HB2 LYS 69 8.788 10.840 2.164 303 HB3 LYS 69 HB3 LYS 69 9.767 12.287 2.031 304 HG2 LYS 69 HG2 LYS 69 8.461 11.422 4.651 305 HG3 LYS 69 HG3 LYS 69 10.080 10.953 4.130 306 HD2 LYS 69 HD2 LYS 69 10.292 13.641 3.777 307 HD3 LYS 69 HD3 LYS 69 9.091 13.626 5.075 308 HE2 LYS 69 HE2 LYS 69 10.578 12.523 6.582 309 HE3 LYS 69 HE3 LYS 69 11.601 11.932 5.269 310 HZ1 LYS 69 HZ1 LYS 69 11.424 14.775 6.100 311 HZ2 LYS 69 HZ2 LYS 69 12.340 14.208 4.869 312 HZ3 LYS 69 HZ3 LYS 69 12.673 13.766 6.399 313 H ASN 70 H ASN 70 7.173 15.086 1.674 314 HA ASN 70 HA ASN 70 6.865 14.863 -1.193 315 HB2 ASN 70 HB2 ASN 70 5.685 16.547 0.195 316 HB3 ASN 70 HB3 ASN 70 7.221 17.311 0.601 317 HD21 ASN 70 HD21 ASN 70 8.368 18.474 -1.093 318 HD22 ASN 70 HD22 ASN 70 7.485 19.017 -2.516 Start of MODEL 17 1 H1 GLY 24 H1 GLY 24 -11.296 -24.625 3.271 2 H2 GLY 24 H2 GLY 24 -10.192 -23.418 3.365 3 H3 GLY 24 H3 GLY 24 -10.183 -24.629 4.475 4 HA2 GLY 24 HA2 GLY 24 -12.281 -22.575 4.149 5 HA3 GLY 24 HA3 GLY 24 -12.390 -23.956 5.249 6 H ALA 25 H ALA 25 -10.674 -20.909 4.609 7 HA ALA 25 HA ALA 25 -10.252 -20.497 7.469 8 HB1 ALA 25 HB1 ALA 25 -8.238 -21.830 6.851 9 HB2 ALA 25 HB2 ALA 25 -7.858 -20.651 5.574 10 HB3 ALA 25 HB3 ALA 25 -7.812 -20.171 7.283 11 H SER 26 H SER 26 -9.427 -18.317 7.924 12 HA SER 26 HA SER 26 -10.463 -16.212 6.210 13 HB2 SER 26 HB2 SER 26 -10.404 -16.036 8.669 14 HB3 SER 26 HB3 SER 26 -8.636 -16.124 8.641 15 HG SER 26 HG SER 26 -10.323 -14.059 7.613 16 H GLU 27 H GLU 27 -9.386 -14.880 4.800 17 HA GLU 27 HA GLU 27 -6.817 -15.642 3.677 18 HB2 GLU 27 HB2 GLU 27 -8.737 -13.325 3.270 19 HB3 GLU 27 HB3 GLU 27 -7.152 -13.359 2.489 20 HG2 GLU 27 HG2 GLU 27 -7.647 -15.428 1.344 21 HG3 GLU 27 HG3 GLU 27 -9.168 -15.624 2.218 22 H GLU 28 H GLU 28 -4.831 -15.066 4.293 23 HA GLU 28 HA GLU 28 -4.405 -13.042 6.398 24 HB2 GLU 28 HB2 GLU 28 -2.450 -14.832 4.905 25 HB3 GLU 28 HB3 GLU 28 -2.074 -13.798 6.294 26 HG2 GLU 28 HG2 GLU 28 -3.687 -15.086 7.685 27 HG3 GLU 28 HG3 GLU 28 -4.016 -16.148 6.313 28 H ASN 29 H ASN 29 -4.055 -13.210 2.893 29 HA ASN 29 HA ASN 29 -2.157 -11.057 2.634 30 HB2 ASN 29 HB2 ASN 29 -2.343 -12.721 0.889 31 HB3 ASN 29 HB3 ASN 29 -4.060 -12.360 0.650 32 HD21 ASN 29 HD21 ASN 29 -0.824 -10.712 0.554 33 HD22 ASN 29 HD22 ASN 29 -1.301 -9.629 -0.744 34 H ILE 30 H ILE 30 -2.440 -9.007 2.951 35 HA ILE 30 HA ILE 30 -5.038 -7.729 3.278 36 HB ILE 30 HB ILE 30 -2.173 -6.733 3.296 37 HG12 ILE 30 HG12 ILE 30 -4.142 -6.834 5.618 38 HG13 ILE 30 HG13 ILE 30 -3.180 -8.252 5.197 39 HG21 ILE 30 HG21 ILE 30 -4.754 -5.181 3.808 40 HG22 ILE 30 HG22 ILE 30 -3.157 -4.615 4.306 41 HG23 ILE 30 HG23 ILE 30 -3.495 -4.829 2.593 42 HD11 ILE 30 HD11 ILE 30 -2.056 -5.557 6.018 43 HD12 ILE 30 HD12 ILE 30 -2.117 -7.032 6.997 44 HD13 ILE 30 HD13 ILE 30 -1.099 -6.991 5.551 45 H HIS 31 H HIS 31 -6.139 -6.521 1.914 46 HA HIS 31 HA HIS 31 -5.113 -5.895 -0.807 47 HB2 HIS 31 HB2 HIS 31 -7.224 -6.842 -1.756 48 HB3 HIS 31 HB3 HIS 31 -6.108 -8.026 -1.101 49 HD1 HIS 31 HD1 HIS 31 -6.905 -9.328 1.188 50 HD2 HIS 31 HD2 HIS 31 -9.632 -6.613 -0.575 51 HE1 HIS 31 HE1 HIS 31 -9.192 -9.744 2.308 52 HE2 HIS 31 HE2 HIS 31 -10.843 -8.087 1.227 53 H PHE 32 H PHE 32 -5.004 -3.731 -0.257 54 HA PHE 32 HA PHE 32 -7.382 -2.249 0.650 55 HB2 PHE 32 HB2 PHE 32 -4.607 -1.447 -0.254 56 HB3 PHE 32 HB3 PHE 32 -5.851 -0.269 0.127 57 HD1 PHE 32 HD1 PHE 32 -6.949 -0.426 2.487 58 HD2 PHE 32 HD2 PHE 32 -3.159 -2.219 1.460 59 HE1 PHE 32 HE1 PHE 32 -6.312 -0.465 4.887 60 HE2 PHE 32 HE2 PHE 32 -2.531 -2.256 3.865 61 HZ PHE 32 HZ PHE 32 -4.107 -1.381 5.576 62 H SER 33 H SER 33 -8.897 -1.346 -0.623 63 HA SER 33 HA SER 33 -8.956 -1.631 -3.495 64 HB2 SER 33 HB2 SER 33 -10.950 -1.504 -2.010 65 HB3 SER 33 HB3 SER 33 -10.590 0.206 -1.697 66 HG SER 33 HG SER 33 -12.140 -0.109 -3.379 67 H SER 34 H SER 34 -7.907 0.981 -1.352 68 HA SER 34 HA SER 34 -6.439 2.339 -3.489 69 HB2 SER 34 HB2 SER 34 -8.696 3.346 -3.745 70 HB3 SER 34 HB3 SER 34 -8.734 3.708 -2.012 71 HG SER 34 HG SER 34 -7.272 4.927 -4.075 72 H CYS 35 H CYS 35 -4.807 3.686 -2.641 73 HA CYS 35 HA CYS 35 -3.897 3.503 0.033 74 HB2 CYS 35 HB2 CYS 35 -3.408 5.427 -2.233 75 HB3 CYS 35 HB3 CYS 35 -2.827 5.836 -0.626 76 H LYS 36 H LYS 36 -6.522 5.548 -1.191 77 HA LYS 36 HA LYS 36 -6.581 7.481 0.934 78 HB2 LYS 36 HB2 LYS 36 -8.864 6.282 -0.681 79 HB3 LYS 36 HB3 LYS 36 -8.988 7.688 0.385 80 HG2 LYS 36 HG2 LYS 36 -7.265 8.874 -1.004 81 HG3 LYS 36 HG3 LYS 36 -7.206 7.484 -2.083 82 HD2 LYS 36 HD2 LYS 36 -8.630 9.071 -3.141 83 HD3 LYS 36 HD3 LYS 36 -9.651 7.768 -2.550 84 HE2 LYS 36 HE2 LYS 36 -10.807 9.791 -2.084 85 HE3 LYS 36 HE3 LYS 36 -10.219 9.195 -0.533 86 HZ1 LYS 36 HZ1 LYS 36 -9.819 11.587 -0.817 87 HZ2 LYS 36 HZ2 LYS 36 -8.919 11.330 -2.150 88 HZ3 LYS 36 HZ3 LYS 36 -8.390 10.813 -0.692 89 H GLU 37 H GLU 37 -7.826 4.170 0.850 90 HA GLU 37 HA GLU 37 -9.069 4.344 3.494 91 HB2 GLU 37 HB2 GLU 37 -9.779 2.842 1.598 92 HB3 GLU 37 HB3 GLU 37 -8.316 1.884 1.856 93 HG2 GLU 37 HG2 GLU 37 -9.050 1.284 4.105 94 HG3 GLU 37 HG3 GLU 37 -10.401 2.420 4.014 95 H ALA 38 H ALA 38 -5.923 3.284 2.210 96 HA ALA 38 HA ALA 38 -4.910 2.159 4.651 97 HB1 ALA 38 HB1 ALA 38 -3.288 3.376 2.385 98 HB2 ALA 38 HB2 ALA 38 -2.855 2.026 3.451 99 HB3 ALA 38 HB3 ALA 38 -4.111 1.804 2.242 100 H TRP 39 H TRP 39 -4.463 5.436 3.172 101 HA TRP 39 HA TRP 39 -2.951 6.616 5.242 102 HB2 TRP 39 HB2 TRP 39 -4.900 7.735 3.203 103 HB3 TRP 39 HB3 TRP 39 -4.119 8.777 4.372 104 HD1 TRP 39 HD1 TRP 39 -1.190 7.736 4.347 105 HE1 TRP 39 HE1 TRP 39 0.324 8.111 2.319 106 HE3 TRP 39 HE3 TRP 39 -4.770 8.531 0.771 107 HZ2 TRP 39 HZ2 TRP 39 0.035 8.731 -0.477 108 HZ3 TRP 39 HZ3 TRP 39 -4.115 8.963 -1.591 109 HH2 TRP 39 HH2 TRP 39 -1.711 9.059 -2.222 110 H ALA 40 H ALA 40 -6.523 6.320 5.041 111 HA ALA 40 HA ALA 40 -7.112 7.880 7.345 112 HB1 ALA 40 HB1 ALA 40 -8.614 5.500 6.173 113 HB2 ALA 40 HB2 ALA 40 -9.279 6.728 7.270 114 HB3 ALA 40 HB3 ALA 40 -8.760 7.192 5.638 115 H ASN 41 H ASN 41 -5.849 4.613 7.117 116 HA ASN 41 HA ASN 41 -6.186 4.091 10.027 117 HB2 ASN 41 HB2 ASN 41 -5.249 2.410 7.656 118 HB3 ASN 41 HB3 ASN 41 -5.128 1.873 9.326 119 HD21 ASN 41 HD21 ASN 41 -7.422 2.519 6.691 120 HD22 ASN 41 HD22 ASN 41 -8.769 1.783 7.542 121 H GLY 42 H GLY 42 -4.035 5.893 8.263 122 HA2 GLY 42 HA2 GLY 42 -2.053 6.851 8.972 123 HA3 GLY 42 HA3 GLY 42 -1.920 5.683 10.287 124 H TYR 43 H TYR 43 -2.411 4.239 7.157 125 HA TYR 43 HA TYR 43 0.305 3.103 7.170 126 HB2 TYR 43 HB2 TYR 43 -2.090 2.721 5.367 127 HB3 TYR 43 HB3 TYR 43 -0.527 2.028 5.032 128 HD1 TYR 43 HD1 TYR 43 -2.485 2.192 8.299 129 HD2 TYR 43 HD2 TYR 43 -0.771 -0.261 5.190 130 HE1 TYR 43 HE1 TYR 43 -3.061 0.176 9.590 131 HE2 TYR 43 HE2 TYR 43 -1.411 -2.301 6.484 132 HH TYR 43 HH TYR 43 -3.002 -2.118 9.689 133 H SER 44 H SER 44 1.782 4.617 6.692 134 HA SER 44 HA SER 44 1.791 5.742 3.945 135 HB2 SER 44 HB2 SER 44 2.703 7.853 4.763 136 HB3 SER 44 HB3 SER 44 1.107 7.561 5.466 137 HG SER 44 HG SER 44 2.741 8.273 7.018 138 H ASP 45 H ASP 45 3.979 6.462 3.296 139 HA ASP 45 HA ASP 45 6.086 5.842 2.704 140 HB2 ASP 45 HB2 ASP 45 6.521 5.748 5.707 141 HB3 ASP 45 HB3 ASP 45 7.759 5.977 4.474 142 H ILE 46 H ILE 46 4.352 3.628 2.609 143 HA ILE 46 HA ILE 46 5.234 1.264 3.899 144 HB ILE 46 HB ILE 46 3.933 1.678 1.209 145 HG12 ILE 46 HG12 ILE 46 2.584 0.733 3.759 146 HG13 ILE 46 HG13 ILE 46 2.620 2.430 3.277 147 HG21 ILE 46 HG21 ILE 46 3.226 -0.919 2.122 148 HG22 ILE 46 HG22 ILE 46 4.272 -0.482 0.763 149 HG23 ILE 46 HG23 ILE 46 4.951 -0.809 2.352 150 HD11 ILE 46 HD11 ILE 46 0.519 1.160 2.594 151 HD12 ILE 46 HD12 ILE 46 1.351 2.037 1.299 152 HD13 ILE 46 HD13 ILE 46 1.512 0.287 1.404 153 H HIS 47 H HIS 47 7.041 0.170 3.762 154 HA HIS 47 HA HIS 47 8.864 0.341 1.393 155 HB2 HIS 47 HB2 HIS 47 9.335 -0.534 4.280 156 HB3 HIS 47 HB3 HIS 47 10.555 -0.581 3.017 157 HD1 HIS 47 HD1 HIS 47 10.662 1.257 5.737 158 HD2 HIS 47 HD2 HIS 47 9.853 2.408 1.754 159 HE1 HIS 47 HE1 HIS 47 11.313 3.743 5.551 160 HE2 HIS 47 HE2 HIS 47 10.811 4.435 3.121 161 H GLU 48 H GLU 48 10.169 -1.772 1.110 162 HA GLU 48 HA GLU 48 8.511 -3.819 0.129 163 HB2 GLU 48 HB2 GLU 48 10.907 -3.387 -0.469 164 HB3 GLU 48 HB3 GLU 48 11.390 -4.033 1.101 165 HG2 GLU 48 HG2 GLU 48 10.273 -6.225 0.448 166 HG3 GLU 48 HG3 GLU 48 9.986 -5.536 -1.148 167 H GLY 49 H GLY 49 7.474 -5.515 0.959 168 HA2 GLY 49 HA2 GLY 49 7.164 -7.392 2.361 169 HA3 GLY 49 HA3 GLY 49 8.180 -6.666 3.602 170 H GLU 50 H GLU 50 6.519 -4.045 3.218 171 HA GLU 50 HA GLU 50 4.331 -4.687 5.095 172 HB2 GLU 50 HB2 GLU 50 5.536 -2.194 3.918 173 HB3 GLU 50 HB3 GLU 50 3.909 -2.098 4.556 174 HG2 GLU 50 HG2 GLU 50 6.155 -3.280 6.220 175 HG3 GLU 50 HG3 GLU 50 5.975 -1.538 6.056 176 HA PRO 51 HA PRO 51 1.173 -5.301 2.121 177 HB2 PRO 51 HB2 PRO 51 -1.054 -4.207 3.264 178 HB3 PRO 51 HB3 PRO 51 -0.241 -5.683 3.882 179 HG2 PRO 51 HG2 PRO 51 0.128 -2.825 4.842 180 HG3 PRO 51 HG3 PRO 51 -0.219 -4.275 5.840 181 HD2 PRO 51 HD2 PRO 51 2.284 -3.371 5.539 182 HD3 PRO 51 HD3 PRO 51 1.961 -5.132 5.512 183 H GLY 52 H GLY 52 0.777 -4.379 0.238 184 HA2 GLY 52 HA2 GLY 52 -0.231 -2.768 -1.163 185 HA3 GLY 52 HA3 GLY 52 0.058 -1.497 0.028 186 H TYR 53 H TYR 53 3.011 -2.966 -0.007 187 HA TYR 53 HA TYR 53 4.390 -1.131 -1.653 188 HB2 TYR 53 HB2 TYR 53 5.461 -2.445 0.078 189 HB3 TYR 53 HB3 TYR 53 4.992 -3.952 -0.685 190 HD1 TYR 53 HD1 TYR 53 7.201 -0.974 -1.026 191 HD2 TYR 53 HD2 TYR 53 6.283 -4.945 -2.446 192 HE1 TYR 53 HE1 TYR 53 9.422 -1.095 -2.192 193 HE2 TYR 53 HE2 TYR 53 8.457 -5.026 -3.654 194 HH TYR 53 HH TYR 53 10.399 -3.916 -4.159 195 H SER 54 H SER 54 2.698 -4.062 -2.513 196 HA SER 54 HA SER 54 3.959 -4.685 -5.012 197 HB2 SER 54 HB2 SER 54 1.220 -5.335 -3.857 198 HB3 SER 54 HB3 SER 54 1.828 -6.027 -5.362 199 HG SER 54 HG SER 54 3.512 -6.999 -4.229 200 H ALA 55 H ALA 55 3.218 -4.442 -7.139 201 HA ALA 55 HA ALA 55 2.226 -1.949 -7.992 202 HB1 ALA 55 HB1 ALA 55 2.101 -3.001 -10.193 203 HB2 ALA 55 HB2 ALA 55 3.561 -3.549 -9.354 204 HB3 ALA 55 HB3 ALA 55 2.147 -4.619 -9.462 205 H LYS 56 H LYS 56 0.403 -4.675 -6.869 206 HA LYS 56 HA LYS 56 -2.208 -4.189 -7.883 207 HB2 LYS 56 HB2 LYS 56 -1.355 -5.182 -5.122 208 HB3 LYS 56 HB3 LYS 56 -2.960 -5.348 -5.817 209 HG2 LYS 56 HG2 LYS 56 -0.419 -6.712 -6.799 210 HG3 LYS 56 HG3 LYS 56 -1.782 -7.439 -5.953 211 HD2 LYS 56 HD2 LYS 56 -3.252 -6.685 -7.946 212 HD3 LYS 56 HD3 LYS 56 -1.741 -6.290 -8.773 213 HE2 LYS 56 HE2 LYS 56 -2.402 -8.438 -9.530 214 HE3 LYS 56 HE3 LYS 56 -0.989 -8.667 -8.496 215 HZ1 LYS 56 HZ1 LYS 56 -2.811 -10.272 -8.059 216 HZ2 LYS 56 HZ2 LYS 56 -3.801 -9.061 -7.602 217 HZ3 LYS 56 HZ3 LYS 56 -2.463 -9.405 -6.725 218 H LEU 57 H LEU 57 -0.416 -2.337 -5.504 219 HA LEU 57 HA LEU 57 -2.838 -0.672 -4.896 220 HB2 LEU 57 HB2 LEU 57 -0.581 -1.768 -3.318 221 HB3 LEU 57 HB3 LEU 57 -0.756 -0.042 -3.102 222 HG LEU 57 HG LEU 57 -1.928 -1.231 -1.392 223 HD11 LEU 57 HD11 LEU 57 -3.700 0.207 -1.327 224 HD12 LEU 57 HD12 LEU 57 -4.260 -0.206 -2.965 225 HD13 LEU 57 HD13 LEU 57 -2.902 0.913 -2.717 226 HD21 LEU 57 HD21 LEU 57 -2.356 -3.294 -2.764 227 HD22 LEU 57 HD22 LEU 57 -3.706 -2.438 -3.544 228 HD23 LEU 57 HD23 LEU 57 -3.746 -2.762 -1.805 229 H ASP 58 H ASP 58 0.630 -0.550 -5.709 230 HA ASP 58 HA ASP 58 0.454 2.385 -6.127 231 HB2 ASP 58 HB2 ASP 58 2.103 1.304 -4.554 232 HB3 ASP 58 HB3 ASP 58 2.920 0.611 -5.950 233 H ARG 59 H ARG 59 -0.502 2.577 -8.159 234 HA ARG 59 HA ARG 59 -0.014 1.031 -10.459 235 HB2 ARG 59 HB2 ARG 59 -1.948 2.342 -10.360 236 HB3 ARG 59 HB3 ARG 59 -1.088 3.809 -9.893 237 HG2 ARG 59 HG2 ARG 59 -0.350 4.282 -12.013 238 HG3 ARG 59 HG3 ARG 59 -0.529 2.622 -12.607 239 HD2 ARG 59 HD2 ARG 59 -2.927 4.306 -11.808 240 HD3 ARG 59 HD3 ARG 59 -2.229 4.349 -13.440 241 HE ARG 59 HE ARG 59 -2.588 1.633 -12.833 242 HH11 ARG 59 HH11 ARG 59 -4.734 4.362 -13.300 243 HH12 ARG 59 HH12 ARG 59 -6.010 3.358 -13.936 244 HH21 ARG 59 HH21 ARG 59 -4.231 0.423 -13.664 245 HH22 ARG 59 HH22 ARG 59 -5.724 1.180 -14.137 246 H ASP 60 H ASP 60 1.767 3.872 -9.301 247 HA ASP 60 HA ASP 60 3.547 4.003 -11.589 248 HB2 ASP 60 HB2 ASP 60 4.823 5.582 -10.152 249 HB3 ASP 60 HB3 ASP 60 3.137 5.996 -10.384 250 H HIS 61 H HIS 61 3.406 1.807 -9.014 251 HA HIS 61 HA HIS 61 4.869 0.581 -7.817 252 HB2 HIS 61 HB2 HIS 61 4.085 -0.687 -9.818 253 HB3 HIS 61 HB3 HIS 61 5.600 -0.297 -10.626 254 HD1 HIS 61 HD1 HIS 61 6.998 -2.488 -10.574 255 HD2 HIS 61 HD2 HIS 61 4.927 -1.687 -6.979 256 HE1 HIS 61 HE1 HIS 61 7.666 -4.346 -8.919 257 HE2 HIS 61 HE2 HIS 61 6.422 -3.832 -6.723 258 H ASP 62 H ASP 62 5.993 2.877 -7.539 259 HA ASP 62 HA ASP 62 8.816 2.876 -8.411 260 HB2 ASP 62 HB2 ASP 62 8.959 5.084 -7.568 261 HB3 ASP 62 HB3 ASP 62 7.449 4.945 -8.459 262 H GLY 63 H GLY 63 7.502 1.028 -6.192 263 HA2 GLY 63 HA2 GLY 63 8.376 -0.153 -4.424 264 HA3 GLY 63 HA3 GLY 63 9.871 0.782 -4.527 265 H VAL 64 H VAL 64 7.055 2.761 -4.260 266 HA VAL 64 HA VAL 64 7.021 2.720 -1.283 267 HB VAL 64 HB VAL 64 7.011 5.351 -2.816 268 HG11 VAL 64 HG11 VAL 64 5.899 5.316 -0.594 269 HG12 VAL 64 HG12 VAL 64 7.369 4.633 0.131 270 HG13 VAL 64 HG13 VAL 64 7.384 6.273 -0.551 271 HG21 VAL 64 HG21 VAL 64 9.270 5.763 -1.944 272 HG22 VAL 64 HG22 VAL 64 9.361 4.068 -1.393 273 HG23 VAL 64 HG23 VAL 64 9.235 4.455 -3.130 274 H ALA 65 H ALA 65 4.979 2.446 -0.663 275 HA ALA 65 HA ALA 65 2.809 3.408 -2.477 276 HB1 ALA 65 HB1 ALA 65 1.418 1.624 -1.365 277 HB2 ALA 65 HB2 ALA 65 2.766 1.040 -2.361 278 HB3 ALA 65 HB3 ALA 65 2.911 1.017 -0.611 279 H CYS 66 H CYS 66 1.145 4.526 -1.704 280 HA CYS 66 HA CYS 66 0.228 6.251 -0.633 281 HB2 CYS 66 HB2 CYS 66 0.490 4.642 1.894 282 HB3 CYS 66 HB3 CYS 66 -0.812 5.708 1.395 283 H GLU 67 H GLU 67 2.781 6.887 -1.118 284 HA GLU 67 HA GLU 67 4.313 7.918 1.043 285 HB2 GLU 67 HB2 GLU 67 5.333 9.366 -0.730 286 HB3 GLU 67 HB3 GLU 67 5.390 7.648 -1.021 287 HG2 GLU 67 HG2 GLU 67 3.154 9.234 -2.305 288 HG3 GLU 67 HG3 GLU 67 4.794 9.402 -2.911 289 H LEU 68 H LEU 68 4.551 9.911 2.020 290 HA LEU 68 HA LEU 68 2.461 12.017 1.581 291 HB2 LEU 68 HB2 LEU 68 3.443 10.719 4.143 292 HB3 LEU 68 HB3 LEU 68 2.730 12.319 4.172 293 HG LEU 68 HG LEU 68 1.302 9.817 3.237 294 HD11 LEU 68 HD11 LEU 68 1.744 10.043 5.687 295 HD12 LEU 68 HD12 LEU 68 0.012 10.123 5.303 296 HD13 LEU 68 HD13 LEU 68 0.917 11.610 5.677 297 HD21 LEU 68 HD21 LEU 68 -0.735 11.362 3.367 298 HD22 LEU 68 HD22 LEU 68 0.340 11.687 2.007 299 HD23 LEU 68 HD23 LEU 68 0.398 12.729 3.451 300 H LYS 69 H LYS 69 5.293 11.767 0.681 301 HA LYS 69 HA LYS 69 6.370 14.330 1.802 302 HB2 LYS 69 HB2 LYS 69 8.593 13.400 1.867 303 HB3 LYS 69 HB3 LYS 69 7.467 12.473 2.822 304 HG2 LYS 69 HG2 LYS 69 8.723 10.818 1.887 305 HG3 LYS 69 HG3 LYS 69 7.336 10.827 0.801 306 HD2 LYS 69 HD2 LYS 69 8.633 11.998 -0.916 307 HD3 LYS 69 HD3 LYS 69 9.925 12.343 0.241 308 HE2 LYS 69 HE2 LYS 69 10.666 10.574 -1.190 309 HE3 LYS 69 HE3 LYS 69 10.436 9.931 0.438 310 HZ1 LYS 69 HZ1 LYS 69 8.349 8.959 -0.287 311 HZ2 LYS 69 HZ2 LYS 69 9.532 8.480 -1.305 312 HZ3 LYS 69 HZ3 LYS 69 8.482 9.635 -1.781 313 H ASN 70 H ASN 70 4.880 13.724 -0.711 314 HA ASN 70 HA ASN 70 6.453 14.257 -3.032 315 HB2 ASN 70 HB2 ASN 70 4.084 13.437 -3.022 316 HB3 ASN 70 HB3 ASN 70 3.566 14.997 -2.383 317 HD21 ASN 70 HD21 ASN 70 2.214 15.498 -4.149 318 HD22 ASN 70 HD22 ASN 70 2.869 15.814 -5.750 Start of MODEL 18 1 H1 GLY 24 H1 GLY 24 -2.563 -26.067 -0.811 2 H2 GLY 24 H2 GLY 24 -3.040 -27.335 0.114 3 H3 GLY 24 H3 GLY 24 -3.672 -27.128 -1.383 4 HA2 GLY 24 HA2 GLY 24 -4.751 -25.079 -0.714 5 HA3 GLY 24 HA3 GLY 24 -5.289 -26.465 0.247 6 H ALA 25 H ALA 25 -4.249 -23.329 0.413 7 HA ALA 25 HA ALA 25 -3.588 -23.507 3.315 8 HB1 ALA 25 HB1 ALA 25 -1.480 -23.097 2.087 9 HB2 ALA 25 HB2 ALA 25 -2.225 -21.744 1.217 10 HB3 ALA 25 HB3 ALA 25 -1.960 -21.637 2.961 11 H SER 26 H SER 26 -4.179 -21.655 4.535 12 HA SER 26 HA SER 26 -6.696 -20.421 3.890 13 HB2 SER 26 HB2 SER 26 -4.608 -19.709 5.992 14 HB3 SER 26 HB3 SER 26 -6.270 -19.088 5.935 15 HG SER 26 HG SER 26 -6.100 -20.876 7.336 16 H GLU 27 H GLU 27 -7.027 -18.019 3.970 17 HA GLU 27 HA GLU 27 -5.014 -16.559 2.300 18 HB2 GLU 27 HB2 GLU 27 -7.339 -16.964 1.367 19 HB3 GLU 27 HB3 GLU 27 -7.961 -15.905 2.640 20 HG2 GLU 27 HG2 GLU 27 -6.345 -14.118 1.787 21 HG3 GLU 27 HG3 GLU 27 -5.959 -15.197 0.447 22 H GLU 28 H GLU 28 -3.784 -15.218 3.450 23 HA GLU 28 HA GLU 28 -5.004 -13.520 5.569 24 HB2 GLU 28 HB2 GLU 28 -3.141 -13.856 7.057 25 HB3 GLU 28 HB3 GLU 28 -3.995 -15.349 6.764 26 HG2 GLU 28 HG2 GLU 28 -1.419 -14.630 5.299 27 HG3 GLU 28 HG3 GLU 28 -1.425 -15.393 6.883 28 H ASN 29 H ASN 29 -4.259 -13.019 2.763 29 HA ASN 29 HA ASN 29 -2.088 -11.012 2.939 30 HB2 ASN 29 HB2 ASN 29 -2.270 -12.652 1.037 31 HB3 ASN 29 HB3 ASN 29 -3.819 -11.929 0.591 32 HD21 ASN 29 HD21 ASN 29 -0.388 -10.990 1.217 33 HD22 ASN 29 HD22 ASN 29 -0.347 -9.804 -0.076 34 H ILE 30 H ILE 30 -2.418 -8.824 2.893 35 HA ILE 30 HA ILE 30 -5.127 -7.754 3.387 36 HB ILE 30 HB ILE 30 -2.325 -6.604 3.445 37 HG12 ILE 30 HG12 ILE 30 -4.364 -6.704 5.701 38 HG13 ILE 30 HG13 ILE 30 -3.353 -8.108 5.346 39 HG21 ILE 30 HG21 ILE 30 -4.952 -5.105 3.889 40 HG22 ILE 30 HG22 ILE 30 -3.364 -4.491 4.363 41 HG23 ILE 30 HG23 ILE 30 -3.706 -4.753 2.661 42 HD11 ILE 30 HD11 ILE 30 -2.335 -5.354 6.137 43 HD12 ILE 30 HD12 ILE 30 -2.402 -6.802 7.155 44 HD13 ILE 30 HD13 ILE 30 -1.324 -6.775 5.752 45 H HIS 31 H HIS 31 -6.304 -6.508 2.068 46 HA HIS 31 HA HIS 31 -5.264 -5.713 -0.607 47 HB2 HIS 31 HB2 HIS 31 -6.456 -7.939 -0.690 48 HB3 HIS 31 HB3 HIS 31 -7.929 -7.129 -0.190 49 HD1 HIS 31 HD1 HIS 31 -6.656 -8.453 -3.181 50 HD2 HIS 31 HD2 HIS 31 -8.242 -4.689 -2.113 51 HE1 HIS 31 HE1 HIS 31 -7.420 -7.330 -5.371 52 HE2 HIS 31 HE2 HIS 31 -8.375 -5.034 -4.702 53 H PHE 32 H PHE 32 -5.175 -3.565 0.053 54 HA PHE 32 HA PHE 32 -7.562 -2.075 0.919 55 HB2 PHE 32 HB2 PHE 32 -4.816 -1.298 -0.107 56 HB3 PHE 32 HB3 PHE 32 -6.059 -0.111 0.264 57 HD1 PHE 32 HD1 PHE 32 -3.350 -2.063 1.601 58 HD2 PHE 32 HD2 PHE 32 -7.056 -0.109 2.639 59 HE1 PHE 32 HE1 PHE 32 -2.672 -2.037 3.995 60 HE2 PHE 32 HE2 PHE 32 -6.381 -0.103 5.030 61 HZ PHE 32 HZ PHE 32 -4.202 -1.075 5.707 62 H SER 33 H SER 33 -8.992 -0.960 -0.367 63 HA SER 33 HA SER 33 -9.065 -1.525 -3.254 64 HB2 SER 33 HB2 SER 33 -10.839 0.241 -1.523 65 HB3 SER 33 HB3 SER 33 -11.120 -0.155 -3.227 66 HG SER 33 HG SER 33 -11.080 -1.945 -1.007 67 H SER 34 H SER 34 -7.832 1.051 -1.279 68 HA SER 34 HA SER 34 -6.546 2.418 -3.487 69 HB2 SER 34 HB2 SER 34 -9.044 3.576 -2.213 70 HB3 SER 34 HB3 SER 34 -7.711 4.664 -2.610 71 HG SER 34 HG SER 34 -8.854 2.849 -4.465 72 H CYS 35 H CYS 35 -4.883 3.811 -2.706 73 HA CYS 35 HA CYS 35 -3.974 3.672 -0.034 74 HB2 CYS 35 HB2 CYS 35 -3.459 5.582 -2.309 75 HB3 CYS 35 HB3 CYS 35 -2.849 5.960 -0.704 76 H LYS 36 H LYS 36 -6.500 5.762 -1.305 77 HA LYS 36 HA LYS 36 -6.780 7.691 0.748 78 HB2 LYS 36 HB2 LYS 36 -8.909 6.182 -0.814 79 HB3 LYS 36 HB3 LYS 36 -9.205 7.626 0.158 80 HG2 LYS 36 HG2 LYS 36 -7.720 8.964 -1.239 81 HG3 LYS 36 HG3 LYS 36 -7.286 7.568 -2.223 82 HD2 LYS 36 HD2 LYS 36 -10.105 8.686 -1.942 83 HD3 LYS 36 HD3 LYS 36 -9.013 9.101 -3.257 84 HE2 LYS 36 HE2 LYS 36 -9.900 6.239 -2.671 85 HE3 LYS 36 HE3 LYS 36 -10.792 7.319 -3.735 86 HZ1 LYS 36 HZ1 LYS 36 -9.141 5.823 -4.869 87 HZ2 LYS 36 HZ2 LYS 36 -7.931 6.679 -4.206 88 HZ3 LYS 36 HZ3 LYS 36 -8.962 7.411 -5.236 89 H GLU 37 H GLU 37 -7.863 4.304 0.784 90 HA GLU 37 HA GLU 37 -9.099 4.500 3.434 91 HB2 GLU 37 HB2 GLU 37 -9.851 2.983 1.602 92 HB3 GLU 37 HB3 GLU 37 -8.335 2.083 1.740 93 HG2 GLU 37 HG2 GLU 37 -8.912 1.394 4.022 94 HG3 GLU 37 HG3 GLU 37 -10.336 2.444 4.010 95 H ALA 38 H ALA 38 -5.965 3.405 2.125 96 HA ALA 38 HA ALA 38 -4.903 2.338 4.565 97 HB1 ALA 38 HB1 ALA 38 -4.078 1.915 2.219 98 HB2 ALA 38 HB2 ALA 38 -3.407 3.564 2.211 99 HB3 ALA 38 HB3 ALA 38 -2.801 2.355 3.348 100 H TRP 39 H TRP 39 -4.538 5.618 3.079 101 HA TRP 39 HA TRP 39 -3.061 6.835 5.169 102 HB2 TRP 39 HB2 TRP 39 -4.987 7.920 3.089 103 HB3 TRP 39 HB3 TRP 39 -4.198 8.971 4.246 104 HD1 TRP 39 HD1 TRP 39 -1.270 7.921 4.225 105 HE1 TRP 39 HE1 TRP 39 0.241 8.239 2.178 106 HE3 TRP 39 HE3 TRP 39 -4.864 8.649 0.654 107 HZ2 TRP 39 HZ2 TRP 39 -0.060 8.877 -0.616 108 HZ3 TRP 39 HZ3 TRP 39 -4.222 9.064 -1.714 109 HH2 TRP 39 HH2 TRP 39 -1.823 9.175 -2.358 110 H ALA 40 H ALA 40 -6.623 6.444 4.890 111 HA ALA 40 HA ALA 40 -7.293 7.996 7.184 112 HB1 ALA 40 HB1 ALA 40 -8.905 7.276 5.459 113 HB2 ALA 40 HB2 ALA 40 -8.718 5.584 5.982 114 HB3 ALA 40 HB3 ALA 40 -9.428 6.783 7.083 115 H ASN 41 H ASN 41 -5.827 4.839 7.003 116 HA ASN 41 HA ASN 41 -6.184 4.355 9.926 117 HB2 ASN 41 HB2 ASN 41 -5.302 2.590 7.596 118 HB3 ASN 41 HB3 ASN 41 -5.199 2.101 9.285 119 HD21 ASN 41 HD21 ASN 41 -7.476 2.786 6.634 120 HD22 ASN 41 HD22 ASN 41 -8.848 2.107 7.493 121 H GLY 42 H GLY 42 -4.102 6.149 8.137 122 HA2 GLY 42 HA2 GLY 42 -2.102 7.111 8.739 123 HA3 GLY 42 HA3 GLY 42 -1.973 6.021 10.120 124 H TYR 43 H TYR 43 -2.410 4.443 7.034 125 HA TYR 43 HA TYR 43 0.304 3.299 7.147 126 HB2 TYR 43 HB2 TYR 43 -2.049 2.876 5.299 127 HB3 TYR 43 HB3 TYR 43 -0.485 2.147 5.037 128 HD1 TYR 43 HD1 TYR 43 -0.858 -0.136 5.211 129 HD2 TYR 43 HD2 TYR 43 -2.477 2.442 8.274 130 HE1 TYR 43 HE1 TYR 43 -1.648 -2.126 6.512 131 HE2 TYR 43 HE2 TYR 43 -3.198 0.475 9.563 132 HH TYR 43 HH TYR 43 -3.312 -1.809 9.654 133 H SER 44 H SER 44 1.880 4.647 6.530 134 HA SER 44 HA SER 44 1.892 5.766 3.796 135 HB2 SER 44 HB2 SER 44 2.709 7.964 4.636 136 HB3 SER 44 HB3 SER 44 1.033 7.622 5.068 137 HG SER 44 HG SER 44 3.314 7.364 6.777 138 H ASP 45 H ASP 45 4.035 6.462 3.109 139 HA ASP 45 HA ASP 45 6.118 5.757 2.549 140 HB2 ASP 45 HB2 ASP 45 6.637 7.348 4.353 141 HB3 ASP 45 HB3 ASP 45 6.636 6.033 5.526 142 H ILE 46 H ILE 46 4.375 3.700 2.560 143 HA ILE 46 HA ILE 46 5.125 1.315 3.952 144 HB ILE 46 HB ILE 46 3.905 1.695 1.203 145 HG12 ILE 46 HG12 ILE 46 2.439 1.088 3.808 146 HG13 ILE 46 HG13 ILE 46 2.558 2.704 3.118 147 HG21 ILE 46 HG21 ILE 46 3.273 -0.552 1.148 148 HG22 ILE 46 HG22 ILE 46 4.888 -0.676 1.805 149 HG23 ILE 46 HG23 ILE 46 3.488 -0.786 2.879 150 HD11 ILE 46 HD11 ILE 46 1.297 0.377 1.596 151 HD12 ILE 46 HD12 ILE 46 0.409 1.558 2.580 152 HD13 ILE 46 HD13 ILE 46 1.317 2.078 1.149 153 H HIS 47 H HIS 47 7.018 0.279 3.849 154 HA HIS 47 HA HIS 47 8.742 0.358 1.394 155 HB2 HIS 47 HB2 HIS 47 9.310 -0.364 4.304 156 HB3 HIS 47 HB3 HIS 47 10.454 -0.650 3.002 157 HD1 HIS 47 HD1 HIS 47 11.823 1.066 4.870 158 HD2 HIS 47 HD2 HIS 47 8.932 2.639 2.227 159 HE1 HIS 47 HE1 HIS 47 12.241 3.606 4.752 160 HE2 HIS 47 HE2 HIS 47 10.393 4.557 3.197 161 H GLU 48 H GLU 48 9.992 -1.796 1.119 162 HA GLU 48 HA GLU 48 8.311 -3.884 0.310 163 HB2 GLU 48 HB2 GLU 48 10.384 -5.313 0.430 164 HB3 GLU 48 HB3 GLU 48 10.520 -3.836 -0.522 165 HG2 GLU 48 HG2 GLU 48 11.751 -2.704 1.221 166 HG3 GLU 48 HG3 GLU 48 11.493 -4.029 2.356 167 H GLY 49 H GLY 49 7.433 -5.678 1.140 168 HA2 GLY 49 HA2 GLY 49 6.952 -7.377 2.658 169 HA3 GLY 49 HA3 GLY 49 7.997 -6.629 3.863 170 H GLU 50 H GLU 50 6.457 -3.956 3.471 171 HA GLU 50 HA GLU 50 4.225 -4.489 5.316 172 HB2 GLU 50 HB2 GLU 50 5.343 -2.011 3.979 173 HB3 GLU 50 HB3 GLU 50 3.785 -1.965 4.771 174 HG2 GLU 50 HG2 GLU 50 6.191 -3.007 6.277 175 HG3 GLU 50 HG3 GLU 50 5.934 -1.277 6.072 176 HA PRO 51 HA PRO 51 1.105 -5.205 2.307 177 HB2 PRO 51 HB2 PRO 51 -1.148 -4.122 3.419 178 HB3 PRO 51 HB3 PRO 51 -0.327 -5.585 4.055 179 HG2 PRO 51 HG2 PRO 51 -0.003 -2.718 5.002 180 HG3 PRO 51 HG3 PRO 51 -0.340 -4.170 6.002 181 HD2 PRO 51 HD2 PRO 51 2.158 -3.219 5.718 182 HD3 PRO 51 HD3 PRO 51 1.862 -4.984 5.714 183 H GLY 52 H GLY 52 0.585 -4.304 0.416 184 HA2 GLY 52 HA2 GLY 52 -0.381 -2.686 -0.997 185 HA3 GLY 52 HA3 GLY 52 -0.073 -1.415 0.186 186 H TYR 53 H TYR 53 2.865 -2.914 0.098 187 HA TYR 53 HA TYR 53 4.233 -1.056 -1.549 188 HB2 TYR 53 HB2 TYR 53 5.336 -2.320 0.178 189 HB3 TYR 53 HB3 TYR 53 4.841 -3.849 -0.521 190 HD1 TYR 53 HD1 TYR 53 7.185 -0.985 -0.901 191 HD2 TYR 53 HD2 TYR 53 6.074 -4.930 -2.261 192 HE1 TYR 53 HE1 TYR 53 9.384 -1.218 -2.061 193 HE2 TYR 53 HE2 TYR 53 8.265 -5.144 -3.432 194 HH TYR 53 HH TYR 53 10.721 -2.532 -3.360 195 H SER 54 H SER 54 2.510 -3.954 -2.386 196 HA SER 54 HA SER 54 3.767 -4.703 -4.832 197 HB2 SER 54 HB2 SER 54 0.935 -5.147 -3.794 198 HB3 SER 54 HB3 SER 54 1.642 -6.002 -5.169 199 HG SER 54 HG SER 54 3.206 -6.884 -3.781 200 H ALA 55 H ALA 55 3.058 -4.531 -6.980 201 HA ALA 55 HA ALA 55 2.121 -2.054 -7.963 202 HB1 ALA 55 HB1 ALA 55 2.007 -4.780 -9.334 203 HB2 ALA 55 HB2 ALA 55 2.036 -3.190 -10.119 204 HB3 ALA 55 HB3 ALA 55 3.456 -3.758 -9.229 205 H LYS 56 H LYS 56 0.255 -4.690 -6.690 206 HA LYS 56 HA LYS 56 -2.324 -4.191 -7.797 207 HB2 LYS 56 HB2 LYS 56 -1.696 -5.149 -4.971 208 HB3 LYS 56 HB3 LYS 56 -3.205 -5.361 -5.867 209 HG2 LYS 56 HG2 LYS 56 -1.788 -6.652 -7.612 210 HG3 LYS 56 HG3 LYS 56 -0.527 -6.700 -6.373 211 HD2 LYS 56 HD2 LYS 56 -3.344 -7.844 -6.154 212 HD3 LYS 56 HD3 LYS 56 -1.855 -8.759 -6.402 213 HE2 LYS 56 HE2 LYS 56 -1.018 -7.950 -4.175 214 HE3 LYS 56 HE3 LYS 56 -2.565 -7.129 -3.921 215 HZ1 LYS 56 HZ1 LYS 56 -2.210 -10.060 -4.265 216 HZ2 LYS 56 HZ2 LYS 56 -3.653 -9.324 -4.089 217 HZ3 LYS 56 HZ3 LYS 56 -2.576 -9.311 -2.860 218 H LEU 57 H LEU 57 -0.518 -2.290 -5.488 219 HA LEU 57 HA LEU 57 -2.910 -0.564 -4.941 220 HB2 LEU 57 HB2 LEU 57 -0.725 -1.695 -3.271 221 HB3 LEU 57 HB3 LEU 57 -0.882 0.034 -3.086 222 HG LEU 57 HG LEU 57 -2.110 -1.074 -1.383 223 HD11 LEU 57 HD11 LEU 57 -3.011 1.054 -2.594 224 HD12 LEU 57 HD12 LEU 57 -4.067 0.208 -1.476 225 HD13 LEU 57 HD13 LEU 57 -4.279 -0.024 -3.220 226 HD21 LEU 57 HD21 LEU 57 -2.539 -3.198 -2.617 227 HD22 LEU 57 HD22 LEU 57 -3.813 -2.375 -3.543 228 HD23 LEU 57 HD23 LEU 57 -3.978 -2.569 -1.793 229 H ASP 58 H ASP 58 0.581 -0.569 -5.653 230 HA ASP 58 HA ASP 58 0.529 2.369 -6.085 231 HB2 ASP 58 HB2 ASP 58 2.086 1.245 -4.467 232 HB3 ASP 58 HB3 ASP 58 2.905 0.491 -5.829 233 H ARG 59 H ARG 59 -0.391 2.560 -8.137 234 HA ARG 59 HA ARG 59 0.029 0.981 -10.408 235 HB2 ARG 59 HB2 ARG 59 -1.830 2.512 -10.060 236 HB3 ARG 59 HB3 ARG 59 -0.742 3.892 -9.951 237 HG2 ARG 59 HG2 ARG 59 -1.919 3.900 -12.026 238 HG3 ARG 59 HG3 ARG 59 -0.185 3.721 -12.303 239 HD2 ARG 59 HD2 ARG 59 -0.443 1.356 -12.816 240 HD3 ARG 59 HD3 ARG 59 -2.147 1.385 -12.315 241 HE ARG 59 HE ARG 59 -2.015 3.286 -14.317 242 HH11 ARG 59 HH11 ARG 59 -1.226 -0.134 -14.257 243 HH12 ARG 59 HH12 ARG 59 -1.647 -0.345 -15.935 244 HH21 ARG 59 HH21 ARG 59 -2.549 2.933 -16.435 245 HH22 ARG 59 HH22 ARG 59 -2.378 1.346 -17.127 246 H ASP 60 H ASP 60 1.900 3.782 -9.313 247 HA ASP 60 HA ASP 60 3.704 3.845 -11.589 248 HB2 ASP 60 HB2 ASP 60 4.969 5.434 -10.167 249 HB3 ASP 60 HB3 ASP 60 3.277 5.855 -10.380 250 H HIS 61 H HIS 61 3.496 1.693 -8.978 251 HA HIS 61 HA HIS 61 4.942 0.553 -7.678 252 HB2 HIS 61 HB2 HIS 61 4.114 -0.804 -9.622 253 HB3 HIS 61 HB3 HIS 61 5.680 -0.571 -10.389 254 HD1 HIS 61 HD1 HIS 61 5.114 -1.497 -6.618 255 HD2 HIS 61 HD2 HIS 61 6.621 -3.019 -10.263 256 HE1 HIS 61 HE1 HIS 61 6.286 -3.711 -6.050 257 HE2 HIS 61 HE2 HIS 61 7.178 -4.649 -8.281 258 H ASP 62 H ASP 62 6.133 2.756 -7.452 259 HA ASP 62 HA ASP 62 8.948 2.697 -8.342 260 HB2 ASP 62 HB2 ASP 62 9.098 4.925 -7.532 261 HB3 ASP 62 HB3 ASP 62 7.586 4.777 -8.418 262 H GLY 63 H GLY 63 7.523 1.029 -5.972 263 HA2 GLY 63 HA2 GLY 63 8.461 -0.163 -4.225 264 HA3 GLY 63 HA3 GLY 63 9.941 0.795 -4.333 265 H VAL 64 H VAL 64 7.219 2.848 -4.122 266 HA VAL 64 HA VAL 64 7.090 2.807 -1.140 267 HB VAL 64 HB VAL 64 7.225 5.411 -2.714 268 HG11 VAL 64 HG11 VAL 64 7.404 4.776 0.269 269 HG12 VAL 64 HG12 VAL 64 7.485 6.391 -0.467 270 HG13 VAL 64 HG13 VAL 64 5.983 5.460 -0.549 271 HG21 VAL 64 HG21 VAL 64 9.427 4.064 -1.122 272 HG22 VAL 64 HG22 VAL 64 9.431 4.424 -2.867 273 HG23 VAL 64 HG23 VAL 64 9.450 5.752 -1.701 274 H ALA 65 H ALA 65 5.019 2.440 -0.644 275 HA ALA 65 HA ALA 65 2.942 3.463 -2.526 276 HB1 ALA 65 HB1 ALA 65 1.486 1.688 -1.683 277 HB2 ALA 65 HB2 ALA 65 2.988 1.034 -2.356 278 HB3 ALA 65 HB3 ALA 65 2.779 1.109 -0.611 279 H CYS 66 H CYS 66 1.141 4.477 -1.799 280 HA CYS 66 HA CYS 66 0.204 6.254 -0.803 281 HB2 CYS 66 HB2 CYS 66 0.436 4.702 1.767 282 HB3 CYS 66 HB3 CYS 66 -0.840 5.792 1.253 283 H GLU 67 H GLU 67 2.760 6.873 -1.264 284 HA GLU 67 HA GLU 67 4.357 7.824 0.859 285 HB2 GLU 67 HB2 GLU 67 5.285 9.387 -0.899 286 HB3 GLU 67 HB3 GLU 67 5.385 7.672 -1.228 287 HG2 GLU 67 HG2 GLU 67 3.021 9.140 -2.386 288 HG3 GLU 67 HG3 GLU 67 4.610 9.488 -3.047 289 H LEU 68 H LEU 68 4.640 9.759 1.933 290 HA LEU 68 HA LEU 68 2.611 11.938 1.530 291 HB2 LEU 68 HB2 LEU 68 3.513 10.629 4.106 292 HB3 LEU 68 HB3 LEU 68 2.971 12.298 4.099 293 HG LEU 68 HG LEU 68 1.296 9.905 3.277 294 HD11 LEU 68 HD11 LEU 68 1.142 11.772 5.693 295 HD12 LEU 68 HD12 LEU 68 1.760 10.111 5.718 296 HD13 LEU 68 HD13 LEU 68 0.054 10.407 5.344 297 HD21 LEU 68 HD21 LEU 68 0.470 12.848 3.515 298 HD22 LEU 68 HD22 LEU 68 -0.640 11.482 3.357 299 HD23 LEU 68 HD23 LEU 68 0.445 11.872 2.034 300 H LYS 69 H LYS 69 5.971 11.179 2.477 301 HA LYS 69 HA LYS 69 6.685 14.028 2.811 302 HB2 LYS 69 HB2 LYS 69 8.212 11.406 2.949 303 HB3 LYS 69 HB3 LYS 69 9.051 12.947 2.821 304 HG2 LYS 69 HG2 LYS 69 8.961 12.284 5.117 305 HG3 LYS 69 HG3 LYS 69 8.041 13.770 4.875 306 HD2 LYS 69 HD2 LYS 69 5.930 12.595 5.130 307 HD3 LYS 69 HD3 LYS 69 6.735 11.022 5.022 308 HE2 LYS 69 HE2 LYS 69 6.163 11.439 7.326 309 HE3 LYS 69 HE3 LYS 69 7.917 11.440 7.143 310 HZ1 LYS 69 HZ1 LYS 69 7.859 13.877 7.197 311 HZ2 LYS 69 HZ2 LYS 69 7.152 13.278 8.535 312 HZ3 LYS 69 HZ3 LYS 69 6.227 13.881 7.336 313 H ASN 70 H ASN 70 6.521 15.189 1.018 314 HA ASN 70 HA ASN 70 6.999 14.355 -1.674 315 HB2 ASN 70 HB2 ASN 70 7.056 17.141 -0.414 316 HB3 ASN 70 HB3 ASN 70 7.050 16.821 -2.142 317 HD21 ASN 70 HD21 ASN 70 5.137 15.470 -2.968 318 HD22 ASN 70 HD22 ASN 70 3.589 15.826 -2.217 Start of MODEL 19 1 H1 GLY 24 H1 GLY 24 -9.713 -14.861 12.167 2 H2 GLY 24 H2 GLY 24 -9.894 -14.436 10.599 3 H3 GLY 24 H3 GLY 24 -10.966 -15.461 11.300 4 HA2 GLY 24 HA2 GLY 24 -8.109 -16.045 10.803 5 HA3 GLY 24 HA3 GLY 24 -9.253 -17.136 11.601 6 H ALA 25 H ALA 25 -8.543 -15.473 8.520 7 HA ALA 25 HA ALA 25 -10.370 -17.231 6.993 8 HB1 ALA 25 HB1 ALA 25 -10.188 -14.790 6.512 9 HB2 ALA 25 HB2 ALA 25 -8.480 -15.016 6.092 10 HB3 ALA 25 HB3 ALA 25 -9.747 -15.790 5.121 11 H SER 26 H SER 26 -9.450 -18.199 4.935 12 HA SER 26 HA SER 26 -7.411 -20.117 5.489 13 HB2 SER 26 HB2 SER 26 -8.499 -19.271 2.777 14 HB3 SER 26 HB3 SER 26 -7.690 -20.801 3.176 15 HG SER 26 HG SER 26 -9.983 -20.991 3.145 16 H GLU 27 H GLU 27 -7.025 -16.870 4.465 17 HA GLU 27 HA GLU 27 -4.125 -17.236 4.196 18 HB2 GLU 27 HB2 GLU 27 -3.924 -15.875 2.197 19 HB3 GLU 27 HB3 GLU 27 -4.864 -17.325 1.864 20 HG2 GLU 27 HG2 GLU 27 -6.963 -15.996 1.934 21 HG3 GLU 27 HG3 GLU 27 -6.040 -14.548 2.348 22 H GLU 28 H GLU 28 -2.993 -15.083 4.254 23 HA GLU 28 HA GLU 28 -4.431 -13.164 6.062 24 HB2 GLU 28 HB2 GLU 28 -1.593 -14.242 6.247 25 HB3 GLU 28 HB3 GLU 28 -2.265 -12.963 7.267 26 HG2 GLU 28 HG2 GLU 28 -4.022 -14.527 8.079 27 HG3 GLU 28 HG3 GLU 28 -3.294 -15.827 7.134 28 H ASN 29 H ASN 29 -3.692 -13.145 3.055 29 HA ASN 29 HA ASN 29 -1.948 -10.865 2.645 30 HB2 ASN 29 HB2 ASN 29 -4.111 -12.127 0.903 31 HB3 ASN 29 HB3 ASN 29 -2.967 -10.907 0.351 32 HD21 ASN 29 HD21 ASN 29 -3.317 -13.527 -0.797 33 HD22 ASN 29 HD22 ASN 29 -1.748 -14.313 -0.639 34 H ILE 30 H ILE 30 -2.534 -8.745 2.120 35 HA ILE 30 HA ILE 30 -5.206 -7.795 3.102 36 HB ILE 30 HB ILE 30 -2.442 -6.582 3.255 37 HG12 ILE 30 HG12 ILE 30 -4.556 -6.908 5.427 38 HG13 ILE 30 HG13 ILE 30 -3.419 -8.199 5.047 39 HG21 ILE 30 HG21 ILE 30 -3.523 -4.531 4.216 40 HG22 ILE 30 HG22 ILE 30 -3.886 -4.744 2.512 41 HG23 ILE 30 HG23 ILE 30 -5.105 -5.162 3.744 42 HD11 ILE 30 HD11 ILE 30 -2.696 -6.929 6.992 43 HD12 ILE 30 HD12 ILE 30 -1.526 -6.786 5.675 44 HD13 ILE 30 HD13 ILE 30 -2.632 -5.435 6.049 45 H HIS 31 H HIS 31 -6.394 -6.442 1.942 46 HA HIS 31 HA HIS 31 -5.649 -5.800 -0.875 47 HB2 HIS 31 HB2 HIS 31 -8.087 -7.371 0.068 48 HB3 HIS 31 HB3 HIS 31 -7.931 -6.672 -1.533 49 HD1 HIS 31 HD1 HIS 31 -6.878 -8.164 -3.342 50 HD2 HIS 31 HD2 HIS 31 -6.362 -9.500 0.626 51 HE1 HIS 31 HE1 HIS 31 -5.934 -10.553 -3.498 52 HE2 HIS 31 HE2 HIS 31 -5.658 -11.373 -1.076 53 H PHE 32 H PHE 32 -5.457 -3.674 0.443 54 HA PHE 32 HA PHE 32 -7.830 -2.119 0.984 55 HB2 PHE 32 HB2 PHE 32 -5.067 -1.319 0.003 56 HB3 PHE 32 HB3 PHE 32 -6.317 -0.169 0.460 57 HD1 PHE 32 HD1 PHE 32 -3.477 -1.912 1.639 58 HD2 PHE 32 HD2 PHE 32 -7.381 -0.546 2.864 59 HE1 PHE 32 HE1 PHE 32 -2.781 -2.040 4.016 60 HE2 PHE 32 HE2 PHE 32 -6.682 -0.675 5.243 61 HZ PHE 32 HZ PHE 32 -4.393 -1.434 5.822 62 H SER 33 H SER 33 -9.060 -0.768 -0.325 63 HA SER 33 HA SER 33 -9.286 -1.462 -3.146 64 HB2 SER 33 HB2 SER 33 -11.190 -0.777 -1.682 65 HB3 SER 33 HB3 SER 33 -10.516 0.860 -1.614 66 HG SER 33 HG SER 33 -11.519 -0.559 -3.880 67 H SER 34 H SER 34 -8.043 1.376 -1.383 68 HA SER 34 HA SER 34 -6.250 2.199 -3.575 69 HB2 SER 34 HB2 SER 34 -8.490 3.989 -2.508 70 HB3 SER 34 HB3 SER 34 -7.130 4.553 -3.491 71 HG SER 34 HG SER 34 -8.987 4.169 -4.760 72 H CYS 35 H CYS 35 -4.649 3.774 -2.823 73 HA CYS 35 HA CYS 35 -3.835 3.703 -0.132 74 HB2 CYS 35 HB2 CYS 35 -3.235 5.520 -2.449 75 HB3 CYS 35 HB3 CYS 35 -2.710 6.008 -0.845 76 H LYS 36 H LYS 36 -6.353 5.765 -1.467 77 HA LYS 36 HA LYS 36 -6.463 7.738 0.583 78 HB2 LYS 36 HB2 LYS 36 -7.661 7.512 -1.718 79 HB3 LYS 36 HB3 LYS 36 -8.916 6.649 -0.847 80 HG2 LYS 36 HG2 LYS 36 -7.899 9.409 -0.007 81 HG3 LYS 36 HG3 LYS 36 -9.073 9.229 -1.296 82 HD2 LYS 36 HD2 LYS 36 -9.543 8.323 1.574 83 HD3 LYS 36 HD3 LYS 36 -10.098 9.833 0.848 84 HE2 LYS 36 HE2 LYS 36 -11.315 8.473 -0.907 85 HE3 LYS 36 HE3 LYS 36 -10.903 7.014 0.004 86 HZ1 LYS 36 HZ1 LYS 36 -13.103 7.835 0.608 87 HZ2 LYS 36 HZ2 LYS 36 -12.511 9.291 1.040 88 HZ3 LYS 36 HZ3 LYS 36 -12.121 7.961 1.908 89 H GLU 37 H GLU 37 -7.769 4.450 0.529 90 HA GLU 37 HA GLU 37 -9.039 4.610 3.169 91 HB2 GLU 37 HB2 GLU 37 -9.822 3.108 1.384 92 HB3 GLU 37 HB3 GLU 37 -8.267 2.268 1.381 93 HG2 GLU 37 HG2 GLU 37 -8.666 1.441 3.654 94 HG3 GLU 37 HG3 GLU 37 -10.147 2.400 3.766 95 H ALA 38 H ALA 38 -5.878 3.509 1.885 96 HA ALA 38 HA ALA 38 -4.865 2.390 4.305 97 HB1 ALA 38 HB1 ALA 38 -2.712 2.525 3.190 98 HB2 ALA 38 HB2 ALA 38 -3.933 2.098 1.984 99 HB3 ALA 38 HB3 ALA 38 -3.303 3.761 2.085 100 H TRP 39 H TRP 39 -4.451 5.745 2.990 101 HA TRP 39 HA TRP 39 -3.083 6.814 5.242 102 HB2 TRP 39 HB2 TRP 39 -4.831 8.058 3.103 103 HB3 TRP 39 HB3 TRP 39 -4.109 9.023 4.371 104 HD1 TRP 39 HD1 TRP 39 -1.207 8.004 4.518 105 HE1 TRP 39 HE1 TRP 39 0.461 8.477 2.614 106 HE3 TRP 39 HE3 TRP 39 -4.533 8.801 0.724 107 HZ2 TRP 39 HZ2 TRP 39 0.347 9.128 -0.191 108 HZ3 TRP 39 HZ3 TRP 39 -3.728 9.346 -1.570 109 HH2 TRP 39 HH2 TRP 39 -1.292 9.507 -2.034 110 H ALA 40 H ALA 40 -6.616 6.423 4.761 111 HA ALA 40 HA ALA 40 -7.404 7.867 7.102 112 HB1 ALA 40 HB1 ALA 40 -9.536 6.715 6.821 113 HB2 ALA 40 HB2 ALA 40 -8.920 7.242 5.243 114 HB3 ALA 40 HB3 ALA 40 -8.797 5.533 5.725 115 H ASN 41 H ASN 41 -5.897 4.750 6.809 116 HA ASN 41 HA ASN 41 -6.375 4.090 9.683 117 HB2 ASN 41 HB2 ASN 41 -5.392 2.458 7.297 118 HB3 ASN 41 HB3 ASN 41 -5.359 1.877 8.958 119 HD21 ASN 41 HD21 ASN 41 -7.534 2.755 6.272 120 HD22 ASN 41 HD22 ASN 41 -8.938 2.010 7.020 121 H GLY 42 H GLY 42 -4.254 6.005 8.090 122 HA2 GLY 42 HA2 GLY 42 -2.241 6.899 8.736 123 HA3 GLY 42 HA3 GLY 42 -2.169 5.778 10.097 124 H TYR 43 H TYR 43 -2.564 4.231 7.003 125 HA TYR 43 HA TYR 43 0.159 3.093 7.129 126 HB2 TYR 43 HB2 TYR 43 -2.251 2.605 5.365 127 HB3 TYR 43 HB3 TYR 43 -0.672 1.947 5.001 128 HD1 TYR 43 HD1 TYR 43 -2.158 2.118 8.486 129 HD2 TYR 43 HD2 TYR 43 -1.229 -0.331 5.048 130 HE1 TYR 43 HE1 TYR 43 -2.739 0.102 9.773 131 HE2 TYR 43 HE2 TYR 43 -1.871 -2.365 6.358 132 HH TYR 43 HH TYR 43 -2.938 -2.183 9.761 133 H SER 44 H SER 44 1.735 4.404 6.466 134 HA SER 44 HA SER 44 1.674 5.642 3.779 135 HB2 SER 44 HB2 SER 44 2.494 7.781 4.709 136 HB3 SER 44 HB3 SER 44 0.855 7.401 5.260 137 HG SER 44 HG SER 44 2.141 8.117 6.999 138 H ASP 45 H ASP 45 3.796 6.377 3.078 139 HA ASP 45 HA ASP 45 5.900 5.729 2.458 140 HB2 ASP 45 HB2 ASP 45 6.367 7.343 4.254 141 HB3 ASP 45 HB3 ASP 45 6.405 6.037 5.436 142 H ILE 46 H ILE 46 4.298 3.567 2.443 143 HA ILE 46 HA ILE 46 5.110 1.321 4.026 144 HB ILE 46 HB ILE 46 3.768 1.568 1.331 145 HG12 ILE 46 HG12 ILE 46 2.448 0.645 3.903 146 HG13 ILE 46 HG13 ILE 46 2.566 2.364 3.511 147 HG21 ILE 46 HG21 ILE 46 4.616 -0.588 1.169 148 HG22 ILE 46 HG22 ILE 46 4.472 -0.906 2.904 149 HG23 ILE 46 HG23 ILE 46 3.035 -0.912 1.888 150 HD11 ILE 46 HD11 ILE 46 1.307 2.102 1.474 151 HD12 ILE 46 HD12 ILE 46 1.287 0.342 1.611 152 HD13 ILE 46 HD13 ILE 46 0.401 1.334 2.793 153 H HIS 47 H HIS 47 6.777 -0.038 3.865 154 HA HIS 47 HA HIS 47 8.691 0.159 1.556 155 HB2 HIS 47 HB2 HIS 47 9.131 -0.646 4.463 156 HB3 HIS 47 HB3 HIS 47 10.361 -0.731 3.212 157 HD1 HIS 47 HD1 HIS 47 10.926 1.042 5.701 158 HD2 HIS 47 HD2 HIS 47 9.138 2.387 2.121 159 HE1 HIS 47 HE1 HIS 47 11.298 3.591 5.608 160 HE2 HIS 47 HE2 HIS 47 10.131 4.405 3.456 161 H GLU 48 H GLU 48 9.990 -1.908 1.267 162 HA GLU 48 HA GLU 48 8.339 -3.950 0.278 163 HB2 GLU 48 HB2 GLU 48 10.708 -3.405 -0.332 164 HB3 GLU 48 HB3 GLU 48 11.261 -4.175 1.144 165 HG2 GLU 48 HG2 GLU 48 9.622 -5.591 -1.007 166 HG3 GLU 48 HG3 GLU 48 11.376 -5.504 -1.044 167 H GLY 49 H GLY 49 7.248 -5.568 1.143 168 HA2 GLY 49 HA2 GLY 49 6.986 -7.492 2.521 169 HA3 GLY 49 HA3 GLY 49 8.001 -6.765 3.764 170 H GLU 50 H GLU 50 6.403 -4.132 3.423 171 HA GLU 50 HA GLU 50 4.197 -4.788 5.271 172 HB2 GLU 50 HB2 GLU 50 5.612 -2.311 4.370 173 HB3 GLU 50 HB3 GLU 50 3.898 -2.136 4.716 174 HG2 GLU 50 HG2 GLU 50 5.317 -1.596 6.639 175 HG3 GLU 50 HG3 GLU 50 4.142 -2.857 6.953 176 HA PRO 51 HA PRO 51 1.072 -5.262 2.297 177 HB2 PRO 51 HB2 PRO 51 -1.184 -4.279 3.496 178 HB3 PRO 51 HB3 PRO 51 -0.328 -5.760 4.035 179 HG2 PRO 51 HG2 PRO 51 -0.037 -2.946 5.136 180 HG3 PRO 51 HG3 PRO 51 -0.335 -4.456 6.057 181 HD2 PRO 51 HD2 PRO 51 2.147 -3.434 5.783 182 HD3 PRO 51 HD3 PRO 51 1.884 -5.204 5.696 183 H GLY 52 H GLY 52 0.684 -4.284 0.448 184 HA2 GLY 52 HA2 GLY 52 -0.399 -2.626 -0.882 185 HA3 GLY 52 HA3 GLY 52 -0.037 -1.386 0.316 186 H TYR 53 H TYR 53 2.874 -2.887 0.180 187 HA TYR 53 HA TYR 53 4.278 -1.046 -1.395 188 HB2 TYR 53 HB2 TYR 53 5.337 -2.488 0.227 189 HB3 TYR 53 HB3 TYR 53 4.763 -3.931 -0.573 190 HD1 TYR 53 HD1 TYR 53 5.975 -4.978 -2.334 191 HD2 TYR 53 HD2 TYR 53 7.156 -1.086 -0.884 192 HE1 TYR 53 HE1 TYR 53 8.148 -5.192 -3.537 193 HE2 TYR 53 HE2 TYR 53 9.362 -1.344 -2.038 194 HH TYR 53 HH TYR 53 10.667 -2.648 -3.389 195 H SER 54 H SER 54 2.472 -3.838 -2.457 196 HA SER 54 HA SER 54 3.944 -4.344 -4.891 197 HB2 SER 54 HB2 SER 54 2.454 -5.934 -3.427 198 HB3 SER 54 HB3 SER 54 1.137 -5.312 -4.403 199 HG SER 54 HG SER 54 2.259 -7.236 -5.252 200 H ALA 55 H ALA 55 2.977 -4.409 -7.040 201 HA ALA 55 HA ALA 55 2.068 -1.893 -7.998 202 HB1 ALA 55 HB1 ALA 55 1.933 -4.637 -9.322 203 HB2 ALA 55 HB2 ALA 55 1.882 -3.062 -10.145 204 HB3 ALA 55 HB3 ALA 55 3.355 -3.573 -9.302 205 H LYS 56 H LYS 56 0.209 -4.572 -6.752 206 HA LYS 56 HA LYS 56 -2.378 -4.002 -7.798 207 HB2 LYS 56 HB2 LYS 56 -3.220 -5.380 -6.049 208 HB3 LYS 56 HB3 LYS 56 -1.665 -6.056 -6.542 209 HG2 LYS 56 HG2 LYS 56 -0.783 -4.506 -4.522 210 HG3 LYS 56 HG3 LYS 56 -2.447 -4.635 -3.995 211 HD2 LYS 56 HD2 LYS 56 -0.646 -7.019 -4.604 212 HD3 LYS 56 HD3 LYS 56 -0.841 -6.333 -2.996 213 HE2 LYS 56 HE2 LYS 56 -3.144 -7.458 -4.651 214 HE3 LYS 56 HE3 LYS 56 -2.201 -8.408 -3.499 215 HZ1 LYS 56 HZ1 LYS 56 -4.185 -7.559 -2.440 216 HZ2 LYS 56 HZ2 LYS 56 -3.800 -6.006 -2.791 217 HZ3 LYS 56 HZ3 LYS 56 -2.904 -6.876 -1.727 218 H LEU 57 H LEU 57 -0.554 -2.178 -5.466 219 HA LEU 57 HA LEU 57 -2.937 -0.459 -4.863 220 HB2 LEU 57 HB2 LEU 57 -0.720 -1.588 -3.216 221 HB3 LEU 57 HB3 LEU 57 -0.914 0.135 -3.018 222 HG LEU 57 HG LEU 57 -2.075 -0.898 -1.286 223 HD11 LEU 57 HD11 LEU 57 -4.306 -0.150 -3.207 224 HD12 LEU 57 HD12 LEU 57 -3.186 1.057 -2.516 225 HD13 LEU 57 HD13 LEU 57 -4.218 0.097 -1.453 226 HD21 LEU 57 HD21 LEU 57 -2.330 -3.126 -2.258 227 HD22 LEU 57 HD22 LEU 57 -3.611 -2.519 -3.342 228 HD23 LEU 57 HD23 LEU 57 -3.867 -2.538 -1.587 229 H ASP 58 H ASP 58 0.620 -0.430 -5.329 230 HA ASP 58 HA ASP 58 0.589 2.466 -5.750 231 HB2 ASP 58 HB2 ASP 58 2.307 1.196 -4.424 232 HB3 ASP 58 HB3 ASP 58 2.924 0.518 -5.926 233 H ARG 59 H ARG 59 -0.453 2.910 -7.665 234 HA ARG 59 HA ARG 59 -0.423 1.486 -10.070 235 HB2 ARG 59 HB2 ARG 59 -0.496 4.526 -10.015 236 HB3 ARG 59 HB3 ARG 59 -1.287 3.446 -11.146 237 HG2 ARG 59 HG2 ARG 59 -1.984 3.949 -8.240 238 HG3 ARG 59 HG3 ARG 59 -2.892 4.466 -9.650 239 HD2 ARG 59 HD2 ARG 59 -2.554 1.616 -8.626 240 HD3 ARG 59 HD3 ARG 59 -4.030 2.568 -8.616 241 HE ARG 59 HE ARG 59 -2.950 1.003 -10.803 242 HH11 ARG 59 HH11 ARG 59 -5.011 3.788 -10.240 243 HH12 ARG 59 HH12 ARG 59 -5.770 3.642 -11.802 244 HH21 ARG 59 HH21 ARG 59 -3.958 0.885 -12.762 245 HH22 ARG 59 HH22 ARG 59 -5.193 2.034 -13.180 246 H ASP 60 H ASP 60 1.718 4.094 -9.161 247 HA ASP 60 HA ASP 60 3.384 3.983 -11.534 248 HB2 ASP 60 HB2 ASP 60 4.815 5.574 -10.343 249 HB3 ASP 60 HB3 ASP 60 3.120 6.037 -10.299 250 H HIS 61 H HIS 61 3.306 1.894 -8.886 251 HA HIS 61 HA HIS 61 4.823 0.733 -7.655 252 HB2 HIS 61 HB2 HIS 61 3.789 -0.639 -9.458 253 HB3 HIS 61 HB3 HIS 61 5.258 -0.443 -10.406 254 HD1 HIS 61 HD1 HIS 61 4.894 -1.415 -6.608 255 HD2 HIS 61 HD2 HIS 61 6.474 -2.726 -10.304 256 HE1 HIS 61 HE1 HIS 61 6.212 -3.567 -6.113 257 HE2 HIS 61 HE2 HIS 61 7.151 -4.375 -8.374 258 H ASP 62 H ASP 62 6.129 2.935 -7.628 259 HA ASP 62 HA ASP 62 8.912 2.616 -8.526 260 HB2 ASP 62 HB2 ASP 62 9.295 4.788 -7.595 261 HB3 ASP 62 HB3 ASP 62 7.832 4.802 -8.565 262 H GLY 63 H GLY 63 7.385 1.038 -6.125 263 HA2 GLY 63 HA2 GLY 63 8.336 -0.315 -4.477 264 HA3 GLY 63 HA3 GLY 63 9.858 0.572 -4.588 265 H VAL 64 H VAL 64 7.177 2.687 -4.233 266 HA VAL 64 HA VAL 64 7.107 2.506 -1.255 267 HB VAL 64 HB VAL 64 7.187 5.209 -2.650 268 HG11 VAL 64 HG11 VAL 64 6.143 5.091 -0.396 269 HG12 VAL 64 HG12 VAL 64 7.612 4.325 0.243 270 HG13 VAL 64 HG13 VAL 64 7.663 5.995 -0.355 271 HG21 VAL 64 HG21 VAL 64 9.530 3.767 -1.371 272 HG22 VAL 64 HG22 VAL 64 9.377 4.263 -3.077 273 HG23 VAL 64 HG23 VAL 64 9.489 5.493 -1.815 274 H ALA 65 H ALA 65 5.054 2.423 -0.575 275 HA ALA 65 HA ALA 65 2.929 3.389 -2.438 276 HB1 ALA 65 HB1 ALA 65 2.825 1.009 -2.294 277 HB2 ALA 65 HB2 ALA 65 2.924 1.010 -0.541 278 HB3 ALA 65 HB3 ALA 65 1.474 1.652 -1.342 279 H CYS 66 H CYS 66 1.283 4.545 -1.731 280 HA CYS 66 HA CYS 66 0.444 6.366 -0.741 281 HB2 CYS 66 HB2 CYS 66 0.510 4.870 1.860 282 HB3 CYS 66 HB3 CYS 66 -0.715 5.961 1.235 283 H GLU 67 H GLU 67 3.031 6.716 -1.178 284 HA GLU 67 HA GLU 67 4.763 7.500 0.879 285 HB2 GLU 67 HB2 GLU 67 5.798 8.993 -0.869 286 HB3 GLU 67 HB3 GLU 67 5.723 7.287 -1.229 287 HG2 GLU 67 HG2 GLU 67 3.511 9.019 -2.329 288 HG3 GLU 67 HG3 GLU 67 5.111 9.142 -3.040 289 H LEU 68 H LEU 68 5.261 9.344 1.980 290 HA LEU 68 HA LEU 68 3.334 11.619 1.889 291 HB2 LEU 68 HB2 LEU 68 2.644 9.619 3.411 292 HB3 LEU 68 HB3 LEU 68 3.997 10.095 4.432 293 HG LEU 68 HG LEU 68 2.870 12.408 4.572 294 HD11 LEU 68 HD11 LEU 68 0.488 10.857 3.491 295 HD12 LEU 68 HD12 LEU 68 1.325 12.167 2.637 296 HD13 LEU 68 HD13 LEU 68 0.463 12.505 4.144 297 HD21 LEU 68 HD21 LEU 68 1.308 11.698 6.303 298 HD22 LEU 68 HD22 LEU 68 2.799 10.748 6.399 299 HD23 LEU 68 HD23 LEU 68 1.333 10.034 5.680 300 H LYS 69 H LYS 69 6.558 10.488 2.688 301 HA LYS 69 HA LYS 69 7.529 12.955 3.802 302 HB2 LYS 69 HB2 LYS 69 8.679 10.678 3.899 303 HB3 LYS 69 HB3 LYS 69 8.988 10.819 2.167 304 HG2 LYS 69 HG2 LYS 69 10.989 11.522 3.209 305 HG3 LYS 69 HG3 LYS 69 10.205 13.014 2.685 306 HD2 LYS 69 HD2 LYS 69 9.181 12.970 5.161 307 HD3 LYS 69 HD3 LYS 69 10.525 11.860 5.469 308 HE2 LYS 69 HE2 LYS 69 12.089 13.618 4.486 309 HE3 LYS 69 HE3 LYS 69 10.703 14.714 4.373 310 HZ1 LYS 69 HZ1 LYS 69 11.943 15.101 6.412 311 HZ2 LYS 69 HZ2 LYS 69 11.776 13.553 6.894 312 HZ3 LYS 69 HZ3 LYS 69 10.467 14.532 6.809 313 H ASN 70 H ASN 70 7.778 14.816 2.844 314 HA ASN 70 HA ASN 70 8.247 15.087 -0.099 315 HB2 ASN 70 HB2 ASN 70 6.243 16.604 1.633 316 HB3 ASN 70 HB3 ASN 70 6.732 17.123 0.028 317 HD21 ASN 70 HD21 ASN 70 4.155 15.865 1.422 318 HD22 ASN 70 HD22 ASN 70 3.613 14.799 0.134 Start of MODEL 20 1 H1 GLY 24 H1 GLY 24 -5.790 -25.607 -2.239 2 H2 GLY 24 H2 GLY 24 -5.691 -26.894 -3.245 3 H3 GLY 24 H3 GLY 24 -4.523 -26.641 -2.126 4 HA2 GLY 24 HA2 GLY 24 -3.746 -26.021 -4.327 5 HA3 GLY 24 HA3 GLY 24 -5.086 -24.868 -4.424 6 H ALA 25 H ALA 25 -5.129 -23.101 -2.802 7 HA ALA 25 HA ALA 25 -2.640 -22.567 -1.294 8 HB1 ALA 25 HB1 ALA 25 -3.850 -20.672 -3.363 9 HB2 ALA 25 HB2 ALA 25 -2.526 -20.276 -2.249 10 HB3 ALA 25 HB3 ALA 25 -2.290 -21.509 -3.502 11 H SER 26 H SER 26 -2.995 -21.459 0.576 12 HA SER 26 HA SER 26 -5.599 -20.134 1.136 13 HB2 SER 26 HB2 SER 26 -4.420 -22.415 2.765 14 HB3 SER 26 HB3 SER 26 -5.596 -21.256 3.408 15 HG SER 26 HG SER 26 -6.700 -23.046 2.631 16 H GLU 27 H GLU 27 -5.168 -18.204 1.840 17 HA GLU 27 HA GLU 27 -3.293 -17.572 3.950 18 HB2 GLU 27 HB2 GLU 27 -1.970 -15.941 2.609 19 HB3 GLU 27 HB3 GLU 27 -1.649 -17.614 2.195 20 HG2 GLU 27 HG2 GLU 27 -3.092 -17.414 0.179 21 HG3 GLU 27 HG3 GLU 27 -3.421 -15.727 0.584 22 H GLU 28 H GLU 28 -3.320 -15.145 4.356 23 HA GLU 28 HA GLU 28 -5.867 -13.831 3.564 24 HB2 GLU 28 HB2 GLU 28 -6.309 -13.239 5.931 25 HB3 GLU 28 HB3 GLU 28 -6.546 -14.927 5.510 26 HG2 GLU 28 HG2 GLU 28 -4.456 -15.573 6.602 27 HG3 GLU 28 HG3 GLU 28 -4.065 -13.888 6.946 28 H ASN 29 H ASN 29 -3.982 -12.963 2.247 29 HA ASN 29 HA ASN 29 -2.295 -10.932 3.348 30 HB2 ASN 29 HB2 ASN 29 -1.867 -10.303 1.088 31 HB3 ASN 29 HB3 ASN 29 -1.933 -12.052 1.151 32 HD21 ASN 29 HD21 ASN 29 -2.067 -10.944 -1.288 33 HD22 ASN 29 HD22 ASN 29 -3.711 -11.013 -1.908 34 H ILE 30 H ILE 30 -2.440 -8.621 2.765 35 HA ILE 30 HA ILE 30 -5.132 -7.514 3.415 36 HB ILE 30 HB ILE 30 -2.349 -6.350 3.503 37 HG12 ILE 30 HG12 ILE 30 -4.442 -6.702 5.695 38 HG13 ILE 30 HG13 ILE 30 -3.211 -7.911 5.357 39 HG21 ILE 30 HG21 ILE 30 -3.785 -4.539 2.727 40 HG22 ILE 30 HG22 ILE 30 -5.019 -4.939 3.939 41 HG23 ILE 30 HG23 ILE 30 -3.464 -4.270 4.422 42 HD11 ILE 30 HD11 ILE 30 -2.584 -5.076 6.265 43 HD12 ILE 30 HD12 ILE 30 -2.606 -6.524 7.277 44 HD13 ILE 30 HD13 ILE 30 -1.423 -6.396 5.975 45 H HIS 31 H HIS 31 -6.322 -6.479 2.030 46 HA HIS 31 HA HIS 31 -5.283 -5.699 -0.658 47 HB2 HIS 31 HB2 HIS 31 -7.402 -6.511 -1.629 48 HB3 HIS 31 HB3 HIS 31 -6.426 -7.795 -0.939 49 HD1 HIS 31 HD1 HIS 31 -9.776 -6.024 -0.400 50 HD2 HIS 31 HD2 HIS 31 -7.379 -9.064 1.284 51 HE1 HIS 31 HE1 HIS 31 -11.270 -7.269 1.287 52 HE2 HIS 31 HE2 HIS 31 -9.799 -9.118 2.315 53 H PHE 32 H PHE 32 -5.234 -3.546 -0.539 54 HA PHE 32 HA PHE 32 -7.538 -2.040 0.633 55 HB2 PHE 32 HB2 PHE 32 -4.751 -1.225 -0.183 56 HB3 PHE 32 HB3 PHE 32 -6.003 -0.058 0.182 57 HD1 PHE 32 HD1 PHE 32 -7.229 -0.434 2.526 58 HD2 PHE 32 HD2 PHE 32 -3.260 -1.807 1.528 59 HE1 PHE 32 HE1 PHE 32 -6.642 -0.494 4.938 60 HE2 PHE 32 HE2 PHE 32 -2.676 -1.856 3.935 61 HZ PHE 32 HZ PHE 32 -4.368 -1.205 5.646 62 H SER 33 H SER 33 -9.005 -1.121 -0.629 63 HA SER 33 HA SER 33 -9.044 -1.433 -3.488 64 HB2 SER 33 HB2 SER 33 -11.013 -1.287 -1.918 65 HB3 SER 33 HB3 SER 33 -10.716 0.456 -1.791 66 HG SER 33 HG SER 33 -12.280 -0.154 -3.416 67 H SER 34 H SER 34 -7.971 1.207 -1.383 68 HA SER 34 HA SER 34 -6.424 2.395 -3.532 69 HB2 SER 34 HB2 SER 34 -7.376 4.648 -3.380 70 HB3 SER 34 HB3 SER 34 -8.604 3.507 -3.934 71 HG SER 34 HG SER 34 -9.528 3.519 -1.904 72 H CYS 35 H CYS 35 -4.801 3.857 -2.756 73 HA CYS 35 HA CYS 35 -3.887 3.695 -0.089 74 HB2 CYS 35 HB2 CYS 35 -3.354 5.558 -2.386 75 HB3 CYS 35 HB3 CYS 35 -2.798 6.028 -0.787 76 H LYS 36 H LYS 36 -6.429 5.794 -1.333 77 HA LYS 36 HA LYS 36 -6.462 7.795 0.686 78 HB2 LYS 36 HB2 LYS 36 -7.780 7.593 -1.543 79 HB3 LYS 36 HB3 LYS 36 -8.942 6.637 -0.618 80 HG2 LYS 36 HG2 LYS 36 -9.124 8.631 0.988 81 HG3 LYS 36 HG3 LYS 36 -8.055 9.511 -0.109 82 HD2 LYS 36 HD2 LYS 36 -10.197 10.209 -0.798 83 HD3 LYS 36 HD3 LYS 36 -9.764 8.972 -1.969 84 HE2 LYS 36 HE2 LYS 36 -11.952 8.380 -1.451 85 HE3 LYS 36 HE3 LYS 36 -11.031 7.312 -0.393 86 HZ1 LYS 36 HZ1 LYS 36 -12.313 9.878 0.400 87 HZ2 LYS 36 HZ2 LYS 36 -11.411 8.965 1.412 88 HZ3 LYS 36 HZ3 LYS 36 -12.821 8.390 0.826 89 H GLU 37 H GLU 37 -7.881 4.546 0.686 90 HA GLU 37 HA GLU 37 -9.131 4.799 3.300 91 HB2 GLU 37 HB2 GLU 37 -9.740 3.199 1.377 92 HB3 GLU 37 HB3 GLU 37 -8.324 2.260 1.823 93 HG2 GLU 37 HG2 GLU 37 -10.311 1.283 2.807 94 HG3 GLU 37 HG3 GLU 37 -9.255 1.883 4.079 95 H ALA 38 H ALA 38 -5.996 3.550 2.132 96 HA ALA 38 HA ALA 38 -5.062 2.508 4.624 97 HB1 ALA 38 HB1 ALA 38 -4.105 2.730 1.940 98 HB2 ALA 38 HB2 ALA 38 -2.881 3.473 2.985 99 HB3 ALA 38 HB3 ALA 38 -3.422 1.810 3.281 100 H TRP 39 H TRP 39 -4.523 5.763 3.125 101 HA TRP 39 HA TRP 39 -3.060 6.896 5.258 102 HB2 TRP 39 HB2 TRP 39 -4.928 8.104 3.194 103 HB3 TRP 39 HB3 TRP 39 -4.081 9.089 4.374 104 HD1 TRP 39 HD1 TRP 39 -1.249 7.751 4.342 105 HE1 TRP 39 HE1 TRP 39 0.320 8.133 2.367 106 HE3 TRP 39 HE3 TRP 39 -4.709 8.998 0.768 107 HZ2 TRP 39 HZ2 TRP 39 0.140 8.995 -0.341 108 HZ3 TRP 39 HZ3 TRP 39 -3.970 9.529 -1.548 109 HH2 TRP 39 HH2 TRP 39 -1.551 9.538 -2.119 110 H ALA 40 H ALA 40 -6.611 6.582 4.990 111 HA ALA 40 HA ALA 40 -7.243 8.176 7.263 112 HB1 ALA 40 HB1 ALA 40 -8.750 7.133 5.368 113 HB2 ALA 40 HB2 ALA 40 -8.874 5.760 6.485 114 HB3 ALA 40 HB3 ALA 40 -9.404 7.373 6.992 115 H ASN 41 H ASN 41 -5.949 4.943 7.052 116 HA ASN 41 HA ASN 41 -6.333 4.362 9.948 117 HB2 ASN 41 HB2 ASN 41 -5.405 2.705 7.553 118 HB3 ASN 41 HB3 ASN 41 -5.341 2.133 9.211 119 HD21 ASN 41 HD21 ASN 41 -7.573 2.966 6.554 120 HD22 ASN 41 HD22 ASN 41 -8.947 2.205 7.334 121 H GLY 42 H GLY 42 -4.137 6.121 8.191 122 HA2 GLY 42 HA2 GLY 42 -2.127 7.028 8.906 123 HA3 GLY 42 HA3 GLY 42 -2.008 5.828 10.193 124 H TYR 43 H TYR 43 -2.575 4.393 7.095 125 HA TYR 43 HA TYR 43 0.125 3.240 7.048 126 HB2 TYR 43 HB2 TYR 43 -2.356 2.798 5.386 127 HB3 TYR 43 HB3 TYR 43 -0.800 2.152 4.934 128 HD1 TYR 43 HD1 TYR 43 -2.092 2.273 8.501 129 HD2 TYR 43 HD2 TYR 43 -1.323 -0.120 4.986 130 HE1 TYR 43 HE1 TYR 43 -2.474 0.229 9.818 131 HE2 TYR 43 HE2 TYR 43 -1.780 -2.176 6.321 132 HH TYR 43 HH TYR 43 -2.532 -2.066 9.813 133 H SER 44 H SER 44 1.481 4.905 6.667 134 HA SER 44 HA SER 44 1.524 6.070 3.913 135 HB2 SER 44 HB2 SER 44 2.641 7.499 6.340 136 HB3 SER 44 HB3 SER 44 2.324 8.131 4.720 137 HG SER 44 HG SER 44 0.514 7.541 6.814 138 H ASP 45 H ASP 45 3.693 6.556 3.141 139 HA ASP 45 HA ASP 45 5.846 5.961 2.649 140 HB2 ASP 45 HB2 ASP 45 6.197 6.062 5.670 141 HB3 ASP 45 HB3 ASP 45 7.476 6.182 4.471 142 H ILE 46 H ILE 46 4.148 3.723 2.633 143 HA ILE 46 HA ILE 46 5.024 1.434 4.072 144 HB ILE 46 HB ILE 46 3.815 1.669 1.318 145 HG12 ILE 46 HG12 ILE 46 2.396 1.072 3.943 146 HG13 ILE 46 HG13 ILE 46 2.408 2.659 3.191 147 HG21 ILE 46 HG21 ILE 46 3.604 -0.559 1.119 148 HG22 ILE 46 HG22 ILE 46 4.868 -0.706 2.318 149 HG23 ILE 46 HG23 ILE 46 3.185 -0.809 2.810 150 HD11 ILE 46 HD11 ILE 46 0.965 2.071 1.509 151 HD12 ILE 46 HD12 ILE 46 1.424 0.369 1.489 152 HD13 ILE 46 HD13 ILE 46 0.390 0.990 2.790 153 H HIS 47 H HIS 47 6.789 0.221 3.944 154 HA HIS 47 HA HIS 47 8.671 0.422 1.617 155 HB2 HIS 47 HB2 HIS 47 9.098 -0.280 4.552 156 HB3 HIS 47 HB3 HIS 47 10.332 -0.502 3.327 157 HD1 HIS 47 HD1 HIS 47 10.680 1.494 5.810 158 HD2 HIS 47 HD2 HIS 47 9.653 2.450 1.827 159 HE1 HIS 47 HE1 HIS 47 11.464 3.917 5.415 160 HE2 HIS 47 HE2 HIS 47 10.824 4.490 2.986 161 H GLU 48 H GLU 48 10.022 -1.637 1.383 162 HA GLU 48 HA GLU 48 8.433 -3.768 0.466 163 HB2 GLU 48 HB2 GLU 48 10.584 -5.090 0.515 164 HB3 GLU 48 HB3 GLU 48 10.629 -3.566 -0.371 165 HG2 GLU 48 HG2 GLU 48 11.813 -2.448 1.418 166 HG3 GLU 48 HG3 GLU 48 11.644 -3.849 2.479 167 H GLY 49 H GLY 49 7.566 -5.554 1.239 168 HA2 GLY 49 HA2 GLY 49 7.147 -7.323 2.725 169 HA3 GLY 49 HA3 GLY 49 8.109 -6.537 3.973 170 H GLU 50 H GLU 50 6.415 -3.926 3.372 171 HA GLU 50 HA GLU 50 4.244 -4.582 5.265 172 HB2 GLU 50 HB2 GLU 50 5.396 -2.021 4.158 173 HB3 GLU 50 HB3 GLU 50 3.739 -2.026 4.709 174 HG2 GLU 50 HG2 GLU 50 4.988 -1.311 6.538 175 HG3 GLU 50 HG3 GLU 50 4.476 -2.946 6.907 176 HA PRO 51 HA PRO 51 1.008 -5.211 2.398 177 HB2 PRO 51 HB2 PRO 51 -1.177 -4.056 3.577 178 HB3 PRO 51 HB3 PRO 51 -0.367 -5.537 4.187 179 HG2 PRO 51 HG2 PRO 51 0.089 -2.678 5.104 180 HG3 PRO 51 HG3 PRO 51 -0.290 -4.105 6.126 181 HD2 PRO 51 HD2 PRO 51 2.238 -3.299 5.790 182 HD3 PRO 51 HD3 PRO 51 1.859 -5.045 5.735 183 H GLY 52 H GLY 52 0.686 -4.327 0.495 184 HA2 GLY 52 HA2 GLY 52 -0.302 -2.740 -0.957 185 HA3 GLY 52 HA3 GLY 52 -0.008 -1.442 0.204 186 H TYR 53 H TYR 53 2.923 -2.959 0.248 187 HA TYR 53 HA TYR 53 4.328 -1.157 -1.413 188 HB2 TYR 53 HB2 TYR 53 5.402 -2.384 0.340 189 HB3 TYR 53 HB3 TYR 53 4.895 -3.931 -0.317 190 HD1 TYR 53 HD1 TYR 53 7.203 -1.064 -0.833 191 HD2 TYR 53 HD2 TYR 53 6.113 -5.062 -2.041 192 HE1 TYR 53 HE1 TYR 53 9.402 -1.327 -2.016 193 HE2 TYR 53 HE2 TYR 53 8.283 -5.300 -3.244 194 HH TYR 53 HH TYR 53 10.721 -2.676 -3.320 195 H SER 54 H SER 54 2.609 -4.073 -2.261 196 HA SER 54 HA SER 54 3.968 -4.683 -4.731 197 HB2 SER 54 HB2 SER 54 2.162 -5.987 -3.088 198 HB3 SER 54 HB3 SER 54 1.146 -5.585 -4.471 199 HG SER 54 HG SER 54 2.504 -6.774 -5.788 200 H ALA 55 H ALA 55 3.225 -4.441 -6.864 201 HA ALA 55 HA ALA 55 2.232 -1.973 -7.707 202 HB1 ALA 55 HB1 ALA 55 2.087 -3.024 -9.918 203 HB2 ALA 55 HB2 ALA 55 3.536 -3.595 -9.073 204 HB3 ALA 55 HB3 ALA 55 2.103 -4.640 -9.182 205 H LYS 56 H LYS 56 0.352 -4.652 -6.625 206 HA LYS 56 HA LYS 56 -2.241 -4.174 -7.679 207 HB2 LYS 56 HB2 LYS 56 -1.434 -5.164 -4.908 208 HB3 LYS 56 HB3 LYS 56 -2.999 -5.418 -5.664 209 HG2 LYS 56 HG2 LYS 56 -0.357 -6.524 -6.738 210 HG3 LYS 56 HG3 LYS 56 -1.439 -7.407 -5.693 211 HD2 LYS 56 HD2 LYS 56 -2.273 -6.318 -8.421 212 HD3 LYS 56 HD3 LYS 56 -1.586 -7.917 -8.192 213 HE2 LYS 56 HE2 LYS 56 -4.147 -6.937 -6.847 214 HE3 LYS 56 HE3 LYS 56 -4.084 -7.880 -8.334 215 HZ1 LYS 56 HZ1 LYS 56 -2.951 -9.654 -7.079 216 HZ2 LYS 56 HZ2 LYS 56 -4.431 -9.346 -6.469 217 HZ3 LYS 56 HZ3 LYS 56 -3.105 -8.807 -5.690 218 H LEU 57 H LEU 57 -0.496 -2.373 -5.246 219 HA LEU 57 HA LEU 57 -2.895 -0.665 -4.647 220 HB2 LEU 57 HB2 LEU 57 -0.643 -1.762 -3.078 221 HB3 LEU 57 HB3 LEU 57 -0.740 -0.027 -2.914 222 HG LEU 57 HG LEU 57 -1.919 -1.105 -1.142 223 HD11 LEU 57 HD11 LEU 57 -2.814 1.044 -2.471 224 HD12 LEU 57 HD12 LEU 57 -3.646 0.386 -1.080 225 HD13 LEU 57 HD13 LEU 57 -4.221 -0.012 -2.717 226 HD21 LEU 57 HD21 LEU 57 -3.840 -2.288 -3.170 227 HD22 LEU 57 HD22 LEU 57 -3.724 -2.630 -1.434 228 HD23 LEU 57 HD23 LEU 57 -2.450 -3.179 -2.511 229 H ASP 58 H ASP 58 0.567 -0.594 -5.465 230 HA ASP 58 HA ASP 58 0.469 2.337 -5.892 231 HB2 ASP 58 HB2 ASP 58 2.147 1.318 -4.404 232 HB3 ASP 58 HB3 ASP 58 2.808 0.395 -5.754 233 H ARG 59 H ARG 59 -0.562 2.562 -7.844 234 HA ARG 59 HA ARG 59 -0.365 1.144 -10.202 235 HB2 ARG 59 HB2 ARG 59 -1.136 3.149 -11.346 236 HB3 ARG 59 HB3 ARG 59 -1.947 2.967 -9.795 237 HG2 ARG 59 HG2 ARG 59 -0.334 4.695 -8.828 238 HG3 ARG 59 HG3 ARG 59 0.314 4.907 -10.457 239 HD2 ARG 59 HD2 ARG 59 -1.179 6.672 -10.129 240 HD3 ARG 59 HD3 ARG 59 -1.967 5.547 -11.249 241 HE ARG 59 HE ARG 59 -2.726 5.014 -8.502 242 HH11 ARG 59 HH11 ARG 59 -3.402 7.286 -11.079 243 HH12 ARG 59 HH12 ARG 59 -4.959 7.712 -10.423 244 HH21 ARG 59 HH21 ARG 59 -4.722 5.608 -7.712 245 HH22 ARG 59 HH22 ARG 59 -5.677 6.786 -8.564 246 H ASP 60 H ASP 60 1.844 3.717 -9.252 247 HA ASP 60 HA ASP 60 3.522 3.501 -11.614 248 HB2 ASP 60 HB2 ASP 60 4.905 5.190 -10.439 249 HB3 ASP 60 HB3 ASP 60 3.216 5.635 -10.604 250 H HIS 61 H HIS 61 3.346 1.585 -8.868 251 HA HIS 61 HA HIS 61 4.756 0.287 -7.653 252 HB2 HIS 61 HB2 HIS 61 5.513 -1.616 -9.045 253 HB3 HIS 61 HB3 HIS 61 3.852 -1.112 -9.288 254 HD1 HIS 61 HD1 HIS 61 3.202 -0.062 -11.684 255 HD2 HIS 61 HD2 HIS 61 7.240 -1.187 -11.123 256 HE1 HIS 61 HE1 HIS 61 4.298 -0.030 -14.016 257 HE2 HIS 61 HE2 HIS 61 6.762 -0.704 -13.666 258 H ASP 62 H ASP 62 6.021 2.583 -7.586 259 HA ASP 62 HA ASP 62 8.830 2.328 -8.415 260 HB2 ASP 62 HB2 ASP 62 9.111 4.573 -7.717 261 HB3 ASP 62 HB3 ASP 62 7.607 4.465 -8.613 262 H GLY 63 H GLY 63 7.487 0.640 -6.153 263 HA2 GLY 63 HA2 GLY 63 8.314 -0.480 -4.323 264 HA3 GLY 63 HA3 GLY 63 9.810 0.457 -4.414 265 H VAL 64 H VAL 64 6.972 2.427 -4.294 266 HA VAL 64 HA VAL 64 6.921 2.543 -1.321 267 HB VAL 64 HB VAL 64 6.935 5.111 -2.936 268 HG11 VAL 64 HG11 VAL 64 7.433 4.459 0.002 269 HG12 VAL 64 HG12 VAL 64 7.434 6.081 -0.721 270 HG13 VAL 64 HG13 VAL 64 5.937 5.140 -0.665 271 HG21 VAL 64 HG21 VAL 64 9.138 4.172 -3.335 272 HG22 VAL 64 HG22 VAL 64 9.236 5.525 -2.209 273 HG23 VAL 64 HG23 VAL 64 9.343 3.856 -1.595 274 H ALA 65 H ALA 65 4.925 2.534 -0.606 275 HA ALA 65 HA ALA 65 2.721 3.345 -2.443 276 HB1 ALA 65 HB1 ALA 65 2.462 1.070 -2.233 277 HB2 ALA 65 HB2 ALA 65 3.044 0.990 -0.589 278 HB3 ALA 65 HB3 ALA 65 1.417 1.646 -0.926 279 H CYS 66 H CYS 66 1.163 4.605 -1.748 280 HA CYS 66 HA CYS 66 0.286 6.398 -0.744 281 HB2 CYS 66 HB2 CYS 66 0.496 4.851 1.827 282 HB3 CYS 66 HB3 CYS 66 -0.779 5.930 1.292 283 H GLU 67 H GLU 67 2.888 6.923 -1.235 284 HA GLU 67 HA GLU 67 4.395 7.971 0.950 285 HB2 GLU 67 HB2 GLU 67 5.697 9.104 -0.802 286 HB3 GLU 67 HB3 GLU 67 5.509 7.394 -1.063 287 HG2 GLU 67 HG2 GLU 67 3.601 9.217 -2.516 288 HG3 GLU 67 HG3 GLU 67 5.282 9.222 -2.998 289 H LEU 68 H LEU 68 4.804 10.032 1.723 290 HA LEU 68 HA LEU 68 2.850 12.219 1.049 291 HB2 LEU 68 HB2 LEU 68 3.971 11.216 3.657 292 HB3 LEU 68 HB3 LEU 68 3.752 12.944 3.478 293 HG LEU 68 HG LEU 68 1.381 12.718 3.044 294 HD11 LEU 68 HD11 LEU 68 1.114 10.611 1.966 295 HD12 LEU 68 HD12 LEU 68 0.290 10.479 3.519 296 HD13 LEU 68 HD13 LEU 68 1.894 9.742 3.303 297 HD21 LEU 68 HD21 LEU 68 2.263 11.141 5.490 298 HD22 LEU 68 HD22 LEU 68 0.704 11.961 5.273 299 HD23 LEU 68 HD23 LEU 68 2.192 12.915 5.369 300 H LYS 69 H LYS 69 6.316 11.558 1.673 301 HA LYS 69 HA LYS 69 7.193 14.296 1.639 302 HB2 LYS 69 HB2 LYS 69 8.580 11.635 1.146 303 HB3 LYS 69 HB3 LYS 69 9.431 13.167 0.934 304 HG2 LYS 69 HG2 LYS 69 8.984 13.824 3.241 305 HG3 LYS 69 HG3 LYS 69 8.083 12.320 3.531 306 HD2 LYS 69 HD2 LYS 69 10.052 10.974 3.108 307 HD3 LYS 69 HD3 LYS 69 10.996 12.374 2.600 308 HE2 LYS 69 HE2 LYS 69 9.821 12.081 5.400 309 HE3 LYS 69 HE3 LYS 69 11.420 11.476 4.961 310 HZ1 LYS 69 HZ1 LYS 69 11.566 13.695 5.915 311 HZ2 LYS 69 HZ2 LYS 69 10.600 14.325 4.764 312 HZ3 LYS 69 HZ3 LYS 69 12.072 13.736 4.368 313 H ASN 70 H ASN 70 6.894 11.957 -0.993 314 HA ASN 70 HA ASN 70 7.535 14.096 -2.984 315 HB2 ASN 70 HB2 ASN 70 9.214 12.173 -2.610 316 HB3 ASN 70 HB3 ASN 70 8.029 11.123 -3.374 317 HD21 ASN 70 HD21 ASN 70 10.228 10.988 -4.674 318 HD22 ASN 70 HD22 ASN 70 10.309 12.065 -6.062
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