Browse entries in the PDBbind-CN Database
HEADER 1VIK_COMPLEX COMPND 1VIK_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 99 PRO GLN ILE THR LEU TRP GLN ARG PRO LEU VAL THR ILE SEQRES 2 A 99 LYS ILE GLY GLY GLN LEU LYS GLU ALA LEU LEU ASP THR SEQRES 3 A 99 GLY ALA ASP ASP THR VAL LEU GLU GLU MET ASN LEU PRO SEQRES 4 A 99 GLY ARG TRP LYS PRO LYS MET ILE GLY GLY ILE GLY GLY SEQRES 5 A 99 PHE ILE LYS VAL ARG GLN TYR ASP GLN ILE LEU ILE GLU SEQRES 6 A 99 ILE CYS GLY HIS LYS ALA ILE GLY THR VAL LEU VAL GLY SEQRES 7 A 99 PRO THR PRO VAL ASN ILE ILE GLY ARG ASN LEU LEU THR SEQRES 8 A 99 GLN ILE GLY CYS THR LEU ASN PHE SEQRES 1 B 99 PRO GLN ILE THR LEU TRP GLN ARG PRO LEU VAL THR ILE SEQRES 2 B 99 LYS ILE GLY GLY GLN LEU LYS GLU ALA LEU LEU ASP THR SEQRES 3 B 99 GLY ALA ASP ASP THR VAL LEU GLU GLU MET ASN LEU PRO SEQRES 4 B 99 GLY ARG TRP LYS PRO LYS MET ILE GLY GLY ILE GLY GLY SEQRES 5 B 99 PHE ILE LYS VAL ARG GLN TYR ASP GLN ILE LEU ILE GLU SEQRES 6 B 99 ILE CYS GLY HIS LYS ALA ILE GLY THR VAL LEU VAL GLY SEQRES 7 B 99 PRO THR PRO VAL ASN ILE ILE GLY ARG ASN LEU LEU THR SEQRES 8 B 99 GLN ILE GLY CYS THR LEU ASN PHE HET BAY A 332 162 ATOM 1 N PRO A 1 28.855 39.999 5.521 1.00 23.12 N ATOM 2 CA PRO A 1 29.785 39.058 4.910 1.00 22.57 C ATOM 3 C PRO A 1 29.148 38.405 3.692 1.00 23.04 C ATOM 4 O PRO A 1 27.895 38.468 3.598 1.00 24.45 O ATOM 5 CB PRO A 1 29.930 37.986 6.009 1.00 21.97 C ATOM 6 CG PRO A 1 28.545 37.938 6.599 1.00 22.26 C ATOM 7 CD PRO A 1 28.033 39.363 6.591 1.00 22.30 C ATOM 8 HA PRO A 1 30.718 39.522 4.589 1.00 0.00 H ATOM 9 HD3 PRO A 1 26.972 39.399 6.346 1.00 0.00 H ATOM 10 HD2 PRO A 1 28.198 39.846 7.554 1.00 0.00 H ATOM 11 HG3 PRO A 1 28.581 37.555 7.619 1.00 0.00 H ATOM 12 HG2 PRO A 1 27.899 37.301 5.996 1.00 0.00 H ATOM 13 HB2 PRO A 1 30.212 37.022 5.585 1.00 0.00 H ATOM 14 HB3 PRO A 1 30.667 38.283 6.755 1.00 0.00 H ATOM 15 N GLN A 2 30.006 37.824 2.883 1.00 22.21 N ATOM 16 CA GLN A 2 29.616 37.057 1.689 1.00 21.13 C ATOM 17 C GLN A 2 29.792 35.583 2.074 1.00 20.37 C ATOM 18 O GLN A 2 30.961 35.174 2.301 1.00 22.28 O ATOM 19 CB GLN A 2 30.502 37.430 0.488 1.00 20.57 C ATOM 20 CG GLN A 2 30.295 36.496 -0.680 1.00 22.96 C ATOM 21 CD GLN A 2 30.770 36.887 -2.046 1.00 24.19 C ATOM 22 OE1 GLN A 2 31.910 36.563 -2.438 1.00 24.36 O ATOM 23 NE2 GLN A 2 29.911 37.553 -2.841 1.00 24.36 N ATOM 24 HA GLN A 2 28.590 37.269 1.387 1.00 0.00 H ATOM 25 HB2 GLN A 2 30.260 38.445 0.174 1.00 0.00 H ATOM 26 HB3 GLN A 2 31.547 37.385 0.794 1.00 0.00 H ATOM 27 HG2 GLN A 2 30.796 35.561 -0.428 1.00 0.00 H ATOM 28 HG3 GLN A 2 29.222 36.322 -0.758 1.00 0.00 H ATOM 29 HE22 GLN A 2 28.967 37.810 -2.487 1.00 0.00 H ATOM 30 HE21 GLN A 2 30.191 37.811 -3.809 1.00 0.00 H ATOM 31 H GLN A 2 31.019 37.911 3.099 1.00 0.00 H ATOM 32 N ILE A 3 28.752 34.808 2.199 1.00 17.49 N ATOM 33 CA ILE A 3 28.867 33.413 2.639 1.00 14.73 C ATOM 34 C ILE A 3 28.758 32.417 1.486 1.00 14.26 C ATOM 35 O ILE A 3 27.894 32.564 0.631 1.00 13.25 O ATOM 36 CB ILE A 3 27.734 33.041 3.619 1.00 13.49 C ATOM 37 CG1 ILE A 3 27.860 33.796 4.946 1.00 12.05 C ATOM 38 CG2 ILE A 3 27.664 31.555 3.825 1.00 13.16 C ATOM 39 CD1 ILE A 3 27.638 35.294 4.717 1.00 13.19 C ATOM 40 HA ILE A 3 29.850 33.349 3.106 1.00 0.00 H ATOM 41 HB ILE A 3 26.792 33.354 3.168 1.00 0.00 H ATOM 42 HG12 ILE A 3 27.113 33.423 5.647 1.00 0.00 H ATOM 43 HG13 ILE A 3 28.856 33.637 5.359 1.00 0.00 H ATOM 44 HD11 ILE A 3 28.386 35.668 4.018 1.00 0.00 H ATOM 45 HD12 ILE A 3 26.641 35.454 4.305 1.00 0.00 H ATOM 46 HD13 ILE A 3 27.729 35.823 5.666 1.00 0.00 H ATOM 47 HG21 ILE A 3 27.474 31.066 2.870 1.00 0.00 H ATOM 48 HG22 ILE A 3 28.610 31.201 4.234 1.00 0.00 H ATOM 49 HG23 ILE A 3 26.857 31.323 4.520 1.00 0.00 H ATOM 50 H ILE A 3 27.810 35.191 1.980 1.00 0.00 H ATOM 51 N THR A 4 29.624 31.421 1.581 1.00 13.32 N ATOM 52 CA THR A 4 29.668 30.298 0.622 1.00 12.41 C ATOM 53 C THR A 4 28.752 29.174 1.117 1.00 10.64 C ATOM 54 O THR A 4 28.319 29.179 2.296 1.00 10.77 O ATOM 55 CB THR A 4 31.095 29.835 0.401 1.00 12.45 C ATOM 56 OG1 THR A 4 31.741 29.801 1.697 1.00 15.67 O ATOM 57 CG2 THR A 4 31.828 30.891 -0.411 1.00 12.43 C ATOM 58 HA THR A 4 29.299 30.626 -0.350 1.00 0.00 H ATOM 59 HB THR A 4 31.108 28.867 -0.101 1.00 0.00 H ATOM 60 HG1 THR A 4 31.258 29.171 2.289 1.00 0.00 H ATOM 61 HG23 THR A 4 31.381 30.960 -1.403 1.00 0.00 H ATOM 62 HG21 THR A 4 31.749 31.854 0.093 1.00 0.00 H ATOM 63 HG22 THR A 4 32.878 30.613 -0.503 1.00 0.00 H ATOM 64 H THR A 4 30.305 31.429 2.367 1.00 0.00 H ATOM 65 N LEU A 5 28.329 28.328 0.209 1.00 8.24 N ATOM 66 CA LEU A 5 27.391 27.248 0.547 1.00 7.34 C ATOM 67 C LEU A 5 28.115 25.924 0.398 1.00 7.62 C ATOM 68 O LEU A 5 27.551 24.968 -0.076 1.00 8.57 O ATOM 69 CB LEU A 5 26.134 27.312 -0.277 1.00 5.14 C ATOM 70 CG LEU A 5 25.426 28.656 -0.455 1.00 6.39 C ATOM 71 CD1 LEU A 5 24.269 28.573 -1.449 1.00 2.36 C ATOM 72 CD2 LEU A 5 24.900 29.164 0.899 1.00 5.75 C ATOM 73 HA LEU A 5 27.061 27.361 1.580 1.00 0.00 H ATOM 74 HB2 LEU A 5 26.388 26.951 -1.274 1.00 0.00 H ATOM 75 HB3 LEU A 5 25.417 26.632 0.183 1.00 0.00 H ATOM 76 HG LEU A 5 26.162 29.353 -0.855 1.00 0.00 H ATOM 77 HD21 LEU A 5 24.195 28.440 1.308 1.00 0.00 H ATOM 78 HD22 LEU A 5 25.735 29.289 1.588 1.00 0.00 H ATOM 79 HD23 LEU A 5 24.399 30.121 0.757 1.00 0.00 H ATOM 80 HD11 LEU A 5 24.649 28.259 -2.421 1.00 0.00 H ATOM 81 HD12 LEU A 5 23.536 27.849 -1.092 1.00 0.00 H ATOM 82 HD13 LEU A 5 23.799 29.552 -1.540 1.00 0.00 H ATOM 83 H LEU A 5 28.664 28.423 -0.771 1.00 0.00 H ATOM 84 N TRP A 6 29.390 25.915 0.749 1.00 9.10 N ATOM 85 CA TRP A 6 30.189 24.688 0.708 1.00 9.52 C ATOM 86 C TRP A 6 29.795 23.921 1.986 1.00 9.47 C ATOM 87 O TRP A 6 29.790 22.698 2.047 1.00 9.08 O ATOM 88 CB TRP A 6 31.681 24.942 0.688 1.00 11.10 C ATOM 89 CG TRP A 6 32.344 25.178 -0.628 1.00 13.30 C ATOM 90 CD1 TRP A 6 33.116 26.281 -0.938 1.00 14.68 C ATOM 91 CD2 TRP A 6 32.358 24.369 -1.807 1.00 13.15 C ATOM 92 NE1 TRP A 6 33.590 26.193 -2.222 1.00 14.62 N ATOM 93 CE2 TRP A 6 33.127 25.033 -2.778 1.00 13.92 C ATOM 94 CE3 TRP A 6 31.808 23.139 -2.127 1.00 14.79 C ATOM 95 CZ2 TRP A 6 33.367 24.524 -4.050 1.00 14.94 C ATOM 96 CZ3 TRP A 6 32.055 22.605 -3.387 1.00 15.90 C ATOM 97 CH2 TRP A 6 32.819 23.300 -4.326 1.00 15.70 C ATOM 98 HA TRP A 6 29.988 24.135 -0.210 1.00 0.00 H ATOM 99 HB2 TRP A 6 31.867 25.821 1.305 1.00 0.00 H ATOM 100 HB3 TRP A 6 32.162 24.075 1.140 1.00 0.00 H ATOM 101 HE1 TRP A 6 34.199 26.891 -2.694 1.00 0.00 H ATOM 102 HD1 TRP A 6 33.320 27.107 -0.256 1.00 0.00 H ATOM 103 HZ2 TRP A 6 33.958 25.069 -4.786 1.00 0.00 H ATOM 104 HH2 TRP A 6 32.984 22.855 -5.307 1.00 0.00 H ATOM 105 HZ3 TRP A 6 31.646 21.628 -3.645 1.00 0.00 H ATOM 106 HE3 TRP A 6 31.194 22.600 -1.406 1.00 0.00 H ATOM 107 H TRP A 6 29.836 26.801 1.062 1.00 0.00 H ATOM 108 N GLN A 7 29.441 24.744 2.969 1.00 9.59 N ATOM 109 CA GLN A 7 29.071 24.298 4.313 1.00 9.77 C ATOM 110 C GLN A 7 27.780 24.927 4.747 1.00 10.11 C ATOM 111 O GLN A 7 27.384 25.967 4.203 1.00 11.08 O ATOM 112 CB GLN A 7 30.217 24.743 5.228 1.00 11.25 C ATOM 113 CG GLN A 7 31.198 23.694 5.661 1.00 14.97 C ATOM 114 CD GLN A 7 32.623 24.164 5.760 1.00 18.43 C ATOM 115 OE1 GLN A 7 32.883 25.365 5.917 1.00 21.69 O ATOM 116 NE2 GLN A 7 33.600 23.263 5.626 1.00 19.61 N ATOM 117 HA GLN A 7 28.922 23.219 4.347 1.00 0.00 H ATOM 118 HB2 GLN A 7 30.776 25.517 4.701 1.00 0.00 H ATOM 119 HB3 GLN A 7 29.772 25.167 6.128 1.00 0.00 H ATOM 120 HG2 GLN A 7 30.893 23.328 6.641 1.00 0.00 H ATOM 121 HG3 GLN A 7 31.160 22.876 4.941 1.00 0.00 H ATOM 122 HE22 GLN A 7 33.366 22.258 5.495 1.00 0.00 H ATOM 123 HE21 GLN A 7 34.594 23.566 5.653 1.00 0.00 H ATOM 124 H GLN A 7 29.426 25.765 2.771 1.00 0.00 H ATOM 125 N ARG A 8 27.113 24.394 5.748 1.00 10.42 N ATOM 126 CA ARG A 8 25.850 25.019 6.207 1.00 10.02 C ATOM 127 C ARG A 8 26.099 26.438 6.654 1.00 11.32 C ATOM 128 O ARG A 8 27.042 26.553 7.457 1.00 12.56 O ATOM 129 CB ARG A 8 25.438 24.227 7.453 1.00 9.65 C ATOM 130 CG ARG A 8 25.460 22.724 7.135 1.00 9.48 C ATOM 131 CD ARG A 8 24.189 22.137 7.717 1.00 8.69 C ATOM 132 NE ARG A 8 23.943 20.794 7.198 1.00 8.94 N ATOM 133 CZ ARG A 8 24.433 19.709 7.778 1.00 9.02 C ATOM 134 NH1 ARG A 8 25.185 19.754 8.859 1.00 8.89 N ATOM 135 NH2 ARG A 8 24.158 18.541 7.238 1.00 11.00 N ATOM 136 HA ARG A 8 25.105 25.017 5.411 1.00 0.00 H ATOM 137 HB2 ARG A 8 26.135 24.437 8.264 1.00 0.00 H ATOM 138 HB3 ARG A 8 24.432 24.520 7.754 1.00 0.00 H ATOM 139 HG2 ARG A 8 25.487 22.568 6.057 1.00 0.00 H ATOM 140 HG3 ARG A 8 26.333 22.256 7.590 1.00 0.00 H ATOM 141 HD2 ARG A 8 23.348 22.779 7.456 1.00 0.00 H ATOM 142 HD3 ARG A 8 24.284 22.088 8.802 1.00 0.00 H ATOM 143 HE ARG A 8 23.362 20.686 6.342 1.00 0.00 H ATOM 144 HH12 ARG A 8 25.547 18.873 9.278 1.00 0.00 H ATOM 145 HH11 ARG A 8 25.417 20.670 9.293 1.00 0.00 H ATOM 146 HH22 ARG A 8 24.527 17.669 7.668 1.00 0.00 H ATOM 147 HH21 ARG A 8 23.571 18.490 6.381 1.00 0.00 H ATOM 148 H ARG A 8 27.471 23.537 6.216 1.00 0.00 H ATOM 149 N PRO A 9 25.301 27.403 6.227 1.00 11.50 N ATOM 150 CA PRO A 9 25.511 28.805 6.635 1.00 11.03 C ATOM 151 C PRO A 9 24.976 29.058 8.023 1.00 11.90 C ATOM 152 O PRO A 9 23.956 29.724 8.267 1.00 12.37 O ATOM 153 CB PRO A 9 24.785 29.575 5.520 1.00 10.01 C ATOM 154 CG PRO A 9 23.562 28.687 5.369 1.00 10.33 C ATOM 155 CD PRO A 9 24.149 27.267 5.308 1.00 10.14 C ATOM 156 HA PRO A 9 26.554 29.108 6.723 1.00 0.00 H ATOM 157 HD3 PRO A 9 23.437 26.523 5.664 1.00 0.00 H ATOM 158 HD2 PRO A 9 24.469 27.008 4.299 1.00 0.00 H ATOM 159 HG3 PRO A 9 23.020 28.924 4.453 1.00 0.00 H ATOM 160 HG2 PRO A 9 22.894 28.796 6.224 1.00 0.00 H ATOM 161 HB2 PRO A 9 24.520 30.586 5.828 1.00 0.00 H ATOM 162 HB3 PRO A 9 25.374 29.618 4.604 1.00 0.00 H ATOM 163 N LEU A 10 25.664 28.459 8.992 1.00 12.61 N ATOM 164 CA LEU A 10 25.313 28.584 10.420 1.00 11.37 C ATOM 165 C LEU A 10 25.947 29.862 10.930 1.00 10.77 C ATOM 166 O LEU A 10 27.102 30.059 10.548 1.00 11.58 O ATOM 167 CB LEU A 10 25.843 27.356 11.170 1.00 9.83 C ATOM 168 CG LEU A 10 25.019 26.090 10.898 1.00 10.52 C ATOM 169 CD1 LEU A 10 25.872 24.844 10.714 1.00 9.57 C ATOM 170 CD2 LEU A 10 24.037 25.894 12.048 1.00 10.09 C ATOM 171 HA LEU A 10 24.235 28.629 10.573 1.00 0.00 H ATOM 172 HB2 LEU A 10 26.872 27.175 10.859 1.00 0.00 H ATOM 173 HB3 LEU A 10 25.819 27.564 12.240 1.00 0.00 H ATOM 174 HG LEU A 10 24.491 26.233 9.955 1.00 0.00 H ATOM 175 HD21 LEU A 10 24.589 25.785 12.981 1.00 0.00 H ATOM 176 HD22 LEU A 10 23.378 26.760 12.113 1.00 0.00 H ATOM 177 HD23 LEU A 10 23.444 24.997 11.869 1.00 0.00 H ATOM 178 HD11 LEU A 10 26.544 24.987 9.868 1.00 0.00 H ATOM 179 HD12 LEU A 10 26.456 24.668 11.617 1.00 0.00 H ATOM 180 HD13 LEU A 10 25.225 23.987 10.525 1.00 0.00 H ATOM 181 H LEU A 10 26.486 27.877 8.731 1.00 0.00 H ATOM 182 N VAL A 11 25.236 30.653 11.684 1.00 10.90 N ATOM 183 CA VAL A 11 25.729 31.899 12.287 1.00 11.41 C ATOM 184 C VAL A 11 25.415 31.958 13.780 1.00 13.06 C ATOM 185 O VAL A 11 24.720 31.093 14.361 1.00 15.56 O ATOM 186 CB VAL A 11 25.278 33.172 11.589 1.00 9.56 C ATOM 187 CG1 VAL A 11 25.845 33.191 10.171 1.00 9.12 C ATOM 188 CG2 VAL A 11 23.775 33.385 11.580 1.00 7.69 C ATOM 189 HA VAL A 11 26.809 31.863 12.147 1.00 0.00 H ATOM 190 HB VAL A 11 25.671 34.007 12.169 1.00 0.00 H ATOM 191 HG11 VAL A 11 26.934 33.162 10.216 1.00 0.00 H ATOM 192 HG12 VAL A 11 25.480 32.322 9.623 1.00 0.00 H ATOM 193 HG13 VAL A 11 25.525 34.102 9.665 1.00 0.00 H ATOM 194 HG21 VAL A 11 23.294 32.553 11.066 1.00 0.00 H ATOM 195 HG22 VAL A 11 23.411 33.439 12.606 1.00 0.00 H ATOM 196 HG23 VAL A 11 23.544 34.316 11.062 1.00 0.00 H ATOM 197 H VAL A 11 24.249 30.383 11.872 1.00 0.00 H ATOM 198 N THR A 12 25.960 32.941 14.477 1.00 13.55 N ATOM 199 CA THR A 12 25.739 33.058 15.925 1.00 13.15 C ATOM 200 C THR A 12 24.685 34.159 16.061 1.00 14.91 C ATOM 201 O THR A 12 24.933 35.181 15.386 1.00 16.04 O ATOM 202 CB THR A 12 26.979 33.491 16.694 1.00 12.25 C ATOM 203 OG1 THR A 12 28.151 32.730 16.333 1.00 9.90 O ATOM 204 CG2 THR A 12 26.772 33.372 18.207 1.00 11.61 C ATOM 205 HA THR A 12 25.450 32.090 16.335 1.00 0.00 H ATOM 206 HB THR A 12 27.141 34.534 16.422 1.00 0.00 H ATOM 207 HG1 THR A 12 27.993 31.772 16.525 1.00 0.00 H ATOM 208 HG23 THR A 12 25.889 33.942 18.498 1.00 0.00 H ATOM 209 HG21 THR A 12 26.633 32.324 18.472 1.00 0.00 H ATOM 210 HG22 THR A 12 27.647 33.766 18.724 1.00 0.00 H ATOM 211 H THR A 12 26.555 33.643 13.992 1.00 0.00 H ATOM 212 N ILE A 13 23.649 33.890 16.832 1.00 14.37 N ATOM 213 CA ILE A 13 22.678 34.957 17.062 1.00 15.51 C ATOM 214 C ILE A 13 22.620 35.275 18.550 1.00 16.34 C ATOM 215 O ILE A 13 23.037 34.431 19.359 1.00 16.93 O ATOM 216 CB ILE A 13 21.293 34.593 16.555 1.00 16.61 C ATOM 217 CG1 ILE A 13 20.756 33.374 17.280 1.00 16.95 C ATOM 218 CG2 ILE A 13 21.397 34.435 15.040 1.00 17.81 C ATOM 219 CD1 ILE A 13 19.255 33.148 17.110 1.00 16.85 C ATOM 220 HA ILE A 13 23.006 35.833 16.503 1.00 0.00 H ATOM 221 HB ILE A 13 20.562 35.373 16.766 1.00 0.00 H ATOM 222 HG12 ILE A 13 21.278 32.495 16.902 1.00 0.00 H ATOM 223 HG13 ILE A 13 20.965 33.490 18.343 1.00 0.00 H ATOM 224 HD11 ILE A 13 18.713 34.012 17.495 1.00 0.00 H ATOM 225 HD12 ILE A 13 19.026 33.016 16.053 1.00 0.00 H ATOM 226 HD13 ILE A 13 18.958 32.256 17.662 1.00 0.00 H ATOM 227 HG21 ILE A 13 21.733 35.374 14.600 1.00 0.00 H ATOM 228 HG22 ILE A 13 22.112 33.646 14.806 1.00 0.00 H ATOM 229 HG23 ILE A 13 20.420 34.173 14.635 1.00 0.00 H ATOM 230 H ILE A 13 23.528 32.951 17.261 1.00 0.00 H ATOM 231 N LYS A 14 22.138 36.459 18.854 1.00 16.79 N ATOM 232 CA LYS A 14 22.015 36.917 20.265 1.00 17.52 C ATOM 233 C LYS A 14 20.535 37.210 20.483 1.00 17.47 C ATOM 234 O LYS A 14 19.949 38.116 19.887 1.00 18.56 O ATOM 235 CB LYS A 14 22.917 38.090 20.457 1.00 19.80 C ATOM 236 CG LYS A 14 23.109 38.629 21.866 1.00 23.90 C ATOM 237 CD LYS A 14 23.848 39.986 21.764 1.00 25.73 C ATOM 238 CE LYS A 14 24.084 40.541 23.163 1.00 27.42 C ATOM 239 NZ LYS A 14 24.961 41.755 23.152 1.00 28.07 N ATOM 240 HA LYS A 14 22.326 36.181 21.007 1.00 0.00 H ATOM 241 HB2 LYS A 14 23.901 37.806 20.083 1.00 0.00 H ATOM 242 HB3 LYS A 14 22.521 38.905 19.851 1.00 0.00 H ATOM 243 HG2 LYS A 14 22.139 38.771 22.343 1.00 0.00 H ATOM 244 HG3 LYS A 14 23.702 37.928 22.453 1.00 0.00 H ATOM 245 HD2 LYS A 14 24.805 39.842 21.263 1.00 0.00 H ATOM 246 HD3 LYS A 14 23.242 40.688 21.191 1.00 0.00 H ATOM 247 HE2 LYS A 14 24.559 39.771 23.771 1.00 0.00 H ATOM 248 HE3 LYS A 14 23.122 40.807 23.602 1.00 0.00 H ATOM 249 HZ1 LYS A 14 25.885 41.510 22.742 1.00 0.00 H ATOM 250 HZ2 LYS A 14 24.513 42.500 22.581 1.00 0.00 H ATOM 251 HZ3 LYS A 14 25.092 42.095 24.126 1.00 0.00 H ATOM 252 H LYS A 14 21.834 37.093 18.088 1.00 0.00 H ATOM 253 N ILE A 15 19.910 36.363 21.247 1.00 17.41 N ATOM 254 CA ILE A 15 18.506 36.382 21.598 1.00 18.29 C ATOM 255 C ILE A 15 18.409 36.324 23.129 1.00 20.53 C ATOM 256 O ILE A 15 19.080 35.523 23.784 1.00 21.12 O ATOM 257 CB ILE A 15 17.692 35.236 20.994 1.00 15.70 C ATOM 258 CG1 ILE A 15 16.251 35.326 21.473 1.00 13.97 C ATOM 259 CG2 ILE A 15 18.294 33.876 21.376 1.00 15.46 C ATOM 260 CD1 ILE A 15 15.249 35.290 20.350 1.00 12.97 C ATOM 261 HA ILE A 15 18.078 37.296 21.187 1.00 0.00 H ATOM 262 HB ILE A 15 17.718 35.324 19.908 1.00 0.00 H ATOM 263 HG12 ILE A 15 16.054 34.487 22.140 1.00 0.00 H ATOM 264 HG13 ILE A 15 16.125 36.260 22.020 1.00 0.00 H ATOM 265 HD11 ILE A 15 15.427 36.131 19.679 1.00 0.00 H ATOM 266 HD12 ILE A 15 15.356 34.355 19.799 1.00 0.00 H ATOM 267 HD13 ILE A 15 14.242 35.358 20.761 1.00 0.00 H ATOM 268 HG21 ILE A 15 19.316 33.815 21.003 1.00 0.00 H ATOM 269 HG22 ILE A 15 18.295 33.772 22.461 1.00 0.00 H ATOM 270 HG23 ILE A 15 17.697 33.079 20.934 1.00 0.00 H ATOM 271 H ILE A 15 20.479 35.591 21.648 1.00 0.00 H ATOM 272 N GLY A 16 17.603 37.240 23.642 1.00 22.96 N ATOM 273 CA GLY A 16 17.438 37.314 25.104 1.00 25.48 C ATOM 274 C GLY A 16 18.835 37.157 25.725 1.00 27.66 C ATOM 275 O GLY A 16 19.007 36.241 26.539 1.00 28.08 O ATOM 276 HA3 GLY A 16 16.784 36.513 25.448 1.00 0.00 H ATOM 277 HA2 GLY A 16 17.010 38.277 25.384 1.00 0.00 H ATOM 278 H GLY A 16 17.092 37.899 23.021 1.00 0.00 H ATOM 279 N GLY A 17 19.736 38.041 25.274 1.00 28.20 N ATOM 280 CA GLY A 17 21.094 37.988 25.836 1.00 29.90 C ATOM 281 C GLY A 17 21.436 36.554 26.265 1.00 31.55 C ATOM 282 O GLY A 17 21.659 36.222 27.432 1.00 33.03 O ATOM 283 HA3 GLY A 17 21.151 38.646 26.703 1.00 0.00 H ATOM 284 HA2 GLY A 17 21.809 38.319 25.082 1.00 0.00 H ATOM 285 H GLY A 17 19.483 38.743 24.549 1.00 0.00 H ATOM 286 N GLN A 18 21.418 35.695 25.291 1.00 31.29 N ATOM 287 CA GLN A 18 21.738 34.280 25.264 1.00 31.15 C ATOM 288 C GLN A 18 22.208 34.096 23.813 1.00 31.01 C ATOM 289 O GLN A 18 21.351 34.441 22.947 1.00 31.87 O ATOM 290 CB GLN A 18 20.523 33.429 25.554 1.00 32.19 C ATOM 291 CG GLN A 18 20.788 32.208 26.422 1.00 33.51 C ATOM 292 CD GLN A 18 19.835 31.069 26.091 1.00 34.64 C ATOM 293 OE1 GLN A 18 20.264 30.007 25.635 1.00 34.15 O ATOM 294 NE2 GLN A 18 18.543 31.312 26.309 1.00 34.95 N ATOM 295 HA GLN A 18 22.471 33.982 26.013 1.00 0.00 H ATOM 296 HB2 GLN A 18 19.786 34.052 26.061 1.00 0.00 H ATOM 297 HB3 GLN A 18 20.114 33.087 24.603 1.00 0.00 H ATOM 298 HG2 GLN A 18 21.812 31.872 26.258 1.00 0.00 H ATOM 299 HG3 GLN A 18 20.661 32.483 27.469 1.00 0.00 H ATOM 300 HE22 GLN A 18 18.245 32.230 26.696 1.00 0.00 H ATOM 301 HE21 GLN A 18 17.833 30.584 26.092 1.00 0.00 H ATOM 302 H GLN A 18 21.124 36.088 24.374 1.00 0.00 H ATOM 303 N LEU A 19 23.454 33.694 23.580 1.00 29.33 N ATOM 304 CA LEU A 19 23.838 33.657 22.146 1.00 28.50 C ATOM 305 C LEU A 19 24.003 32.308 21.506 1.00 28.06 C ATOM 306 O LEU A 19 25.045 31.654 21.515 1.00 28.25 O ATOM 307 CB LEU A 19 24.901 34.718 21.943 1.00 27.09 C ATOM 308 CG LEU A 19 26.338 34.325 21.673 1.00 26.49 C ATOM 309 CD1 LEU A 19 27.240 35.546 21.682 1.00 25.73 C ATOM 310 CD2 LEU A 19 26.774 33.258 22.658 1.00 26.08 C ATOM 311 HA LEU A 19 22.986 33.924 21.521 1.00 0.00 H ATOM 312 HB2 LEU A 19 24.579 35.325 21.097 1.00 0.00 H ATOM 313 HB3 LEU A 19 24.909 35.329 22.845 1.00 0.00 H ATOM 314 HG LEU A 19 26.419 33.894 20.675 1.00 0.00 H ATOM 315 HD21 LEU A 19 26.691 33.647 23.673 1.00 0.00 H ATOM 316 HD22 LEU A 19 26.134 32.382 22.550 1.00 0.00 H ATOM 317 HD23 LEU A 19 27.809 32.981 22.457 1.00 0.00 H ATOM 318 HD11 LEU A 19 26.914 36.243 20.910 1.00 0.00 H ATOM 319 HD12 LEU A 19 27.184 36.030 22.657 1.00 0.00 H ATOM 320 HD13 LEU A 19 28.267 35.239 21.486 1.00 0.00 H ATOM 321 H LEU A 19 24.109 33.426 24.343 1.00 0.00 H ATOM 322 N LYS A 20 22.910 31.856 20.869 1.00 27.33 N ATOM 323 CA LYS A 20 22.677 30.641 20.157 1.00 26.46 C ATOM 324 C LYS A 20 23.394 30.601 18.785 1.00 25.08 C ATOM 325 O LYS A 20 24.143 31.515 18.464 1.00 25.83 O ATOM 326 CB LYS A 20 21.198 30.371 19.873 1.00 28.44 C ATOM 327 CG LYS A 20 20.182 30.842 20.865 1.00 29.87 C ATOM 328 CD LYS A 20 19.573 29.758 21.720 1.00 31.23 C ATOM 329 CE LYS A 20 20.680 29.042 22.508 1.00 33.72 C ATOM 330 NZ LYS A 20 20.092 28.329 23.691 1.00 34.25 N ATOM 331 HA LYS A 20 23.076 29.881 20.828 1.00 0.00 H ATOM 332 HB2 LYS A 20 20.961 30.845 18.920 1.00 0.00 H ATOM 333 HB3 LYS A 20 21.080 29.291 19.779 1.00 0.00 H ATOM 334 HG2 LYS A 20 20.663 31.563 21.525 1.00 0.00 H ATOM 335 HG3 LYS A 20 19.377 31.333 20.318 1.00 0.00 H ATOM 336 HD2 LYS A 20 18.860 30.201 22.416 1.00 0.00 H ATOM 337 HD3 LYS A 20 19.058 29.039 21.083 1.00 0.00 H ATOM 338 HE2 LYS A 20 21.409 29.775 22.854 1.00 0.00 H ATOM 339 HE3 LYS A 20 21.174 28.319 21.860 1.00 0.00 H ATOM 340 HZ1 LYS A 20 19.622 29.019 24.311 1.00 0.00 H ATOM 341 HZ2 LYS A 20 19.398 27.628 23.362 1.00 0.00 H ATOM 342 HZ3 LYS A 20 20.850 27.848 24.216 1.00 0.00 H ATOM 343 H LYS A 20 22.095 32.501 20.900 1.00 0.00 H ATOM 344 N GLU A 21 23.097 29.550 18.058 1.00 22.63 N ATOM 345 CA GLU A 21 23.678 29.237 16.740 1.00 20.62 C ATOM 346 C GLU A 21 22.563 28.827 15.785 1.00 17.63 C ATOM 347 O GLU A 21 21.745 27.964 16.140 1.00 16.24 O ATOM 348 CB GLU A 21 24.614 28.054 16.974 1.00 23.30 C ATOM 349 CG GLU A 21 25.812 27.878 16.103 1.00 27.18 C ATOM 350 CD GLU A 21 26.277 26.425 16.088 1.00 30.73 C ATOM 351 OE1 GLU A 21 26.159 25.699 17.101 1.00 31.06 O ATOM 352 OE2 GLU A 21 26.757 26.001 15.003 1.00 33.79 O ATOM 353 HA GLU A 21 24.203 30.089 16.309 1.00 0.00 H ATOM 354 HB2 GLU A 21 24.977 28.135 17.999 1.00 0.00 H ATOM 355 HB3 GLU A 21 24.013 27.150 16.873 1.00 0.00 H ATOM 356 HG2 GLU A 21 25.560 28.181 15.087 1.00 0.00 H ATOM 357 HG3 GLU A 21 26.620 28.506 16.479 1.00 0.00 H ATOM 358 H GLU A 21 22.396 28.885 18.442 1.00 0.00 H ATOM 359 N ALA A 22 22.523 29.479 14.634 1.00 14.72 N ATOM 360 CA ALA A 22 21.417 29.234 13.709 1.00 12.76 C ATOM 361 C ALA A 22 21.840 29.298 12.249 1.00 11.95 C ATOM 362 O ALA A 22 22.835 29.895 11.857 1.00 11.10 O ATOM 363 CB ALA A 22 20.269 30.183 13.995 1.00 11.63 C ATOM 364 HA ALA A 22 21.078 28.212 13.879 1.00 0.00 H ATOM 365 HB1 ALA A 22 19.919 30.031 15.016 1.00 0.00 H ATOM 366 HB2 ALA A 22 20.611 31.211 13.876 1.00 0.00 H ATOM 367 HB3 ALA A 22 19.455 29.987 13.298 1.00 0.00 H ATOM 368 H ALA A 22 23.271 30.159 14.390 1.00 0.00 H ATOM 369 N LEU A 23 20.984 28.590 11.503 1.00 10.04 N ATOM 370 CA LEU A 23 21.246 28.430 10.064 1.00 8.70 C ATOM 371 C LEU A 23 20.323 29.288 9.242 1.00 7.44 C ATOM 372 O LEU A 23 19.110 29.280 9.428 1.00 5.69 O ATOM 373 CB LEU A 23 21.263 26.929 9.788 1.00 7.56 C ATOM 374 CG LEU A 23 20.685 26.369 8.508 1.00 4.16 C ATOM 375 CD1 LEU A 23 21.307 25.012 8.228 1.00 5.18 C ATOM 376 CD2 LEU A 23 19.193 26.163 8.666 1.00 2.47 C ATOM 377 HA LEU A 23 22.219 28.810 9.751 1.00 0.00 H ATOM 378 HB2 LEU A 23 22.308 26.619 9.819 1.00 0.00 H ATOM 379 HB3 LEU A 23 20.721 26.456 10.607 1.00 0.00 H ATOM 380 HG LEU A 23 20.890 27.067 7.696 1.00 0.00 H ATOM 381 HD21 LEU A 23 19.008 25.464 9.482 1.00 0.00 H ATOM 382 HD22 LEU A 23 18.717 27.118 8.890 1.00 0.00 H ATOM 383 HD23 LEU A 23 18.783 25.759 7.740 1.00 0.00 H ATOM 384 HD11 LEU A 23 22.386 25.123 8.124 1.00 0.00 H ATOM 385 HD12 LEU A 23 21.088 24.336 9.054 1.00 0.00 H ATOM 386 HD13 LEU A 23 20.891 24.607 7.305 1.00 0.00 H ATOM 387 H LEU A 23 20.143 28.158 11.936 1.00 0.00 H ATOM 388 N LEU A 24 21.025 30.091 8.414 1.00 7.03 N ATOM 389 CA LEU A 24 20.362 31.043 7.499 1.00 5.29 C ATOM 390 C LEU A 24 19.661 30.270 6.401 1.00 4.07 C ATOM 391 O LEU A 24 20.259 29.790 5.459 1.00 3.13 O ATOM 392 CB LEU A 24 21.381 31.990 6.906 1.00 5.93 C ATOM 393 CG LEU A 24 22.310 32.595 7.967 1.00 6.68 C ATOM 394 CD1 LEU A 24 23.584 33.075 7.254 1.00 8.17 C ATOM 395 CD2 LEU A 24 21.594 33.715 8.695 1.00 6.59 C ATOM 396 HA LEU A 24 19.629 31.630 8.052 1.00 0.00 H ATOM 397 HB2 LEU A 24 21.986 31.444 6.182 1.00 0.00 H ATOM 398 HB3 LEU A 24 20.854 32.799 6.401 1.00 0.00 H ATOM 399 HG LEU A 24 22.588 31.860 8.722 1.00 0.00 H ATOM 400 HD21 LEU A 24 21.309 34.487 7.981 1.00 0.00 H ATOM 401 HD22 LEU A 24 20.701 33.319 9.179 1.00 0.00 H ATOM 402 HD23 LEU A 24 22.258 34.141 9.447 1.00 0.00 H ATOM 403 HD11 LEU A 24 24.066 32.228 6.765 1.00 0.00 H ATOM 404 HD12 LEU A 24 23.321 33.825 6.508 1.00 0.00 H ATOM 405 HD13 LEU A 24 24.265 33.511 7.985 1.00 0.00 H ATOM 406 H LEU A 24 22.064 30.038 8.420 1.00 0.00 H ATOM 407 N ASP A 25 18.373 30.165 6.616 1.00 4.57 N ATOM 408 CA ASP A 25 17.516 29.373 5.751 1.00 6.21 C ATOM 409 C ASP A 25 16.518 30.128 4.931 1.00 6.81 C ATOM 410 O ASP A 25 15.477 30.661 5.417 1.00 9.02 O ATOM 411 CB ASP A 25 16.926 28.341 6.733 1.00 8.83 C ATOM 412 CG ASP A 25 15.991 27.371 6.055 1.00 10.42 C ATOM 413 OD1 ASP A 25 16.229 27.226 4.849 1.00 11.95 O ATOM 414 OD2 ASP A 25 15.065 26.840 6.711 1.00 11.69 O ATOM 415 HA ASP A 25 18.068 28.916 4.930 1.00 0.00 H ATOM 416 HB2 ASP A 25 17.744 27.781 7.186 1.00 0.00 H ATOM 417 HB3 ASP A 25 16.377 28.872 7.511 1.00 0.00 H ATOM 418 H ASP A 25 17.953 30.662 7.427 1.00 0.00 H ATOM 419 N THR A 26 16.815 30.189 3.619 1.00 5.18 N ATOM 420 CA THR A 26 15.955 30.879 2.660 1.00 3.49 C ATOM 421 C THR A 26 14.800 30.022 2.202 1.00 1.77 C ATOM 422 O THR A 26 13.873 30.472 1.513 1.00 1.77 O ATOM 423 CB THR A 26 16.713 31.381 1.424 1.00 4.58 C ATOM 424 OG1 THR A 26 17.310 30.196 0.836 1.00 5.38 O ATOM 425 CG2 THR A 26 17.696 32.471 1.776 1.00 1.77 C ATOM 426 HA THR A 26 15.572 31.740 3.207 1.00 0.00 H ATOM 427 HB THR A 26 16.061 31.865 0.697 1.00 0.00 H ATOM 428 HG1 THR A 26 16.596 29.556 0.590 1.00 0.00 H ATOM 429 HG23 THR A 26 17.160 33.316 2.209 1.00 0.00 H ATOM 430 HG21 THR A 26 18.418 32.088 2.498 1.00 0.00 H ATOM 431 HG22 THR A 26 18.218 32.793 0.875 1.00 0.00 H ATOM 432 H THR A 26 17.684 29.731 3.277 1.00 0.00 H ATOM 433 N GLY A 27 14.814 28.795 2.672 1.00 2.29 N ATOM 434 CA GLY A 27 13.680 27.864 2.383 1.00 1.77 C ATOM 435 C GLY A 27 12.589 28.159 3.434 1.00 1.77 C ATOM 436 O GLY A 27 11.425 27.849 3.168 1.00 2.42 O ATOM 437 HA3 GLY A 27 14.012 26.829 2.465 1.00 0.00 H ATOM 438 HA2 GLY A 27 13.294 28.041 1.379 1.00 0.00 H ATOM 439 H GLY A 27 15.617 28.470 3.247 1.00 0.00 H ATOM 440 N ALA A 28 12.942 28.743 4.559 1.00 1.77 N ATOM 441 CA ALA A 28 12.062 29.135 5.629 1.00 1.77 C ATOM 442 C ALA A 28 11.401 30.499 5.556 1.00 2.43 C ATOM 443 O ALA A 28 12.080 31.556 5.561 1.00 2.45 O ATOM 444 CB ALA A 28 12.864 29.103 6.968 1.00 1.77 C ATOM 445 HA ALA A 28 11.246 28.417 5.550 1.00 0.00 H ATOM 446 HB1 ALA A 28 13.236 28.094 7.143 1.00 0.00 H ATOM 447 HB2 ALA A 28 13.704 29.795 6.904 1.00 0.00 H ATOM 448 HB3 ALA A 28 12.210 29.398 7.789 1.00 0.00 H ATOM 449 H ALA A 28 13.955 28.941 4.688 1.00 0.00 H ATOM 450 N ASP A 29 10.068 30.515 5.608 1.00 2.99 N ATOM 451 CA ASP A 29 9.286 31.752 5.630 1.00 5.06 C ATOM 452 C ASP A 29 9.539 32.576 6.892 1.00 7.30 C ATOM 453 O ASP A 29 9.753 33.781 6.782 1.00 8.17 O ATOM 454 CB ASP A 29 7.791 31.504 5.497 1.00 4.58 C ATOM 455 CG ASP A 29 7.388 30.960 4.141 1.00 7.05 C ATOM 456 OD1 ASP A 29 8.231 30.843 3.213 1.00 5.56 O ATOM 457 OD2 ASP A 29 6.184 30.642 4.018 1.00 7.85 O ATOM 458 HA ASP A 29 9.626 32.315 4.761 1.00 0.00 H ATOM 459 HB2 ASP A 29 7.491 30.786 6.260 1.00 0.00 H ATOM 460 HB3 ASP A 29 7.268 32.447 5.660 1.00 0.00 H ATOM 461 H ASP A 29 9.561 29.607 5.634 1.00 0.00 H ATOM 462 N ASP A 30 9.509 31.929 8.046 1.00 8.48 N ATOM 463 CA ASP A 30 9.663 32.375 9.380 1.00 7.97 C ATOM 464 C ASP A 30 10.879 31.836 10.131 1.00 7.80 C ATOM 465 O ASP A 30 11.508 30.844 9.766 1.00 7.28 O ATOM 466 CB ASP A 30 8.493 31.741 10.214 1.00 12.58 C ATOM 467 CG ASP A 30 7.144 32.313 9.842 1.00 15.24 C ATOM 468 OD1 ASP A 30 7.057 33.537 9.621 1.00 13.61 O ATOM 469 OD2 ASP A 30 6.171 31.481 9.812 1.00 17.72 O ATOM 470 HA ASP A 30 9.721 33.460 9.299 1.00 0.00 H ATOM 471 HB2 ASP A 30 8.479 30.666 10.036 1.00 0.00 H ATOM 472 HB3 ASP A 30 8.674 31.931 11.272 1.00 0.00 H ATOM 473 H ASP A 30 9.342 30.906 7.956 1.00 0.00 H ATOM 474 N THR A 31 11.101 32.473 11.294 1.00 6.06 N ATOM 475 CA THR A 31 12.210 32.086 12.183 1.00 3.52 C ATOM 476 C THR A 31 11.675 31.228 13.294 1.00 3.67 C ATOM 477 O THR A 31 10.633 31.581 13.904 1.00 5.22 O ATOM 478 CB THR A 31 12.941 33.317 12.682 1.00 1.79 C ATOM 479 OG1 THR A 31 13.453 33.927 11.486 1.00 2.26 O ATOM 480 CG2 THR A 31 14.126 32.939 13.550 1.00 2.62 C ATOM 481 HA THR A 31 12.946 31.495 11.637 1.00 0.00 H ATOM 482 HB THR A 31 12.284 33.955 13.273 1.00 0.00 H ATOM 483 HG1 THR A 31 12.700 34.158 10.886 1.00 0.00 H ATOM 484 HG23 THR A 31 13.768 32.472 14.468 1.00 0.00 H ATOM 485 HG21 THR A 31 14.762 32.239 13.009 1.00 0.00 H ATOM 486 HG22 THR A 31 14.696 33.835 13.795 1.00 0.00 H ATOM 487 H THR A 31 10.476 33.256 11.572 1.00 0.00 H ATOM 488 N VAL A 32 12.299 30.108 13.475 1.00 2.73 N ATOM 489 CA VAL A 32 11.886 29.103 14.465 1.00 3.66 C ATOM 490 C VAL A 32 13.091 28.638 15.233 1.00 4.37 C ATOM 491 O VAL A 32 14.078 28.248 14.604 1.00 5.93 O ATOM 492 CB VAL A 32 11.176 27.931 13.764 1.00 2.85 C ATOM 493 CG1 VAL A 32 11.965 27.441 12.600 1.00 3.05 C ATOM 494 CG2 VAL A 32 10.985 26.831 14.788 1.00 4.62 C ATOM 495 HA VAL A 32 11.179 29.543 15.168 1.00 0.00 H ATOM 496 HB VAL A 32 10.212 28.258 13.374 1.00 0.00 H ATOM 497 HG11 VAL A 32 12.092 28.251 11.882 1.00 0.00 H ATOM 498 HG12 VAL A 32 12.942 27.101 12.942 1.00 0.00 H ATOM 499 HG13 VAL A 32 11.436 26.613 12.127 1.00 0.00 H ATOM 500 HG21 VAL A 32 11.957 26.515 15.166 1.00 0.00 H ATOM 501 HG22 VAL A 32 10.378 27.205 15.612 1.00 0.00 H ATOM 502 HG23 VAL A 32 10.483 25.984 14.320 1.00 0.00 H ATOM 503 H VAL A 32 13.135 29.909 12.890 1.00 0.00 H ATOM 504 N LEU A 33 13.043 28.827 16.531 1.00 6.02 N ATOM 505 CA LEU A 33 14.142 28.527 17.450 1.00 7.26 C ATOM 506 C LEU A 33 13.764 27.416 18.386 1.00 10.11 C ATOM 507 O LEU A 33 12.611 27.482 18.863 1.00 12.45 O ATOM 508 CB LEU A 33 14.445 29.760 18.342 1.00 3.52 C ATOM 509 CG LEU A 33 14.831 31.009 17.534 1.00 2.27 C ATOM 510 CD1 LEU A 33 15.026 32.227 18.409 1.00 1.88 C ATOM 511 CD2 LEU A 33 16.078 30.734 16.723 1.00 2.84 C ATOM 512 HA LEU A 33 15.003 28.250 16.842 1.00 0.00 H ATOM 513 HB2 LEU A 33 13.557 29.989 18.931 1.00 0.00 H ATOM 514 HB3 LEU A 33 15.269 29.511 19.011 1.00 0.00 H ATOM 515 HG LEU A 33 14.002 31.232 16.863 1.00 0.00 H ATOM 516 HD21 LEU A 33 16.896 30.473 17.394 1.00 0.00 H ATOM 517 HD22 LEU A 33 15.890 29.907 16.039 1.00 0.00 H ATOM 518 HD23 LEU A 33 16.344 31.625 16.154 1.00 0.00 H ATOM 519 HD11 LEU A 33 14.099 32.443 18.940 1.00 0.00 H ATOM 520 HD12 LEU A 33 15.822 32.033 19.128 1.00 0.00 H ATOM 521 HD13 LEU A 33 15.297 33.080 17.787 1.00 0.00 H ATOM 522 H LEU A 33 12.166 29.216 16.933 1.00 0.00 H ATOM 523 N GLU A 34 14.668 26.498 18.645 1.00 13.14 N ATOM 524 CA GLU A 34 14.328 25.437 19.633 1.00 15.25 C ATOM 525 C GLU A 34 13.742 26.129 20.877 1.00 15.61 C ATOM 526 O GLU A 34 13.948 27.335 21.096 1.00 15.50 O ATOM 527 CB GLU A 34 15.615 24.753 20.063 1.00 17.78 C ATOM 528 CG GLU A 34 16.621 24.640 18.917 1.00 22.14 C ATOM 529 CD GLU A 34 18.022 24.343 19.456 1.00 24.56 C ATOM 530 OE1 GLU A 34 18.224 24.473 20.696 1.00 24.69 O ATOM 531 OE2 GLU A 34 18.879 24.003 18.614 1.00 25.77 O ATOM 532 HA GLU A 34 13.629 24.720 19.203 1.00 0.00 H ATOM 533 HB2 GLU A 34 16.066 25.329 20.871 1.00 0.00 H ATOM 534 HB3 GLU A 34 15.377 23.752 20.422 1.00 0.00 H ATOM 535 HG2 GLU A 34 16.315 23.834 18.250 1.00 0.00 H ATOM 536 HG3 GLU A 34 16.641 25.579 18.364 1.00 0.00 H ATOM 537 H GLU A 34 15.595 26.512 18.173 1.00 0.00 H ATOM 538 N GLU A 35 13.072 25.349 21.688 1.00 15.29 N ATOM 539 CA GLU A 35 12.479 25.727 22.932 1.00 14.55 C ATOM 540 C GLU A 35 13.268 26.586 23.894 1.00 14.98 C ATOM 541 O GLU A 35 14.431 26.314 24.277 1.00 14.69 O ATOM 542 CB GLU A 35 12.149 24.418 23.707 1.00 15.99 C ATOM 543 CG GLU A 35 10.707 23.963 23.436 1.00 18.41 C ATOM 544 CD GLU A 35 9.761 25.052 23.901 1.00 21.08 C ATOM 545 OE1 GLU A 35 10.349 26.103 24.307 1.00 22.83 O ATOM 546 OE2 GLU A 35 8.527 24.893 23.849 1.00 22.21 O ATOM 547 HA GLU A 35 11.638 26.350 22.626 1.00 0.00 H ATOM 548 HB2 GLU A 35 12.836 23.633 23.390 1.00 0.00 H ATOM 549 HB3 GLU A 35 12.272 24.596 24.775 1.00 0.00 H ATOM 550 HG2 GLU A 35 10.571 23.789 22.369 1.00 0.00 H ATOM 551 HG3 GLU A 35 10.504 23.042 23.982 1.00 0.00 H ATOM 552 H GLU A 35 12.960 24.356 21.398 1.00 0.00 H ATOM 553 N MET A 36 12.615 27.641 24.360 1.00 14.96 N ATOM 554 CA MET A 36 13.239 28.558 25.322 1.00 15.93 C ATOM 555 C MET A 36 12.147 29.448 25.883 1.00 18.25 C ATOM 556 O MET A 36 10.975 29.351 25.486 1.00 17.85 O ATOM 557 CB MET A 36 14.313 29.403 24.672 1.00 14.99 C ATOM 558 CG MET A 36 13.743 30.365 23.639 1.00 16.80 C ATOM 559 SD MET A 36 15.048 31.111 22.605 1.00 18.49 S ATOM 560 CE MET A 36 15.944 31.968 23.926 1.00 17.68 C ATOM 561 HA MET A 36 13.720 27.982 26.112 1.00 0.00 H ATOM 562 HB2 MET A 36 14.822 29.979 25.445 1.00 0.00 H ATOM 563 HB3 MET A 36 15.029 28.744 24.181 1.00 0.00 H ATOM 564 HG2 MET A 36 13.206 31.160 24.157 1.00 0.00 H ATOM 565 HG3 MET A 36 13.052 29.821 22.995 1.00 0.00 H ATOM 566 HE1 MET A 36 15.278 32.680 24.412 1.00 0.00 H ATOM 567 HE2 MET A 36 16.295 31.240 24.657 1.00 0.00 H ATOM 568 HE3 MET A 36 16.796 32.498 23.501 1.00 0.00 H ATOM 569 H MET A 36 11.643 27.823 24.038 1.00 0.00 H ATOM 570 N ASN A 37 12.579 30.314 26.811 1.00 20.40 N ATOM 571 CA ASN A 37 11.549 31.188 27.416 1.00 22.00 C ATOM 572 C ASN A 37 11.819 32.656 27.141 1.00 22.23 C ATOM 573 O ASN A 37 12.846 33.214 27.557 1.00 23.52 O ATOM 574 CB ASN A 37 11.343 30.860 28.894 1.00 23.46 C ATOM 575 CG ASN A 37 9.976 31.314 29.385 1.00 24.75 C ATOM 576 OD1 ASN A 37 9.891 31.888 30.474 1.00 24.89 O ATOM 577 ND2 ASN A 37 8.930 31.065 28.590 1.00 25.34 N ATOM 578 HA ASN A 37 10.596 30.979 26.929 1.00 0.00 H ATOM 579 HB2 ASN A 37 11.429 29.782 29.032 1.00 0.00 H ATOM 580 HB3 ASN A 37 12.114 31.362 29.479 1.00 0.00 H ATOM 581 HD22 ASN A 37 9.071 30.576 27.683 1.00 0.00 H ATOM 582 HD21 ASN A 37 7.975 31.360 28.879 1.00 0.00 H ATOM 583 H ASN A 37 13.580 30.368 27.089 1.00 0.00 H ATOM 584 N LEU A 38 10.891 33.213 26.409 1.00 20.70 N ATOM 585 CA LEU A 38 10.853 34.596 26.006 1.00 21.04 C ATOM 586 C LEU A 38 9.644 35.246 26.690 1.00 21.21 C ATOM 587 O LEU A 38 8.754 34.500 27.118 1.00 22.81 O ATOM 588 CB LEU A 38 10.644 34.696 24.480 1.00 19.74 C ATOM 589 CG LEU A 38 11.730 34.000 23.662 1.00 18.81 C ATOM 590 CD1 LEU A 38 11.333 33.995 22.173 1.00 20.29 C ATOM 591 CD2 LEU A 38 13.048 34.718 23.861 1.00 18.79 C ATOM 592 HA LEU A 38 11.787 35.086 26.280 1.00 0.00 H ATOM 593 HB2 LEU A 38 9.684 34.242 24.234 1.00 0.00 H ATOM 594 HB3 LEU A 38 10.628 35.750 24.203 1.00 0.00 H ATOM 595 HG LEU A 38 11.839 32.968 23.995 1.00 0.00 H ATOM 596 HD21 LEU A 38 12.950 35.752 23.531 1.00 0.00 H ATOM 597 HD22 LEU A 38 13.317 34.696 24.917 1.00 0.00 H ATOM 598 HD23 LEU A 38 13.823 34.221 23.277 1.00 0.00 H ATOM 599 HD11 LEU A 38 10.390 33.462 22.052 1.00 0.00 H ATOM 600 HD12 LEU A 38 11.219 35.022 21.825 1.00 0.00 H ATOM 601 HD13 LEU A 38 12.110 33.498 21.593 1.00 0.00 H ATOM 602 H LEU A 38 10.111 32.604 26.089 1.00 0.00 H ATOM 603 N PRO A 39 9.661 36.560 26.737 1.00 20.87 N ATOM 604 CA PRO A 39 8.571 37.319 27.354 1.00 20.96 C ATOM 605 C PRO A 39 7.501 37.595 26.318 1.00 21.67 C ATOM 606 O PRO A 39 7.783 37.519 25.124 1.00 21.59 O ATOM 607 CB PRO A 39 9.288 38.588 27.810 1.00 19.93 C ATOM 608 CG PRO A 39 10.294 38.821 26.694 1.00 19.77 C ATOM 609 CD PRO A 39 10.724 37.449 26.233 1.00 20.27 C ATOM 610 HA PRO A 39 8.056 36.817 28.173 1.00 0.00 H ATOM 611 HD3 PRO A 39 10.784 37.405 25.146 1.00 0.00 H ATOM 612 HD2 PRO A 39 11.690 37.181 26.660 1.00 0.00 H ATOM 613 HG3 PRO A 39 11.151 39.382 27.066 1.00 0.00 H ATOM 614 HG2 PRO A 39 9.831 39.369 25.874 1.00 0.00 H ATOM 615 HB2 PRO A 39 8.593 39.424 27.895 1.00 0.00 H ATOM 616 HB3 PRO A 39 9.789 38.435 28.766 1.00 0.00 H ATOM 617 N GLY A 40 6.322 37.914 26.810 1.00 23.22 N ATOM 618 CA GLY A 40 5.198 38.280 25.939 1.00 25.21 C ATOM 619 C GLY A 40 4.185 37.164 25.857 1.00 26.53 C ATOM 620 O GLY A 40 4.412 36.087 26.436 1.00 27.17 O ATOM 621 HA3 GLY A 40 5.577 38.491 24.939 1.00 0.00 H ATOM 622 HA2 GLY A 40 4.714 39.171 26.338 1.00 0.00 H ATOM 623 H GLY A 40 6.184 37.907 27.841 1.00 0.00 H ATOM 624 N ARG A 41 3.075 37.470 25.171 1.00 27.15 N ATOM 625 CA ARG A 41 2.106 36.372 25.038 1.00 27.67 C ATOM 626 C ARG A 41 2.508 35.737 23.670 1.00 26.60 C ATOM 627 O ARG A 41 2.925 36.423 22.758 1.00 26.79 O ATOM 628 CB ARG A 41 0.655 36.603 24.992 1.00 29.93 C ATOM 629 CG ARG A 41 -0.032 37.842 25.458 1.00 33.57 C ATOM 630 CD ARG A 41 -1.521 37.506 25.678 1.00 36.66 C ATOM 631 NE ARG A 41 -1.694 36.880 26.981 1.00 39.58 N ATOM 632 CZ ARG A 41 -1.699 35.588 27.261 1.00 41.30 C ATOM 633 NH1 ARG A 41 -1.573 34.669 26.310 1.00 41.49 N ATOM 634 NH2 ARG A 41 -1.849 35.228 28.542 1.00 42.09 N ATOM 635 HA ARG A 41 2.186 35.807 25.967 1.00 0.00 H ATOM 636 HB2 ARG A 41 0.377 36.494 23.944 1.00 0.00 H ATOM 637 HB3 ARG A 41 0.213 35.791 25.570 1.00 0.00 H ATOM 638 HG2 ARG A 41 0.413 38.183 26.393 1.00 0.00 H ATOM 639 HG3 ARG A 41 0.064 38.624 24.705 1.00 0.00 H ATOM 640 HD2 ARG A 41 -1.858 36.822 24.899 1.00 0.00 H ATOM 641 HD3 ARG A 41 -2.110 38.422 25.634 1.00 0.00 H ATOM 642 HE ARG A 41 -1.830 37.525 27.786 1.00 0.00 H ATOM 643 HH12 ARG A 41 -1.580 33.659 26.559 1.00 0.00 H ATOM 644 HH11 ARG A 41 -1.467 34.959 25.317 1.00 0.00 H ATOM 645 HH22 ARG A 41 -1.858 34.221 28.802 1.00 0.00 H ATOM 646 HH21 ARG A 41 -1.957 35.955 29.277 1.00 0.00 H ATOM 647 H ARG A 41 2.911 38.413 24.764 1.00 0.00 H ATOM 648 N TRP A 42 2.311 34.447 23.688 1.00 25.34 N ATOM 649 CA TRP A 42 2.582 33.682 22.464 1.00 24.03 C ATOM 650 C TRP A 42 1.234 33.120 22.038 1.00 22.84 C ATOM 651 O TRP A 42 0.435 32.950 22.968 1.00 24.73 O ATOM 652 CB TRP A 42 3.579 32.599 22.816 1.00 23.10 C ATOM 653 CG TRP A 42 3.068 31.707 23.902 1.00 22.51 C ATOM 654 CD1 TRP A 42 3.447 31.698 25.206 1.00 23.39 C ATOM 655 CD2 TRP A 42 2.123 30.639 23.747 1.00 21.89 C ATOM 656 NE1 TRP A 42 2.798 30.679 25.882 1.00 23.31 N ATOM 657 CE2 TRP A 42 1.980 30.024 24.994 1.00 21.90 C ATOM 658 CE3 TRP A 42 1.422 30.127 22.664 1.00 21.20 C ATOM 659 CZ2 TRP A 42 1.144 28.937 25.198 1.00 21.35 C ATOM 660 CZ3 TRP A 42 0.602 29.050 22.849 1.00 21.10 C ATOM 661 CH2 TRP A 42 0.461 28.477 24.115 1.00 21.74 C ATOM 662 HA TRP A 42 3.009 34.267 21.649 1.00 0.00 H ATOM 663 HB2 TRP A 42 3.776 31.998 21.928 1.00 0.00 H ATOM 664 HB3 TRP A 42 4.506 33.066 23.149 1.00 0.00 H ATOM 665 HE1 TRP A 42 2.911 30.449 26.890 1.00 0.00 H ATOM 666 HD1 TRP A 42 4.158 32.392 25.655 1.00 0.00 H ATOM 667 HZ2 TRP A 42 1.039 28.473 26.179 1.00 0.00 H ATOM 668 HH2 TRP A 42 -0.218 27.634 24.239 1.00 0.00 H ATOM 669 HZ3 TRP A 42 0.054 28.635 22.003 1.00 0.00 H ATOM 670 HE3 TRP A 42 1.525 30.579 21.677 1.00 0.00 H ATOM 671 H TRP A 42 1.970 33.972 24.548 1.00 0.00 H ATOM 672 N LYS A 43 1.043 32.888 20.768 1.00 20.46 N ATOM 673 CA LYS A 43 -0.165 32.271 20.213 1.00 17.14 C ATOM 674 C LYS A 43 0.375 31.024 19.474 1.00 14.25 C ATOM 675 O LYS A 43 1.446 31.168 18.918 1.00 14.16 O ATOM 676 CB LYS A 43 -0.860 33.068 19.157 1.00 16.85 C ATOM 677 CG LYS A 43 -0.326 34.445 18.918 1.00 18.96 C ATOM 678 CD LYS A 43 -0.869 35.055 17.642 1.00 21.32 C ATOM 679 CE LYS A 43 -1.404 34.007 16.697 1.00 22.00 C ATOM 680 NZ LYS A 43 -2.894 33.961 16.632 1.00 23.20 N ATOM 681 HA LYS A 43 -0.878 32.122 21.024 1.00 0.00 H ATOM 682 HB2 LYS A 43 -0.789 32.515 18.220 1.00 0.00 H ATOM 683 HB3 LYS A 43 -1.907 33.161 19.444 1.00 0.00 H ATOM 684 HG2 LYS A 43 -0.605 35.081 19.758 1.00 0.00 H ATOM 685 HG3 LYS A 43 0.761 34.393 18.848 1.00 0.00 H ATOM 686 HD2 LYS A 43 -1.674 35.744 17.896 1.00 0.00 H ATOM 687 HD3 LYS A 43 -0.068 35.602 17.144 1.00 0.00 H ATOM 688 HE2 LYS A 43 -1.043 33.032 17.025 1.00 0.00 H ATOM 689 HE3 LYS A 43 -1.022 34.217 15.698 1.00 0.00 H ATOM 690 HZ1 LYS A 43 -3.275 33.750 17.577 1.00 0.00 H ATOM 691 HZ2 LYS A 43 -3.254 34.882 16.310 1.00 0.00 H ATOM 692 HZ3 LYS A 43 -3.188 33.219 15.965 1.00 0.00 H ATOM 693 H LYS A 43 1.798 33.159 20.106 1.00 0.00 H ATOM 694 N PRO A 44 -0.348 29.957 19.550 1.00 12.64 N ATOM 695 CA PRO A 44 0.056 28.742 18.859 1.00 11.70 C ATOM 696 C PRO A 44 -0.083 28.978 17.336 1.00 11.20 C ATOM 697 O PRO A 44 -1.007 29.674 16.931 1.00 10.69 O ATOM 698 CB PRO A 44 -1.012 27.727 19.239 1.00 11.62 C ATOM 699 CG PRO A 44 -2.241 28.593 19.483 1.00 12.71 C ATOM 700 CD PRO A 44 -1.665 29.832 20.208 1.00 12.82 C ATOM 701 HA PRO A 44 1.073 28.437 19.106 1.00 0.00 H ATOM 702 HD3 PRO A 44 -2.281 30.716 20.042 1.00 0.00 H ATOM 703 HD2 PRO A 44 -1.563 29.658 21.279 1.00 0.00 H ATOM 704 HG3 PRO A 44 -2.966 28.075 20.111 1.00 0.00 H ATOM 705 HG2 PRO A 44 -2.713 28.875 18.542 1.00 0.00 H ATOM 706 HB2 PRO A 44 -1.186 27.020 18.428 1.00 0.00 H ATOM 707 HB3 PRO A 44 -0.731 27.182 20.141 1.00 0.00 H ATOM 708 N LYS A 45 0.805 28.367 16.628 1.00 10.25 N ATOM 709 CA LYS A 45 0.966 28.236 15.209 1.00 10.41 C ATOM 710 C LYS A 45 1.399 26.746 15.008 1.00 11.85 C ATOM 711 O LYS A 45 1.864 26.119 15.973 1.00 10.75 O ATOM 712 CB LYS A 45 2.017 29.152 14.643 1.00 8.04 C ATOM 713 CG LYS A 45 2.211 29.289 13.152 1.00 5.48 C ATOM 714 CD LYS A 45 2.696 30.704 12.849 1.00 7.11 C ATOM 715 CE LYS A 45 3.167 30.970 11.443 1.00 6.33 C ATOM 716 NZ LYS A 45 1.984 30.893 10.507 1.00 9.35 N ATOM 717 HA LYS A 45 0.045 28.505 14.692 1.00 0.00 H ATOM 718 HB2 LYS A 45 1.793 30.150 15.019 1.00 0.00 H ATOM 719 HB3 LYS A 45 2.971 28.817 15.050 1.00 0.00 H ATOM 720 HG2 LYS A 45 2.952 28.566 12.810 1.00 0.00 H ATOM 721 HG3 LYS A 45 1.266 29.108 12.641 1.00 0.00 H ATOM 722 HD2 LYS A 45 1.873 31.387 13.057 1.00 0.00 H ATOM 723 HD3 LYS A 45 3.525 30.921 13.522 1.00 0.00 H ATOM 724 HE2 LYS A 45 3.908 30.224 11.158 1.00 0.00 H ATOM 725 HE3 LYS A 45 3.613 31.963 11.388 1.00 0.00 H ATOM 726 HZ1 LYS A 45 1.561 29.945 10.563 1.00 0.00 H ATOM 727 HZ2 LYS A 45 1.279 31.606 10.783 1.00 0.00 H ATOM 728 HZ3 LYS A 45 2.301 31.076 9.534 1.00 0.00 H ATOM 729 H LYS A 45 1.536 27.882 17.187 1.00 0.00 H ATOM 730 N MET A 46 1.269 26.327 13.779 1.00 12.77 N ATOM 731 CA MET A 46 1.597 24.990 13.252 1.00 13.62 C ATOM 732 C MET A 46 2.433 25.093 11.975 1.00 13.32 C ATOM 733 O MET A 46 1.845 25.533 10.961 1.00 13.85 O ATOM 734 CB MET A 46 0.203 24.441 12.877 1.00 14.97 C ATOM 735 CG MET A 46 0.119 22.930 12.742 1.00 16.88 C ATOM 736 SD MET A 46 -0.425 22.179 14.298 1.00 16.44 S ATOM 737 CE MET A 46 1.084 21.293 14.690 1.00 17.25 C ATOM 738 HA MET A 46 2.164 24.383 13.958 1.00 0.00 H ATOM 739 HB2 MET A 46 -0.501 24.751 13.649 1.00 0.00 H ATOM 740 HB3 MET A 46 -0.088 24.882 11.924 1.00 0.00 H ATOM 741 HG2 MET A 46 1.102 22.538 12.479 1.00 0.00 H ATOM 742 HG3 MET A 46 -0.593 22.680 11.955 1.00 0.00 H ATOM 743 HE1 MET A 46 1.306 20.584 13.892 1.00 0.00 H ATOM 744 HE2 MET A 46 1.906 22.003 14.786 1.00 0.00 H ATOM 745 HE3 MET A 46 0.955 20.755 15.629 1.00 0.00 H ATOM 746 H MET A 46 0.892 27.013 13.095 1.00 0.00 H ATOM 747 N ILE A 47 3.712 24.765 11.947 1.00 12.67 N ATOM 748 CA ILE A 47 4.541 24.899 10.737 1.00 12.07 C ATOM 749 C ILE A 47 4.930 23.576 10.116 1.00 11.83 C ATOM 750 O ILE A 47 5.224 22.618 10.847 1.00 13.61 O ATOM 751 CB ILE A 47 5.851 25.649 11.003 1.00 12.39 C ATOM 752 CG1 ILE A 47 6.468 25.069 12.290 1.00 12.79 C ATOM 753 CG2 ILE A 47 5.671 27.148 11.110 1.00 12.91 C ATOM 754 CD1 ILE A 47 7.955 25.359 12.352 1.00 13.09 C ATOM 755 HA ILE A 47 3.899 25.456 10.054 1.00 0.00 H ATOM 756 HB ILE A 47 6.517 25.504 10.152 1.00 0.00 H ATOM 757 HG12 ILE A 47 5.980 25.518 13.155 1.00 0.00 H ATOM 758 HG13 ILE A 47 6.313 23.990 12.306 1.00 0.00 H ATOM 759 HD11 ILE A 47 8.448 24.908 11.491 1.00 0.00 H ATOM 760 HD12 ILE A 47 8.114 26.437 12.340 1.00 0.00 H ATOM 761 HD13 ILE A 47 8.368 24.940 13.270 1.00 0.00 H ATOM 762 HG21 ILE A 47 5.256 27.530 10.177 1.00 0.00 H ATOM 763 HG22 ILE A 47 4.990 27.373 11.931 1.00 0.00 H ATOM 764 HG23 ILE A 47 6.637 27.616 11.299 1.00 0.00 H ATOM 765 H ILE A 47 4.152 24.397 12.815 1.00 0.00 H ATOM 766 N GLY A 48 4.958 23.520 8.775 1.00 10.58 N ATOM 767 CA GLY A 48 5.227 22.271 8.095 1.00 7.52 C ATOM 768 C GLY A 48 6.498 22.156 7.350 1.00 6.42 C ATOM 769 O GLY A 48 6.946 23.128 6.773 1.00 7.11 O ATOM 770 HA3 GLY A 48 4.417 22.105 7.385 1.00 0.00 H ATOM 771 HA2 GLY A 48 5.217 21.482 8.847 1.00 0.00 H ATOM 772 H GLY A 48 4.785 24.382 8.220 1.00 0.00 H ATOM 773 N GLY A 49 7.081 20.980 7.302 1.00 6.18 N ATOM 774 CA GLY A 49 8.352 20.803 6.555 1.00 6.89 C ATOM 775 C GLY A 49 8.427 19.333 6.136 1.00 6.49 C ATOM 776 O GLY A 49 7.373 18.676 6.041 1.00 6.75 O ATOM 777 HA3 GLY A 49 9.199 21.054 7.193 1.00 0.00 H ATOM 778 HA2 GLY A 49 8.360 21.444 5.674 1.00 0.00 H ATOM 779 H GLY A 49 6.650 20.169 7.790 1.00 0.00 H ATOM 780 N ILE A 50 9.644 18.909 5.898 1.00 6.09 N ATOM 781 CA ILE A 50 9.866 17.488 5.591 1.00 7.74 C ATOM 782 C ILE A 50 9.422 16.680 6.823 1.00 9.78 C ATOM 783 O ILE A 50 9.714 17.020 8.022 1.00 10.58 O ATOM 784 CB ILE A 50 11.362 17.306 5.374 1.00 6.51 C ATOM 785 CG1 ILE A 50 11.737 17.392 3.901 1.00 6.26 C ATOM 786 CG2 ILE A 50 11.805 15.988 5.962 1.00 8.51 C ATOM 787 CD1 ILE A 50 10.704 16.881 2.958 1.00 6.25 C ATOM 788 HA ILE A 50 9.314 17.161 4.710 1.00 0.00 H ATOM 789 HB ILE A 50 11.879 18.120 5.883 1.00 0.00 H ATOM 790 HG12 ILE A 50 11.927 18.438 3.661 1.00 0.00 H ATOM 791 HG13 ILE A 50 12.649 16.814 3.750 1.00 0.00 H ATOM 792 HD11 ILE A 50 10.508 15.830 3.170 1.00 0.00 H ATOM 793 HD12 ILE A 50 9.786 17.455 3.081 1.00 0.00 H ATOM 794 HD13 ILE A 50 11.065 16.985 1.935 1.00 0.00 H ATOM 795 HG21 ILE A 50 11.590 15.978 7.031 1.00 0.00 H ATOM 796 HG22 ILE A 50 11.267 15.175 5.474 1.00 0.00 H ATOM 797 HG23 ILE A 50 12.876 15.863 5.804 1.00 0.00 H ATOM 798 H ILE A 50 10.445 19.571 5.926 1.00 0.00 H ATOM 799 N GLY A 51 8.692 15.611 6.589 1.00 9.81 N ATOM 800 CA GLY A 51 8.293 14.834 7.792 1.00 11.02 C ATOM 801 C GLY A 51 7.098 15.435 8.498 1.00 11.62 C ATOM 802 O GLY A 51 6.658 14.853 9.506 1.00 11.85 O ATOM 803 HA3 GLY A 51 9.133 14.808 8.486 1.00 0.00 H ATOM 804 HA2 GLY A 51 8.044 13.818 7.486 1.00 0.00 H ATOM 805 H GLY A 51 8.413 15.329 5.628 1.00 0.00 H ATOM 806 N GLY A 52 6.549 16.561 8.027 1.00 10.60 N ATOM 807 CA GLY A 52 5.341 17.025 8.649 1.00 9.91 C ATOM 808 C GLY A 52 5.239 18.306 9.370 1.00 9.27 C ATOM 809 O GLY A 52 6.083 19.171 9.152 1.00 10.59 O ATOM 810 HA3 GLY A 52 5.061 16.255 9.368 1.00 0.00 H ATOM 811 HA2 GLY A 52 4.595 17.069 7.856 1.00 0.00 H ATOM 812 H GLY A 52 6.982 17.082 7.238 1.00 0.00 H ATOM 813 N PHE A 53 4.211 18.416 10.192 1.00 7.56 N ATOM 814 CA PHE A 53 3.917 19.590 10.993 1.00 8.01 C ATOM 815 C PHE A 53 4.143 19.447 12.499 1.00 8.98 C ATOM 816 O PHE A 53 3.779 18.463 13.164 1.00 11.41 O ATOM 817 CB PHE A 53 2.438 19.920 10.697 1.00 3.94 C ATOM 818 CG PHE A 53 2.201 20.648 9.423 1.00 2.25 C ATOM 819 CD1 PHE A 53 2.084 20.021 8.211 1.00 2.49 C ATOM 820 CD2 PHE A 53 2.081 22.037 9.425 1.00 2.02 C ATOM 821 CE1 PHE A 53 1.867 20.748 7.030 1.00 1.77 C ATOM 822 CE2 PHE A 53 1.855 22.752 8.279 1.00 1.77 C ATOM 823 CZ PHE A 53 1.759 22.122 7.051 1.00 1.77 C ATOM 824 HA PHE A 53 4.614 20.381 10.716 1.00 0.00 H ATOM 825 HB2 PHE A 53 1.883 18.983 10.660 1.00 0.00 H ATOM 826 HB3 PHE A 53 2.058 20.534 11.514 1.00 0.00 H ATOM 827 HD2 PHE A 53 2.170 22.572 10.371 1.00 0.00 H ATOM 828 HE2 PHE A 53 1.749 23.835 8.335 1.00 0.00 H ATOM 829 HZ PHE A 53 1.604 22.691 6.134 1.00 0.00 H ATOM 830 HE1 PHE A 53 1.783 20.218 6.081 1.00 0.00 H ATOM 831 HD1 PHE A 53 2.161 18.935 8.162 1.00 0.00 H ATOM 832 H PHE A 53 3.566 17.604 10.271 1.00 0.00 H ATOM 833 N ILE A 54 4.761 20.428 13.122 1.00 8.07 N ATOM 834 CA ILE A 54 4.994 20.544 14.558 1.00 6.99 C ATOM 835 C ILE A 54 4.211 21.764 15.007 1.00 6.95 C ATOM 836 O ILE A 54 3.965 22.635 14.161 1.00 7.71 O ATOM 837 CB ILE A 54 6.480 20.701 14.937 1.00 5.05 C ATOM 838 CG1 ILE A 54 7.177 21.702 14.066 1.00 5.82 C ATOM 839 CG2 ILE A 54 7.108 19.318 14.730 1.00 4.48 C ATOM 840 CD1 ILE A 54 8.021 22.792 14.626 1.00 6.70 C ATOM 841 HA ILE A 54 4.673 19.625 15.050 1.00 0.00 H ATOM 842 HB ILE A 54 6.575 21.059 15.962 1.00 0.00 H ATOM 843 HG12 ILE A 54 7.823 21.129 13.401 1.00 0.00 H ATOM 844 HG13 ILE A 54 6.398 22.191 13.481 1.00 0.00 H ATOM 845 HD11 ILE A 54 7.415 23.421 15.278 1.00 0.00 H ATOM 846 HD12 ILE A 54 8.841 22.358 15.198 1.00 0.00 H ATOM 847 HD13 ILE A 54 8.423 23.393 13.811 1.00 0.00 H ATOM 848 HG21 ILE A 54 6.608 18.594 15.373 1.00 0.00 H ATOM 849 HG22 ILE A 54 6.993 19.021 13.688 1.00 0.00 H ATOM 850 HG23 ILE A 54 8.168 19.360 14.983 1.00 0.00 H ATOM 851 H ILE A 54 5.121 21.202 12.528 1.00 0.00 H ATOM 852 N LYS A 55 3.810 21.809 16.257 1.00 8.27 N ATOM 853 CA LYS A 55 3.044 22.975 16.761 1.00 7.70 C ATOM 854 C LYS A 55 4.060 23.842 17.458 1.00 7.84 C ATOM 855 O LYS A 55 4.833 23.247 18.223 1.00 8.85 O ATOM 856 CB LYS A 55 1.939 22.523 17.703 1.00 9.14 C ATOM 857 CG LYS A 55 1.331 23.704 18.480 1.00 12.67 C ATOM 858 CD LYS A 55 0.055 23.317 19.195 1.00 12.81 C ATOM 859 CE LYS A 55 -1.186 23.768 18.419 1.00 14.18 C ATOM 860 NZ LYS A 55 -2.391 23.053 18.992 1.00 13.82 N ATOM 861 HA LYS A 55 2.544 23.522 15.962 1.00 0.00 H ATOM 862 HB2 LYS A 55 1.153 22.042 17.120 1.00 0.00 H ATOM 863 HB3 LYS A 55 2.352 21.808 18.414 1.00 0.00 H ATOM 864 HG2 LYS A 55 2.056 24.051 19.216 1.00 0.00 H ATOM 865 HG3 LYS A 55 1.112 24.510 17.780 1.00 0.00 H ATOM 866 HD2 LYS A 55 0.027 22.233 19.308 1.00 0.00 H ATOM 867 HD3 LYS A 55 0.046 23.784 20.180 1.00 0.00 H ATOM 868 HE2 LYS A 55 -1.074 23.515 17.365 1.00 0.00 H ATOM 869 HE3 LYS A 55 -1.313 24.846 18.521 1.00 0.00 H ATOM 870 HZ1 LYS A 55 -2.262 22.026 18.894 1.00 0.00 H ATOM 871 HZ2 LYS A 55 -2.491 23.296 19.998 1.00 0.00 H ATOM 872 HZ3 LYS A 55 -3.245 23.347 18.476 1.00 0.00 H ATOM 873 H LYS A 55 4.031 21.021 16.898 1.00 0.00 H ATOM 874 N VAL A 56 4.091 25.126 17.224 1.00 8.35 N ATOM 875 CA VAL A 56 5.071 26.001 17.892 1.00 8.35 C ATOM 876 C VAL A 56 4.337 27.130 18.622 1.00 10.65 C ATOM 877 O VAL A 56 3.140 27.357 18.391 1.00 11.43 O ATOM 878 CB VAL A 56 6.014 26.637 16.856 1.00 6.48 C ATOM 879 CG1 VAL A 56 6.857 25.624 16.112 1.00 5.83 C ATOM 880 CG2 VAL A 56 5.168 27.477 15.910 1.00 4.17 C ATOM 881 HA VAL A 56 5.646 25.399 18.595 1.00 0.00 H ATOM 882 HB VAL A 56 6.738 27.265 17.376 1.00 0.00 H ATOM 883 HG11 VAL A 56 7.473 25.073 16.823 1.00 0.00 H ATOM 884 HG12 VAL A 56 6.205 24.930 15.581 1.00 0.00 H ATOM 885 HG13 VAL A 56 7.498 26.141 15.398 1.00 0.00 H ATOM 886 HG21 VAL A 56 4.437 26.838 15.415 1.00 0.00 H ATOM 887 HG22 VAL A 56 4.651 28.251 16.477 1.00 0.00 H ATOM 888 HG23 VAL A 56 5.812 27.941 15.163 1.00 0.00 H ATOM 889 H VAL A 56 3.412 25.539 16.554 1.00 0.00 H ATOM 890 N ARG A 57 5.081 27.862 19.441 1.00 11.47 N ATOM 891 CA ARG A 57 4.559 29.028 20.161 1.00 11.55 C ATOM 892 C ARG A 57 4.989 30.299 19.475 1.00 11.28 C ATOM 893 O ARG A 57 6.194 30.564 19.462 1.00 12.76 O ATOM 894 CB ARG A 57 5.159 28.971 21.597 1.00 11.48 C ATOM 895 CG ARG A 57 4.246 27.999 22.345 1.00 12.45 C ATOM 896 CD ARG A 57 4.451 27.991 23.827 1.00 12.38 C ATOM 897 NE ARG A 57 5.702 27.205 24.090 1.00 13.58 N ATOM 898 CZ ARG A 57 6.803 27.951 24.271 1.00 13.62 C ATOM 899 NH1 ARG A 57 6.579 29.260 24.188 1.00 13.11 N ATOM 900 NH2 ARG A 57 7.941 27.346 24.515 1.00 13.05 N ATOM 901 HA ARG A 57 3.469 29.016 20.187 1.00 0.00 H ATOM 902 HB2 ARG A 57 6.184 28.600 21.574 1.00 0.00 H ATOM 903 HB3 ARG A 57 5.141 29.956 22.064 1.00 0.00 H ATOM 904 HG2 ARG A 57 3.211 28.276 22.143 1.00 0.00 H ATOM 905 HG3 ARG A 57 4.432 26.994 21.967 1.00 0.00 H ATOM 906 HD2 ARG A 57 3.601 27.520 24.321 1.00 0.00 H ATOM 907 HD3 ARG A 57 4.564 29.011 24.196 1.00 0.00 H ATOM 908 HE ARG A 57 5.715 26.166 24.129 1.00 0.00 H ATOM 909 HH12 ARG A 57 7.364 29.931 24.313 1.00 0.00 H ATOM 910 HH11 ARG A 57 5.619 29.612 23.998 1.00 0.00 H ATOM 911 HH22 ARG A 57 8.807 27.904 24.658 1.00 0.00 H ATOM 912 HH21 ARG A 57 7.978 26.308 24.565 1.00 0.00 H ATOM 913 H ARG A 57 6.077 27.597 19.578 1.00 0.00 H ATOM 914 N GLN A 58 4.115 31.089 18.922 1.00 11.44 N ATOM 915 CA GLN A 58 4.495 32.331 18.260 1.00 12.21 C ATOM 916 C GLN A 58 4.547 33.570 19.136 1.00 12.50 C ATOM 917 O GLN A 58 3.592 33.907 19.856 1.00 11.56 O ATOM 918 CB GLN A 58 3.542 32.546 17.095 1.00 12.97 C ATOM 919 CG GLN A 58 3.619 33.925 16.508 1.00 16.99 C ATOM 920 CD GLN A 58 2.558 34.153 15.444 1.00 18.78 C ATOM 921 OE1 GLN A 58 2.432 33.378 14.484 1.00 20.68 O ATOM 922 NE2 GLN A 58 1.794 35.225 15.647 1.00 20.66 N ATOM 923 HA GLN A 58 5.529 32.203 17.939 1.00 0.00 H ATOM 924 HB2 GLN A 58 3.782 31.824 16.314 1.00 0.00 H ATOM 925 HB3 GLN A 58 2.524 32.376 17.445 1.00 0.00 H ATOM 926 HG2 GLN A 58 3.480 34.655 17.305 1.00 0.00 H ATOM 927 HG3 GLN A 58 4.603 34.062 16.059 1.00 0.00 H ATOM 928 HE22 GLN A 58 1.958 35.831 16.476 1.00 0.00 H ATOM 929 HE21 GLN A 58 1.033 35.456 14.976 1.00 0.00 H ATOM 930 H GLN A 58 3.110 30.825 18.953 1.00 0.00 H ATOM 931 N TYR A 59 5.681 34.254 19.022 1.00 13.33 N ATOM 932 CA TYR A 59 5.974 35.501 19.721 1.00 14.86 C ATOM 933 C TYR A 59 6.247 36.583 18.683 1.00 15.64 C ATOM 934 O TYR A 59 6.845 36.194 17.683 1.00 16.78 O ATOM 935 CB TYR A 59 7.266 35.477 20.546 1.00 14.61 C ATOM 936 CG TYR A 59 7.127 34.584 21.742 1.00 14.70 C ATOM 937 CD1 TYR A 59 7.380 33.231 21.593 1.00 15.90 C ATOM 938 CD2 TYR A 59 6.725 35.076 22.970 1.00 14.76 C ATOM 939 CE1 TYR A 59 7.241 32.351 22.661 1.00 16.17 C ATOM 940 CE2 TYR A 59 6.575 34.209 24.032 1.00 15.36 C ATOM 941 CZ TYR A 59 6.828 32.869 23.870 1.00 15.66 C ATOM 942 OH TYR A 59 6.716 32.013 24.926 1.00 17.19 O ATOM 943 HA TYR A 59 5.115 35.669 20.371 1.00 0.00 H ATOM 944 HB3 TYR A 59 7.493 36.489 20.882 1.00 0.00 H ATOM 945 HB2 TYR A 59 8.081 35.111 19.921 1.00 0.00 H ATOM 946 HD2 TYR A 59 6.528 36.140 23.098 1.00 0.00 H ATOM 947 HE2 TYR A 59 6.255 34.588 25.002 1.00 0.00 H ATOM 948 HE1 TYR A 59 7.451 31.288 22.546 1.00 0.00 H ATOM 949 HD1 TYR A 59 7.694 32.849 20.622 1.00 0.00 H ATOM 950 HH TYR A 59 7.344 32.288 25.640 1.00 0.00 H ATOM 951 H TYR A 59 6.413 33.873 18.389 1.00 0.00 H ATOM 952 N ASP A 60 5.869 37.792 18.982 1.00 17.84 N ATOM 953 CA ASP A 60 6.066 38.912 18.061 1.00 19.66 C ATOM 954 C ASP A 60 6.914 40.034 18.637 1.00 19.33 C ATOM 955 O ASP A 60 7.197 40.101 19.826 1.00 19.55 O ATOM 956 CB ASP A 60 4.708 39.536 17.687 1.00 23.40 C ATOM 957 CG ASP A 60 3.803 38.661 16.885 1.00 26.39 C ATOM 958 OD1 ASP A 60 4.031 37.426 16.831 1.00 29.81 O ATOM 959 OD2 ASP A 60 2.834 39.159 16.275 1.00 28.74 O ATOM 960 HA ASP A 60 6.581 38.487 17.200 1.00 0.00 H ATOM 961 HB2 ASP A 60 4.192 39.798 18.611 1.00 0.00 H ATOM 962 HB3 ASP A 60 4.900 40.441 17.110 1.00 0.00 H ATOM 963 H ASP A 60 5.414 37.967 19.901 1.00 0.00 H ATOM 964 N GLN A 61 7.231 40.943 17.711 1.00 19.13 N ATOM 965 CA GLN A 61 8.017 42.128 18.091 1.00 18.13 C ATOM 966 C GLN A 61 9.127 41.673 19.057 1.00 17.38 C ATOM 967 O GLN A 61 9.341 42.321 20.082 1.00 17.65 O ATOM 968 CB GLN A 61 7.140 43.186 18.751 1.00 17.18 C ATOM 969 CG GLN A 61 5.852 43.521 18.022 1.00 15.99 C ATOM 970 CD GLN A 61 4.697 43.866 18.953 1.00 15.67 C ATOM 971 OE1 GLN A 61 3.535 43.545 18.643 1.00 12.82 O ATOM 972 NE2 GLN A 61 5.016 44.613 20.031 1.00 14.08 N ATOM 973 HA GLN A 61 8.449 42.580 17.199 1.00 0.00 H ATOM 974 HB2 GLN A 61 6.878 42.830 19.748 1.00 0.00 H ATOM 975 HB3 GLN A 61 7.725 44.102 18.835 1.00 0.00 H ATOM 976 HG2 GLN A 61 6.037 44.375 17.370 1.00 0.00 H ATOM 977 HG3 GLN A 61 5.563 42.660 17.418 1.00 0.00 H ATOM 978 HE22 GLN A 61 6.011 44.843 20.228 1.00 0.00 H ATOM 979 HE21 GLN A 61 4.267 44.959 20.664 1.00 0.00 H ATOM 980 H GLN A 61 6.924 40.814 16.726 1.00 0.00 H ATOM 981 N ILE A 62 9.731 40.562 18.666 1.00 16.23 N ATOM 982 CA ILE A 62 10.891 39.958 19.311 1.00 15.12 C ATOM 983 C ILE A 62 12.180 40.461 18.652 1.00 16.74 C ATOM 984 O ILE A 62 12.276 40.477 17.396 1.00 18.07 O ATOM 985 CB ILE A 62 10.843 38.442 19.203 1.00 12.64 C ATOM 986 CG1 ILE A 62 9.992 37.867 20.359 1.00 12.91 C ATOM 987 CG2 ILE A 62 12.241 37.876 19.265 1.00 12.61 C ATOM 988 CD1 ILE A 62 10.760 37.844 21.662 1.00 10.78 C ATOM 989 HA ILE A 62 10.875 40.242 20.363 1.00 0.00 H ATOM 990 HB ILE A 62 10.392 38.165 18.250 1.00 0.00 H ATOM 991 HG12 ILE A 62 9.102 38.484 20.484 1.00 0.00 H ATOM 992 HG13 ILE A 62 9.694 36.849 20.106 1.00 0.00 H ATOM 993 HD11 ILE A 62 11.648 37.223 21.548 1.00 0.00 H ATOM 994 HD12 ILE A 62 11.056 38.859 21.926 1.00 0.00 H ATOM 995 HD13 ILE A 62 10.127 37.433 22.448 1.00 0.00 H ATOM 996 HG21 ILE A 62 12.831 38.277 18.440 1.00 0.00 H ATOM 997 HG22 ILE A 62 12.703 38.154 20.212 1.00 0.00 H ATOM 998 HG23 ILE A 62 12.196 36.790 19.187 1.00 0.00 H ATOM 999 H ILE A 62 9.346 40.080 17.829 1.00 0.00 H ATOM 1000 N LEU A 63 13.188 40.845 19.433 1.00 16.83 N ATOM 1001 CA LEU A 63 14.424 41.364 18.835 1.00 16.77 C ATOM 1002 C LEU A 63 15.535 40.321 18.805 1.00 17.05 C ATOM 1003 O LEU A 63 15.734 39.807 19.905 1.00 16.95 O ATOM 1004 CB LEU A 63 14.925 42.533 19.698 1.00 17.09 C ATOM 1005 CG LEU A 63 16.298 43.125 19.349 1.00 17.27 C ATOM 1006 CD1 LEU A 63 16.208 43.838 18.001 1.00 17.24 C ATOM 1007 CD2 LEU A 63 16.752 44.130 20.407 1.00 16.70 C ATOM 1008 HA LEU A 63 14.195 41.663 17.812 1.00 0.00 H ATOM 1009 HB2 LEU A 63 14.192 43.336 19.620 1.00 0.00 H ATOM 1010 HB3 LEU A 63 14.971 42.183 20.729 1.00 0.00 H ATOM 1011 HG LEU A 63 17.021 42.311 19.308 1.00 0.00 H ATOM 1012 HD21 LEU A 63 16.028 44.942 20.469 1.00 0.00 H ATOM 1013 HD22 LEU A 63 16.823 43.631 21.373 1.00 0.00 H ATOM 1014 HD23 LEU A 63 17.727 44.531 20.131 1.00 0.00 H ATOM 1015 HD11 LEU A 63 15.910 43.124 17.233 1.00 0.00 H ATOM 1016 HD12 LEU A 63 15.469 44.637 18.063 1.00 0.00 H ATOM 1017 HD13 LEU A 63 17.181 44.260 17.749 1.00 0.00 H ATOM 1018 H LEU A 63 13.099 40.777 20.467 1.00 0.00 H ATOM 1019 N ILE A 64 16.192 40.125 17.671 1.00 16.95 N ATOM 1020 CA ILE A 64 17.319 39.237 17.473 1.00 17.26 C ATOM 1021 C ILE A 64 18.499 40.049 16.861 1.00 18.40 C ATOM 1022 O ILE A 64 18.315 41.079 16.244 1.00 19.07 O ATOM 1023 CB ILE A 64 17.199 38.030 16.557 1.00 15.55 C ATOM 1024 CG1 ILE A 64 16.073 37.043 16.888 1.00 13.95 C ATOM 1025 CG2 ILE A 64 18.456 37.108 16.576 1.00 15.20 C ATOM 1026 CD1 ILE A 64 16.301 35.856 15.947 1.00 14.15 C ATOM 1027 HA ILE A 64 17.436 38.838 18.481 1.00 0.00 H ATOM 1028 HB ILE A 64 17.026 38.535 15.606 1.00 0.00 H ATOM 1029 HG12 ILE A 64 16.135 36.725 17.929 1.00 0.00 H ATOM 1030 HG13 ILE A 64 15.099 37.496 16.705 1.00 0.00 H ATOM 1031 HD11 ILE A 64 16.247 36.198 14.913 1.00 0.00 H ATOM 1032 HD12 ILE A 64 17.284 35.426 16.138 1.00 0.00 H ATOM 1033 HD13 ILE A 64 15.533 35.102 16.122 1.00 0.00 H ATOM 1034 HG21 ILE A 64 19.328 37.678 16.254 1.00 0.00 H ATOM 1035 HG22 ILE A 64 18.617 36.736 17.588 1.00 0.00 H ATOM 1036 HG23 ILE A 64 18.299 36.268 15.899 1.00 0.00 H ATOM 1037 H ILE A 64 15.866 40.662 16.842 1.00 0.00 H ATOM 1038 N GLU A 65 19.666 39.454 17.032 1.00 19.50 N ATOM 1039 CA GLU A 65 20.896 40.010 16.520 1.00 21.35 C ATOM 1040 C GLU A 65 21.664 38.974 15.698 1.00 21.79 C ATOM 1041 O GLU A 65 22.162 38.031 16.311 1.00 22.58 O ATOM 1042 CB GLU A 65 21.781 40.478 17.677 1.00 23.19 C ATOM 1043 CG GLU A 65 23.201 40.790 17.210 1.00 26.33 C ATOM 1044 CD GLU A 65 23.994 41.543 18.276 1.00 27.99 C ATOM 1045 OE1 GLU A 65 23.335 42.263 19.069 1.00 29.43 O ATOM 1046 OE2 GLU A 65 25.238 41.392 18.275 1.00 27.79 O ATOM 1047 HA GLU A 65 20.641 40.855 15.880 1.00 0.00 H ATOM 1048 HB2 GLU A 65 21.346 41.377 18.113 1.00 0.00 H ATOM 1049 HB3 GLU A 65 21.821 39.693 18.432 1.00 0.00 H ATOM 1050 HG2 GLU A 65 23.712 39.854 16.984 1.00 0.00 H ATOM 1051 HG3 GLU A 65 23.150 41.402 16.309 1.00 0.00 H ATOM 1052 H GLU A 65 19.700 38.555 17.553 1.00 0.00 H ATOM 1053 N ILE A 66 21.743 39.201 14.405 1.00 21.96 N ATOM 1054 CA ILE A 66 22.439 38.327 13.473 1.00 22.24 C ATOM 1055 C ILE A 66 23.714 38.964 12.949 1.00 23.58 C ATOM 1056 O ILE A 66 23.636 39.863 12.101 1.00 25.15 O ATOM 1057 CB ILE A 66 21.547 37.900 12.298 1.00 20.26 C ATOM 1058 CG1 ILE A 66 20.305 37.165 12.828 1.00 19.88 C ATOM 1059 CG2 ILE A 66 22.275 36.954 11.359 1.00 20.02 C ATOM 1060 CD1 ILE A 66 19.209 38.160 13.164 1.00 19.81 C ATOM 1061 HA ILE A 66 22.703 37.433 14.038 1.00 0.00 H ATOM 1062 HB ILE A 66 21.270 38.805 11.757 1.00 0.00 H ATOM 1063 HG12 ILE A 66 19.943 36.474 12.067 1.00 0.00 H ATOM 1064 HG13 ILE A 66 20.572 36.607 13.725 1.00 0.00 H ATOM 1065 HD11 ILE A 66 19.568 38.850 13.927 1.00 0.00 H ATOM 1066 HD12 ILE A 66 18.938 38.717 12.267 1.00 0.00 H ATOM 1067 HD13 ILE A 66 18.336 37.625 13.538 1.00 0.00 H ATOM 1068 HG21 ILE A 66 23.159 37.451 10.958 1.00 0.00 H ATOM 1069 HG22 ILE A 66 22.575 36.061 11.906 1.00 0.00 H ATOM 1070 HG23 ILE A 66 21.611 36.674 10.541 1.00 0.00 H ATOM 1071 H ILE A 66 21.282 40.053 14.027 1.00 0.00 H ATOM 1072 N CYS A 67 24.851 38.522 13.450 1.00 24.79 N ATOM 1073 CA CYS A 67 26.140 39.077 13.006 1.00 26.18 C ATOM 1074 C CYS A 67 26.242 40.583 13.160 1.00 26.63 C ATOM 1075 O CYS A 67 26.691 41.290 12.241 1.00 27.64 O ATOM 1076 CB CYS A 67 26.285 38.695 11.511 1.00 26.96 C ATOM 1077 SG CYS A 67 26.823 36.978 11.320 1.00 29.05 S ATOM 1078 HA CYS A 67 26.934 38.667 13.630 1.00 0.00 H ATOM 1079 HB2 CYS A 67 27.020 39.352 11.046 1.00 0.00 H ATOM 1080 HB3 CYS A 67 25.322 38.823 11.017 1.00 0.00 H ATOM 1081 HG CYS A 67 26.939 36.681 9.977 1.00 0.00 H ATOM 1082 H CYS A 67 24.837 37.771 14.169 1.00 0.00 H ATOM 1083 N GLY A 68 25.850 41.104 14.307 1.00 26.73 N ATOM 1084 CA GLY A 68 25.893 42.549 14.575 1.00 25.84 C ATOM 1085 C GLY A 68 24.463 43.074 14.459 1.00 26.57 C ATOM 1086 O GLY A 68 23.758 43.287 15.453 1.00 26.59 O ATOM 1087 HA3 GLY A 68 26.533 43.045 13.846 1.00 0.00 H ATOM 1088 HA2 GLY A 68 26.278 42.732 15.578 1.00 0.00 H ATOM 1089 H GLY A 68 25.497 40.468 15.050 1.00 0.00 H ATOM 1090 N HIS A 69 24.060 43.225 13.213 1.00 26.35 N ATOM 1091 CA HIS A 69 22.735 43.725 12.902 1.00 26.89 C ATOM 1092 C HIS A 69 21.612 43.145 13.784 1.00 25.95 C ATOM 1093 O HIS A 69 21.496 41.960 14.094 1.00 26.09 O ATOM 1094 CB HIS A 69 22.347 43.523 11.435 1.00 29.04 C ATOM 1095 CG HIS A 69 23.507 43.365 10.512 1.00 30.76 C ATOM 1096 ND1 HIS A 69 24.532 42.470 10.787 1.00 31.59 N ATOM 1097 CD2 HIS A 69 23.804 43.965 9.336 1.00 31.44 C ATOM 1098 CE1 HIS A 69 25.410 42.497 9.804 1.00 31.87 C ATOM 1099 NE2 HIS A 69 24.990 43.398 8.910 1.00 33.20 N ATOM 1100 HA HIS A 69 22.820 44.790 13.116 1.00 0.00 H ATOM 1101 HB2 HIS A 69 21.729 42.628 11.365 1.00 0.00 H ATOM 1102 HB3 HIS A 69 21.768 44.388 11.112 1.00 0.00 H ATOM 1103 HD2 HIS A 69 23.226 44.737 8.829 1.00 0.00 H ATOM 1104 HE1 HIS A 69 26.315 41.894 9.733 1.00 0.00 H ATOM 1105 H HIS A 69 24.707 42.980 12.436 1.00 0.00 H ATOM 1106 N LYS A 70 20.773 44.091 14.142 1.00 23.45 N ATOM 1107 CA LYS A 70 19.560 44.041 14.869 1.00 21.38 C ATOM 1108 C LYS A 70 18.402 43.928 13.836 1.00 20.07 C ATOM 1109 O LYS A 70 18.324 44.718 12.897 1.00 18.84 O ATOM 1110 CB LYS A 70 19.283 45.382 15.575 1.00 23.18 C ATOM 1111 CG LYS A 70 19.898 45.560 16.938 1.00 25.09 C ATOM 1112 CD LYS A 70 21.360 45.178 16.902 1.00 27.75 C ATOM 1113 CE LYS A 70 22.119 46.018 15.864 1.00 29.90 C ATOM 1114 NZ LYS A 70 23.594 46.023 16.200 1.00 30.00 N ATOM 1115 HA LYS A 70 19.626 43.218 15.580 1.00 0.00 H ATOM 1116 HB2 LYS A 70 19.660 46.179 14.934 1.00 0.00 H ATOM 1117 HB3 LYS A 70 18.203 45.484 15.682 1.00 0.00 H ATOM 1118 HG2 LYS A 70 19.805 46.602 17.243 1.00 0.00 H ATOM 1119 HG3 LYS A 70 19.377 44.925 17.655 1.00 0.00 H ATOM 1120 HD2 LYS A 70 21.798 45.345 17.886 1.00 0.00 H ATOM 1121 HD3 LYS A 70 21.448 44.123 16.641 1.00 0.00 H ATOM 1122 HE2 LYS A 70 21.740 47.040 15.876 1.00 0.00 H ATOM 1123 HE3 LYS A 70 21.973 45.589 14.873 1.00 0.00 H ATOM 1124 HZ1 LYS A 70 23.731 46.433 17.146 1.00 0.00 H ATOM 1125 HZ2 LYS A 70 23.954 45.048 16.188 1.00 0.00 H ATOM 1126 HZ3 LYS A 70 24.107 46.592 15.496 1.00 0.00 H ATOM 1127 H LYS A 70 21.050 45.046 13.837 1.00 0.00 H ATOM 1128 N ALA A 71 17.543 42.980 14.136 1.00 17.74 N ATOM 1129 CA ALA A 71 16.339 42.790 13.318 1.00 15.74 C ATOM 1130 C ALA A 71 15.180 42.633 14.304 1.00 13.97 C ATOM 1131 O ALA A 71 15.438 42.324 15.468 1.00 13.10 O ATOM 1132 CB ALA A 71 16.545 41.544 12.467 1.00 17.79 C ATOM 1133 HA ALA A 71 16.131 43.620 12.643 1.00 0.00 H ATOM 1134 HB1 ALA A 71 17.418 41.682 11.829 1.00 0.00 H ATOM 1135 HB2 ALA A 71 16.700 40.683 13.117 1.00 0.00 H ATOM 1136 HB3 ALA A 71 15.663 41.379 11.848 1.00 0.00 H ATOM 1137 H ALA A 71 17.717 42.363 14.955 1.00 0.00 H ATOM 1138 N ILE A 72 13.970 42.879 13.850 1.00 12.37 N ATOM 1139 CA ILE A 72 12.788 42.688 14.684 1.00 11.64 C ATOM 1140 C ILE A 72 11.868 41.729 13.936 1.00 11.27 C ATOM 1141 O ILE A 72 11.831 41.816 12.698 1.00 12.95 O ATOM 1142 CB ILE A 72 12.019 43.962 15.002 1.00 12.11 C ATOM 1143 CG1 ILE A 72 12.747 44.720 16.132 1.00 12.43 C ATOM 1144 CG2 ILE A 72 10.575 43.720 15.382 1.00 11.71 C ATOM 1145 CD1 ILE A 72 14.113 45.171 15.625 1.00 14.07 C ATOM 1146 HA ILE A 72 13.125 42.305 15.647 1.00 0.00 H ATOM 1147 HB ILE A 72 11.993 44.558 14.090 1.00 0.00 H ATOM 1148 HG12 ILE A 72 12.160 45.590 16.426 1.00 0.00 H ATOM 1149 HG13 ILE A 72 12.875 44.062 16.991 1.00 0.00 H ATOM 1150 HD11 ILE A 72 14.696 44.298 15.331 1.00 0.00 H ATOM 1151 HD12 ILE A 72 13.981 45.828 14.765 1.00 0.00 H ATOM 1152 HD13 ILE A 72 14.634 45.708 16.418 1.00 0.00 H ATOM 1153 HG21 ILE A 72 10.061 43.227 14.557 1.00 0.00 H ATOM 1154 HG22 ILE A 72 10.535 43.086 16.268 1.00 0.00 H ATOM 1155 HG23 ILE A 72 10.092 44.674 15.594 1.00 0.00 H ATOM 1156 H ILE A 72 13.853 43.218 12.874 1.00 0.00 H ATOM 1157 N GLY A 73 11.187 40.867 14.663 1.00 9.50 N ATOM 1158 CA GLY A 73 10.249 40.013 13.929 1.00 8.76 C ATOM 1159 C GLY A 73 9.576 39.055 14.890 1.00 8.48 C ATOM 1160 O GLY A 73 9.868 39.042 16.067 1.00 9.03 O ATOM 1161 HA3 GLY A 73 10.790 39.447 13.171 1.00 0.00 H ATOM 1162 HA2 GLY A 73 9.494 40.634 13.447 1.00 0.00 H ATOM 1163 H GLY A 73 11.307 40.797 15.694 1.00 0.00 H ATOM 1164 N THR A 74 8.680 38.309 14.283 1.00 7.99 N ATOM 1165 CA THR A 74 8.006 37.206 14.949 1.00 7.93 C ATOM 1166 C THR A 74 9.102 36.122 14.979 1.00 8.27 C ATOM 1167 O THR A 74 10.003 36.185 14.111 1.00 8.51 O ATOM 1168 CB THR A 74 6.866 36.732 14.033 1.00 8.56 C ATOM 1169 OG1 THR A 74 5.751 37.584 14.374 1.00 12.82 O ATOM 1170 CG2 THR A 74 6.582 35.281 14.241 1.00 7.58 C ATOM 1171 HA THR A 74 7.596 37.446 15.930 1.00 0.00 H ATOM 1172 HB THR A 74 7.107 36.812 12.973 1.00 0.00 H ATOM 1173 HG1 THR A 74 5.529 37.467 15.332 1.00 0.00 H ATOM 1174 HG23 THR A 74 7.460 34.697 13.966 1.00 0.00 H ATOM 1175 HG21 THR A 74 6.341 35.106 15.290 1.00 0.00 H ATOM 1176 HG22 THR A 74 5.738 34.984 13.619 1.00 0.00 H ATOM 1177 H THR A 74 8.445 38.515 13.291 1.00 0.00 H ATOM 1178 N VAL A 75 9.001 35.240 15.915 1.00 6.96 N ATOM 1179 CA VAL A 75 9.985 34.135 16.104 1.00 6.55 C ATOM 1180 C VAL A 75 9.106 33.050 16.705 1.00 6.33 C ATOM 1181 O VAL A 75 8.254 33.511 17.466 1.00 6.69 O ATOM 1182 CB VAL A 75 11.078 34.643 17.030 1.00 6.90 C ATOM 1183 CG1 VAL A 75 12.124 33.633 17.427 1.00 6.56 C ATOM 1184 CG2 VAL A 75 11.744 35.845 16.346 1.00 6.25 C ATOM 1185 HA VAL A 75 10.508 33.771 15.219 1.00 0.00 H ATOM 1186 HB VAL A 75 10.593 34.906 17.970 1.00 0.00 H ATOM 1187 HG11 VAL A 75 11.646 32.802 17.946 1.00 0.00 H ATOM 1188 HG12 VAL A 75 12.628 33.264 16.534 1.00 0.00 H ATOM 1189 HG13 VAL A 75 12.851 34.105 18.087 1.00 0.00 H ATOM 1190 HG21 VAL A 75 12.169 35.530 15.393 1.00 0.00 H ATOM 1191 HG22 VAL A 75 10.999 36.622 16.174 1.00 0.00 H ATOM 1192 HG23 VAL A 75 12.535 36.234 16.987 1.00 0.00 H ATOM 1193 H VAL A 75 8.195 35.302 16.569 1.00 0.00 H ATOM 1194 N LEU A 76 9.176 31.845 16.229 1.00 6.17 N ATOM 1195 CA LEU A 76 8.367 30.693 16.662 1.00 4.66 C ATOM 1196 C LEU A 76 9.293 29.846 17.505 1.00 3.96 C ATOM 1197 O LEU A 76 10.472 29.767 17.122 1.00 4.12 O ATOM 1198 CB LEU A 76 7.908 29.907 15.428 1.00 5.35 C ATOM 1199 CG LEU A 76 7.509 30.825 14.255 1.00 5.17 C ATOM 1200 CD1 LEU A 76 7.209 30.057 12.981 1.00 6.88 C ATOM 1201 CD2 LEU A 76 6.264 31.605 14.625 1.00 5.67 C ATOM 1202 HA LEU A 76 7.479 30.992 17.219 1.00 0.00 H ATOM 1203 HB2 LEU A 76 8.722 29.259 15.103 1.00 0.00 H ATOM 1204 HB3 LEU A 76 7.048 29.297 15.703 1.00 0.00 H ATOM 1205 HG LEU A 76 8.360 31.481 14.070 1.00 0.00 H ATOM 1206 HD21 LEU A 76 5.451 30.910 14.836 1.00 0.00 H ATOM 1207 HD22 LEU A 76 6.465 32.210 15.509 1.00 0.00 H ATOM 1208 HD23 LEU A 76 5.983 32.253 13.795 1.00 0.00 H ATOM 1209 HD11 LEU A 76 8.094 29.497 12.679 1.00 0.00 H ATOM 1210 HD12 LEU A 76 6.384 29.367 13.160 1.00 0.00 H ATOM 1211 HD13 LEU A 76 6.934 30.757 12.192 1.00 0.00 H ATOM 1212 H LEU A 76 9.868 31.677 15.471 1.00 0.00 H ATOM 1213 N VAL A 77 8.818 29.392 18.620 1.00 4.36 N ATOM 1214 CA VAL A 77 9.681 28.578 19.538 1.00 5.28 C ATOM 1215 C VAL A 77 9.095 27.187 19.589 1.00 6.40 C ATOM 1216 O VAL A 77 7.827 27.118 19.529 1.00 8.46 O ATOM 1217 CB VAL A 77 9.719 29.247 20.915 1.00 4.31 C ATOM 1218 CG1 VAL A 77 10.192 28.276 21.966 1.00 2.89 C ATOM 1219 CG2 VAL A 77 10.554 30.514 20.831 1.00 2.14 C ATOM 1220 HA VAL A 77 10.711 28.514 19.186 1.00 0.00 H ATOM 1221 HB VAL A 77 8.716 29.543 21.222 1.00 0.00 H ATOM 1222 HG11 VAL A 77 9.512 27.425 22.006 1.00 0.00 H ATOM 1223 HG12 VAL A 77 11.194 27.930 21.714 1.00 0.00 H ATOM 1224 HG13 VAL A 77 10.211 28.773 22.936 1.00 0.00 H ATOM 1225 HG21 VAL A 77 11.567 30.260 20.519 1.00 0.00 H ATOM 1226 HG22 VAL A 77 10.108 31.194 20.105 1.00 0.00 H ATOM 1227 HG23 VAL A 77 10.584 30.994 21.809 1.00 0.00 H ATOM 1228 H VAL A 77 7.832 29.593 18.881 1.00 0.00 H ATOM 1229 N GLY A 78 9.916 26.153 19.626 1.00 5.94 N ATOM 1230 CA GLY A 78 9.390 24.796 19.624 1.00 5.21 C ATOM 1231 C GLY A 78 10.426 23.738 19.281 1.00 6.73 C ATOM 1232 O GLY A 78 11.647 24.027 19.291 1.00 6.11 O ATOM 1233 HA3 GLY A 78 8.585 24.740 18.891 1.00 0.00 H ATOM 1234 HA2 GLY A 78 8.992 24.580 20.616 1.00 0.00 H ATOM 1235 H GLY A 78 10.944 26.309 19.657 1.00 0.00 H ATOM 1236 N PRO A 79 9.877 22.548 18.973 1.00 6.81 N ATOM 1237 CA PRO A 79 10.625 21.363 18.667 1.00 8.21 C ATOM 1238 C PRO A 79 11.430 21.261 17.393 1.00 10.01 C ATOM 1239 O PRO A 79 11.396 20.164 16.752 1.00 10.68 O ATOM 1240 CB PRO A 79 9.624 20.208 18.715 1.00 7.88 C ATOM 1241 CG PRO A 79 8.308 20.796 19.156 1.00 7.22 C ATOM 1242 CD PRO A 79 8.435 22.276 19.043 1.00 6.54 C ATOM 1243 HA PRO A 79 11.423 21.359 19.410 1.00 0.00 H ATOM 1244 HD3 PRO A 79 7.937 22.633 18.142 1.00 0.00 H ATOM 1245 HD2 PRO A 79 7.998 22.763 19.915 1.00 0.00 H ATOM 1246 HG3 PRO A 79 8.099 20.515 20.188 1.00 0.00 H ATOM 1247 HG2 PRO A 79 7.503 20.438 18.513 1.00 0.00 H ATOM 1248 HB2 PRO A 79 9.523 19.757 17.728 1.00 0.00 H ATOM 1249 HB3 PRO A 79 9.956 19.452 19.427 1.00 0.00 H ATOM 1250 N THR A 80 12.191 22.295 17.070 1.00 10.23 N ATOM 1251 CA THR A 80 13.097 22.235 15.896 1.00 10.39 C ATOM 1252 C THR A 80 14.402 21.636 16.427 1.00 11.74 C ATOM 1253 O THR A 80 14.727 21.934 17.598 1.00 12.13 O ATOM 1254 CB THR A 80 13.387 23.632 15.310 1.00 8.82 C ATOM 1255 OG1 THR A 80 14.507 23.506 14.419 1.00 7.36 O ATOM 1256 CG2 THR A 80 13.797 24.651 16.370 1.00 8.86 C ATOM 1257 HA THR A 80 12.643 21.650 15.096 1.00 0.00 H ATOM 1258 HB THR A 80 12.473 23.978 14.827 1.00 0.00 H ATOM 1259 HG1 THR A 80 14.716 24.391 14.027 1.00 0.00 H ATOM 1260 HG23 THR A 80 12.979 24.787 17.077 1.00 0.00 H ATOM 1261 HG21 THR A 80 14.679 24.289 16.898 1.00 0.00 H ATOM 1262 HG22 THR A 80 14.024 25.602 15.889 1.00 0.00 H ATOM 1263 H THR A 80 12.153 23.160 17.646 1.00 0.00 H ATOM 1264 N PRO A 81 15.101 20.863 15.626 1.00 12.69 N ATOM 1265 CA PRO A 81 16.374 20.253 16.031 1.00 13.07 C ATOM 1266 C PRO A 81 17.564 21.113 15.698 1.00 13.12 C ATOM 1267 O PRO A 81 18.727 20.759 15.955 1.00 14.50 O ATOM 1268 CB PRO A 81 16.385 18.957 15.201 1.00 13.93 C ATOM 1269 CG PRO A 81 15.760 19.386 13.886 1.00 13.93 C ATOM 1270 CD PRO A 81 14.734 20.472 14.257 1.00 13.45 C ATOM 1271 HA PRO A 81 16.446 20.103 17.108 1.00 0.00 H ATOM 1272 HD3 PRO A 81 14.808 21.322 13.579 1.00 0.00 H ATOM 1273 HD2 PRO A 81 13.720 20.073 14.227 1.00 0.00 H ATOM 1274 HG3 PRO A 81 15.266 18.542 13.405 1.00 0.00 H ATOM 1275 HG2 PRO A 81 16.519 19.791 13.217 1.00 0.00 H ATOM 1276 HB2 PRO A 81 17.403 18.596 15.052 1.00 0.00 H ATOM 1277 HB3 PRO A 81 15.792 18.179 15.681 1.00 0.00 H ATOM 1278 N VAL A 82 17.279 22.239 15.081 1.00 12.95 N ATOM 1279 CA VAL A 82 18.263 23.270 14.718 1.00 11.85 C ATOM 1280 C VAL A 82 17.484 24.597 14.600 1.00 11.12 C ATOM 1281 O VAL A 82 16.376 24.635 14.049 1.00 10.70 O ATOM 1282 CB VAL A 82 19.090 23.022 13.462 1.00 12.24 C ATOM 1283 CG1 VAL A 82 18.250 22.438 12.352 1.00 11.77 C ATOM 1284 CG2 VAL A 82 19.748 24.259 12.845 1.00 11.89 C ATOM 1285 HA VAL A 82 19.020 23.275 15.502 1.00 0.00 H ATOM 1286 HB VAL A 82 19.864 22.346 13.826 1.00 0.00 H ATOM 1287 HG11 VAL A 82 17.826 21.489 12.680 1.00 0.00 H ATOM 1288 HG12 VAL A 82 17.445 23.130 12.104 1.00 0.00 H ATOM 1289 HG13 VAL A 82 18.874 22.275 11.473 1.00 0.00 H ATOM 1290 HG21 VAL A 82 18.978 24.978 12.567 1.00 0.00 H ATOM 1291 HG22 VAL A 82 20.423 24.710 13.572 1.00 0.00 H ATOM 1292 HG23 VAL A 82 20.310 23.966 11.958 1.00 0.00 H ATOM 1293 H VAL A 82 16.285 22.413 14.831 1.00 0.00 H ATOM 1294 N ASN A 83 18.122 25.590 15.177 1.00 9.00 N ATOM 1295 CA ASN A 83 17.623 26.950 15.163 1.00 8.65 C ATOM 1296 C ASN A 83 17.691 27.502 13.737 1.00 8.57 C ATOM 1297 O ASN A 83 18.774 27.549 13.118 1.00 9.20 O ATOM 1298 CB ASN A 83 18.614 27.759 15.995 1.00 11.48 C ATOM 1299 CG ASN A 83 18.404 27.636 17.477 1.00 12.67 C ATOM 1300 OD1 ASN A 83 17.352 27.177 17.895 1.00 13.76 O ATOM 1301 ND2 ASN A 83 19.443 28.090 18.192 1.00 14.88 N ATOM 1302 HA ASN A 83 16.599 26.997 15.534 1.00 0.00 H ATOM 1303 HB2 ASN A 83 19.621 27.415 15.761 1.00 0.00 H ATOM 1304 HB3 ASN A 83 18.517 28.809 15.720 1.00 0.00 H ATOM 1305 HD22 ASN A 83 20.287 28.458 17.708 1.00 0.00 H ATOM 1306 HD21 ASN A 83 19.406 28.074 19.231 1.00 0.00 H ATOM 1307 H ASN A 83 19.020 25.392 15.663 1.00 0.00 H ATOM 1308 N ILE A 84 16.600 28.024 13.267 1.00 7.42 N ATOM 1309 CA ILE A 84 16.480 28.540 11.899 1.00 6.53 C ATOM 1310 C ILE A 84 16.153 30.013 11.806 1.00 6.44 C ATOM 1311 O ILE A 84 15.250 30.551 12.467 1.00 5.60 O ATOM 1312 CB ILE A 84 15.325 27.661 11.313 1.00 5.26 C ATOM 1313 CG1 ILE A 84 15.845 26.245 11.065 1.00 2.90 C ATOM 1314 CG2 ILE A 84 14.658 28.272 10.104 1.00 5.80 C ATOM 1315 CD1 ILE A 84 14.651 25.245 11.069 1.00 1.77 C ATOM 1316 HA ILE A 84 17.426 28.474 11.361 1.00 0.00 H ATOM 1317 HB ILE A 84 14.526 27.611 12.052 1.00 0.00 H ATOM 1318 HG12 ILE A 84 16.348 26.206 10.099 1.00 0.00 H ATOM 1319 HG13 ILE A 84 16.549 25.973 11.851 1.00 0.00 H ATOM 1320 HD11 ILE A 84 14.149 25.284 12.036 1.00 0.00 H ATOM 1321 HD12 ILE A 84 13.948 25.517 10.282 1.00 0.00 H ATOM 1322 HD13 ILE A 84 15.023 24.236 10.892 1.00 0.00 H ATOM 1323 HG21 ILE A 84 14.229 29.237 10.376 1.00 0.00 H ATOM 1324 HG22 ILE A 84 15.397 28.411 9.314 1.00 0.00 H ATOM 1325 HG23 ILE A 84 13.868 27.608 9.752 1.00 0.00 H ATOM 1326 H ILE A 84 15.770 28.079 13.891 1.00 0.00 H ATOM 1327 N ILE A 85 16.896 30.708 10.961 1.00 7.16 N ATOM 1328 CA ILE A 85 16.633 32.166 10.743 1.00 7.22 C ATOM 1329 C ILE A 85 15.940 32.176 9.379 1.00 7.28 C ATOM 1330 O ILE A 85 16.570 31.591 8.495 1.00 8.87 O ATOM 1331 CB ILE A 85 17.846 33.069 10.695 1.00 5.66 C ATOM 1332 CG1 ILE A 85 18.649 33.097 12.001 1.00 2.16 C ATOM 1333 CG2 ILE A 85 17.393 34.474 10.309 1.00 5.28 C ATOM 1334 CD1 ILE A 85 17.835 33.554 13.165 1.00 2.36 C ATOM 1335 HA ILE A 85 16.066 32.566 11.584 1.00 0.00 H ATOM 1336 HB ILE A 85 18.528 32.663 9.947 1.00 0.00 H ATOM 1337 HG12 ILE A 85 19.018 32.092 12.206 1.00 0.00 H ATOM 1338 HG13 ILE A 85 19.494 33.775 11.877 1.00 0.00 H ATOM 1339 HD11 ILE A 85 17.467 34.562 12.976 1.00 0.00 H ATOM 1340 HD12 ILE A 85 16.991 32.878 13.304 1.00 0.00 H ATOM 1341 HD13 ILE A 85 18.454 33.554 14.062 1.00 0.00 H ATOM 1342 HG21 ILE A 85 16.914 34.444 9.331 1.00 0.00 H ATOM 1343 HG22 ILE A 85 16.685 34.843 11.051 1.00 0.00 H ATOM 1344 HG23 ILE A 85 18.258 35.136 10.271 1.00 0.00 H ATOM 1345 H ILE A 85 17.668 30.239 10.445 1.00 0.00 H ATOM 1346 N GLY A 86 14.735 32.692 9.317 1.00 7.31 N ATOM 1347 CA GLY A 86 14.009 32.595 8.037 1.00 6.82 C ATOM 1348 C GLY A 86 13.976 33.916 7.315 1.00 7.85 C ATOM 1349 O GLY A 86 14.704 34.837 7.666 1.00 8.23 O ATOM 1350 HA3 GLY A 86 12.986 32.274 8.234 1.00 0.00 H ATOM 1351 HA2 GLY A 86 14.504 31.858 7.404 1.00 0.00 H ATOM 1352 H GLY A 86 14.306 33.154 10.144 1.00 0.00 H ATOM 1353 N ARG A 87 13.089 33.949 6.320 1.00 8.16 N ATOM 1354 CA ARG A 87 12.970 35.122 5.468 1.00 8.29 C ATOM 1355 C ARG A 87 12.619 36.396 6.214 1.00 8.90 C ATOM 1356 O ARG A 87 13.200 37.462 5.937 1.00 8.64 O ATOM 1357 CB ARG A 87 12.046 34.778 4.285 1.00 7.54 C ATOM 1358 CG ARG A 87 12.802 34.000 3.239 1.00 6.97 C ATOM 1359 CD ARG A 87 12.083 33.675 1.973 1.00 6.31 C ATOM 1360 NE ARG A 87 10.700 33.338 2.189 1.00 6.71 N ATOM 1361 CZ ARG A 87 9.683 34.174 2.192 1.00 7.75 C ATOM 1362 NH1 ARG A 87 9.893 35.454 1.935 1.00 8.44 N ATOM 1363 NH2 ARG A 87 8.422 33.754 2.370 1.00 7.25 N ATOM 1364 HA ARG A 87 13.951 35.371 5.063 1.00 0.00 H ATOM 1365 HB2 ARG A 87 11.209 34.179 4.644 1.00 0.00 H ATOM 1366 HB3 ARG A 87 11.668 35.700 3.844 1.00 0.00 H ATOM 1367 HG2 ARG A 87 13.685 34.581 2.974 1.00 0.00 H ATOM 1368 HG3 ARG A 87 13.111 33.058 3.691 1.00 0.00 H ATOM 1369 HD2 ARG A 87 12.578 32.828 1.498 1.00 0.00 H ATOM 1370 HD3 ARG A 87 12.132 34.540 1.312 1.00 0.00 H ATOM 1371 HE ARG A 87 10.483 32.335 2.359 1.00 0.00 H ATOM 1372 HH12 ARG A 87 9.096 36.122 1.935 1.00 0.00 H ATOM 1373 HH11 ARG A 87 10.855 35.793 1.733 1.00 0.00 H ATOM 1374 HH22 ARG A 87 7.640 34.440 2.367 1.00 0.00 H ATOM 1375 HH21 ARG A 87 8.226 32.742 2.511 1.00 0.00 H ATOM 1376 H ARG A 87 12.475 33.127 6.151 1.00 0.00 H ATOM 1377 N ASN A 88 11.723 36.257 7.170 1.00 8.41 N ATOM 1378 CA ASN A 88 11.198 37.283 8.038 1.00 8.02 C ATOM 1379 C ASN A 88 12.245 38.159 8.710 1.00 7.59 C ATOM 1380 O ASN A 88 11.950 39.371 8.926 1.00 8.39 O ATOM 1381 CB ASN A 88 10.207 36.645 9.010 1.00 8.97 C ATOM 1382 CG ASN A 88 10.737 36.288 10.363 1.00 9.11 C ATOM 1383 OD1 ASN A 88 11.437 35.289 10.542 1.00 9.11 O ATOM 1384 ND2 ASN A 88 10.382 37.106 11.365 1.00 10.56 N ATOM 1385 HA ASN A 88 10.671 38.006 7.415 1.00 0.00 H ATOM 1386 HB2 ASN A 88 9.383 37.345 9.150 1.00 0.00 H ATOM 1387 HB3 ASN A 88 9.832 35.731 8.549 1.00 0.00 H ATOM 1388 HD22 ASN A 88 9.790 37.939 11.171 1.00 0.00 H ATOM 1389 HD21 ASN A 88 10.699 36.907 12.335 1.00 0.00 H ATOM 1390 H ASN A 88 11.351 35.297 7.316 1.00 0.00 H ATOM 1391 N LEU A 89 13.425 37.660 8.972 1.00 5.77 N ATOM 1392 CA LEU A 89 14.545 38.380 9.528 1.00 4.86 C ATOM 1393 C LEU A 89 15.675 38.553 8.541 1.00 5.33 C ATOM 1394 O LEU A 89 16.321 39.622 8.610 1.00 7.31 O ATOM 1395 CB LEU A 89 15.102 37.707 10.793 1.00 4.76 C ATOM 1396 CG LEU A 89 14.060 37.841 11.914 1.00 5.64 C ATOM 1397 CD1 LEU A 89 14.572 37.266 13.202 1.00 7.28 C ATOM 1398 CD2 LEU A 89 13.778 39.351 12.048 1.00 8.05 C ATOM 1399 HA LEU A 89 14.146 39.361 9.786 1.00 0.00 H ATOM 1400 HB2 LEU A 89 15.296 36.653 10.594 1.00 0.00 H ATOM 1401 HB3 LEU A 89 16.029 38.195 11.092 1.00 0.00 H ATOM 1402 HG LEU A 89 13.151 37.288 11.680 1.00 0.00 H ATOM 1403 HD21 LEU A 89 14.702 39.871 12.302 1.00 0.00 H ATOM 1404 HD22 LEU A 89 13.393 39.733 11.102 1.00 0.00 H ATOM 1405 HD23 LEU A 89 13.040 39.513 12.834 1.00 0.00 H ATOM 1406 HD11 LEU A 89 14.799 36.209 13.062 1.00 0.00 H ATOM 1407 HD12 LEU A 89 15.476 37.796 13.501 1.00 0.00 H ATOM 1408 HD13 LEU A 89 13.812 37.376 13.975 1.00 0.00 H ATOM 1409 H LEU A 89 13.569 36.652 8.760 1.00 0.00 H ATOM 1410 N LEU A 90 15.852 37.611 7.634 1.00 3.54 N ATOM 1411 CA LEU A 90 16.902 37.732 6.614 1.00 2.27 C ATOM 1412 C LEU A 90 16.754 39.025 5.819 1.00 2.68 C ATOM 1413 O LEU A 90 17.743 39.676 5.450 1.00 3.59 O ATOM 1414 CB LEU A 90 16.910 36.515 5.741 1.00 2.66 C ATOM 1415 CG LEU A 90 17.339 35.107 6.126 1.00 2.35 C ATOM 1416 CD1 LEU A 90 17.504 34.375 4.769 1.00 4.46 C ATOM 1417 CD2 LEU A 90 18.693 34.978 6.815 1.00 2.73 C ATOM 1418 HA LEU A 90 17.872 37.789 7.107 1.00 0.00 H ATOM 1419 HB2 LEU A 90 15.881 36.410 5.399 1.00 0.00 H ATOM 1420 HB3 LEU A 90 17.547 36.780 4.897 1.00 0.00 H ATOM 1421 HG LEU A 90 16.599 34.724 6.829 1.00 0.00 H ATOM 1422 HD21 LEU A 90 19.473 35.360 6.156 1.00 0.00 H ATOM 1423 HD22 LEU A 90 18.684 35.553 7.741 1.00 0.00 H ATOM 1424 HD23 LEU A 90 18.887 33.929 7.039 1.00 0.00 H ATOM 1425 HD11 LEU A 90 16.553 34.382 4.236 1.00 0.00 H ATOM 1426 HD12 LEU A 90 18.260 34.885 4.172 1.00 0.00 H ATOM 1427 HD13 LEU A 90 17.814 33.345 4.948 1.00 0.00 H ATOM 1428 H LEU A 90 15.239 36.771 7.641 1.00 0.00 H ATOM 1429 N THR A 91 15.544 39.446 5.528 1.00 2.62 N ATOM 1430 CA THR A 91 15.252 40.664 4.801 1.00 3.41 C ATOM 1431 C THR A 91 15.684 41.874 5.633 1.00 3.91 C ATOM 1432 O THR A 91 16.188 42.884 5.109 1.00 3.22 O ATOM 1433 CB THR A 91 13.762 40.857 4.478 1.00 4.56 C ATOM 1434 OG1 THR A 91 13.070 41.088 5.716 1.00 8.06 O ATOM 1435 CG2 THR A 91 13.091 39.661 3.844 1.00 4.79 C ATOM 1436 HA THR A 91 15.798 40.580 3.862 1.00 0.00 H ATOM 1437 HB THR A 91 13.714 41.682 3.767 1.00 0.00 H ATOM 1438 HG1 THR A 91 12.105 41.216 5.535 1.00 0.00 H ATOM 1439 HG23 THR A 91 13.576 39.435 2.894 1.00 0.00 H ATOM 1440 HG21 THR A 91 13.177 38.803 4.510 1.00 0.00 H ATOM 1441 HG22 THR A 91 12.038 39.885 3.672 1.00 0.00 H ATOM 1442 H THR A 91 14.741 38.865 5.841 1.00 0.00 H ATOM 1443 N GLN A 92 15.468 41.747 6.934 1.00 4.50 N ATOM 1444 CA GLN A 92 15.816 42.860 7.826 1.00 6.32 C ATOM 1445 C GLN A 92 17.273 43.233 7.864 1.00 7.36 C ATOM 1446 O GLN A 92 17.586 44.385 8.194 1.00 9.90 O ATOM 1447 CB GLN A 92 15.396 42.506 9.259 1.00 5.74 C ATOM 1448 CG GLN A 92 13.877 42.353 9.300 1.00 6.66 C ATOM 1449 CD GLN A 92 13.207 43.667 9.061 1.00 6.07 C ATOM 1450 OE1 GLN A 92 12.357 43.834 8.198 1.00 6.80 O ATOM 1451 NE2 GLN A 92 13.590 44.619 9.923 1.00 8.42 N ATOM 1452 HA GLN A 92 15.285 43.720 7.418 1.00 0.00 H ATOM 1453 HB2 GLN A 92 15.868 41.570 9.559 1.00 0.00 H ATOM 1454 HB3 GLN A 92 15.703 43.301 9.939 1.00 0.00 H ATOM 1455 HG2 GLN A 92 13.567 41.648 8.529 1.00 0.00 H ATOM 1456 HG3 GLN A 92 13.582 41.973 10.278 1.00 0.00 H ATOM 1457 HE22 GLN A 92 14.320 44.413 10.635 1.00 0.00 H ATOM 1458 HE21 GLN A 92 13.158 45.564 9.880 1.00 0.00 H ATOM 1459 H GLN A 92 15.058 40.872 7.318 1.00 0.00 H ATOM 1460 N ILE A 93 18.145 42.286 7.654 1.00 9.05 N ATOM 1461 CA ILE A 93 19.592 42.483 7.706 1.00 9.71 C ATOM 1462 C ILE A 93 20.101 42.518 6.270 1.00 9.71 C ATOM 1463 O ILE A 93 21.307 42.477 6.111 1.00 10.24 O ATOM 1464 CB ILE A 93 20.402 41.473 8.524 1.00 10.49 C ATOM 1465 CG1 ILE A 93 20.346 40.089 7.864 1.00 10.49 C ATOM 1466 CG2 ILE A 93 19.852 41.409 9.945 1.00 10.32 C ATOM 1467 CD1 ILE A 93 20.702 38.920 8.756 1.00 10.38 C ATOM 1468 HA ILE A 93 19.746 43.418 8.244 1.00 0.00 H ATOM 1469 HB ILE A 93 21.443 41.793 8.561 1.00 0.00 H ATOM 1470 HG12 ILE A 93 19.331 39.934 7.497 1.00 0.00 H ATOM 1471 HG13 ILE A 93 21.039 40.091 7.022 1.00 0.00 H ATOM 1472 HD11 ILE A 93 21.721 39.042 9.124 1.00 0.00 H ATOM 1473 HD12 ILE A 93 20.012 38.885 9.599 1.00 0.00 H ATOM 1474 HD13 ILE A 93 20.629 37.994 8.186 1.00 0.00 H ATOM 1475 HG21 ILE A 93 19.926 42.394 10.407 1.00 0.00 H ATOM 1476 HG22 ILE A 93 18.808 41.098 9.915 1.00 0.00 H ATOM 1477 HG23 ILE A 93 20.430 40.690 10.525 1.00 0.00 H ATOM 1478 H ILE A 93 17.789 41.333 7.436 1.00 0.00 H ATOM 1479 N GLY A 94 19.154 42.592 5.366 1.00 9.50 N ATOM 1480 CA GLY A 94 19.375 42.779 3.961 1.00 10.88 C ATOM 1481 C GLY A 94 20.262 41.868 3.182 1.00 11.06 C ATOM 1482 O GLY A 94 21.167 42.234 2.452 1.00 11.49 O ATOM 1483 HA3 GLY A 94 19.786 43.782 3.845 1.00 0.00 H ATOM 1484 HA2 GLY A 94 18.395 42.733 3.487 1.00 0.00 H ATOM 1485 H GLY A 94 18.170 42.509 5.692 1.00 0.00 H ATOM 1486 N CYS A 95 19.921 40.620 3.334 1.00 12.51 N ATOM 1487 CA CYS A 95 20.558 39.427 2.777 1.00 12.47 C ATOM 1488 C CYS A 95 19.940 39.171 1.417 1.00 12.96 C ATOM 1489 O CYS A 95 18.761 39.504 1.200 1.00 14.21 O ATOM 1490 CB CYS A 95 20.259 38.340 3.791 1.00 11.85 C ATOM 1491 SG CYS A 95 21.241 36.849 3.677 1.00 16.39 S ATOM 1492 HA CYS A 95 21.634 39.500 2.620 1.00 0.00 H ATOM 1493 HB2 CYS A 95 19.213 38.057 3.675 1.00 0.00 H ATOM 1494 HB3 CYS A 95 20.412 38.762 4.784 1.00 0.00 H ATOM 1495 HG CYS A 95 20.849 35.966 4.662 1.00 0.00 H ATOM 1496 H CYS A 95 19.086 40.449 3.930 1.00 0.00 H ATOM 1497 N THR A 96 20.753 38.698 0.502 1.00 12.42 N ATOM 1498 CA THR A 96 20.375 38.371 -0.844 1.00 11.38 C ATOM 1499 C THR A 96 21.154 37.146 -1.302 1.00 11.00 C ATOM 1500 O THR A 96 22.286 36.941 -0.871 1.00 12.29 O ATOM 1501 CB THR A 96 20.517 39.495 -1.881 1.00 11.95 C ATOM 1502 OG1 THR A 96 21.689 40.261 -1.707 1.00 10.53 O ATOM 1503 CG2 THR A 96 19.278 40.397 -1.771 1.00 12.12 C ATOM 1504 HA THR A 96 19.303 38.180 -0.796 1.00 0.00 H ATOM 1505 HB THR A 96 20.594 39.043 -2.870 1.00 0.00 H ATOM 1506 HG1 THR A 96 21.679 40.679 -0.810 1.00 0.00 H ATOM 1507 HG23 THR A 96 18.379 39.796 -1.907 1.00 0.00 H ATOM 1508 HG21 THR A 96 19.258 40.866 -0.787 1.00 0.00 H ATOM 1509 HG22 THR A 96 19.321 41.167 -2.541 1.00 0.00 H ATOM 1510 H THR A 96 21.746 38.549 0.772 1.00 0.00 H ATOM 1511 N LEU A 97 20.488 36.392 -2.111 1.00 9.97 N ATOM 1512 CA LEU A 97 21.096 35.183 -2.736 1.00 10.02 C ATOM 1513 C LEU A 97 21.658 35.731 -4.037 1.00 10.88 C ATOM 1514 O LEU A 97 20.946 36.420 -4.793 1.00 11.86 O ATOM 1515 CB LEU A 97 19.956 34.197 -2.867 1.00 7.96 C ATOM 1516 CG LEU A 97 20.216 32.718 -3.042 1.00 8.98 C ATOM 1517 CD1 LEU A 97 20.755 32.086 -1.767 1.00 8.02 C ATOM 1518 CD2 LEU A 97 18.936 31.984 -3.477 1.00 8.07 C ATOM 1519 HA LEU A 97 21.893 34.659 -2.209 1.00 0.00 H ATOM 1520 HB2 LEU A 97 19.353 34.300 -1.965 1.00 0.00 H ATOM 1521 HB3 LEU A 97 19.372 34.513 -3.731 1.00 0.00 H ATOM 1522 HG LEU A 97 20.971 32.618 -3.822 1.00 0.00 H ATOM 1523 HD21 LEU A 97 18.166 32.118 -2.717 1.00 0.00 H ATOM 1524 HD22 LEU A 97 18.588 32.394 -4.425 1.00 0.00 H ATOM 1525 HD23 LEU A 97 19.150 30.922 -3.596 1.00 0.00 H ATOM 1526 HD11 LEU A 97 21.692 32.569 -1.492 1.00 0.00 H ATOM 1527 HD12 LEU A 97 20.029 32.214 -0.964 1.00 0.00 H ATOM 1528 HD13 LEU A 97 20.928 31.023 -1.935 1.00 0.00 H ATOM 1529 H LEU A 97 19.501 36.634 -2.333 1.00 0.00 H ATOM 1530 N ASN A 98 22.901 35.576 -4.365 1.00 12.36 N ATOM 1531 CA ASN A 98 23.497 36.101 -5.592 1.00 13.04 C ATOM 1532 C ASN A 98 24.188 35.005 -6.371 1.00 14.04 C ATOM 1533 O ASN A 98 24.836 34.148 -5.708 1.00 15.26 O ATOM 1534 CB ASN A 98 24.624 37.069 -5.152 1.00 16.04 C ATOM 1535 CG ASN A 98 24.071 38.481 -4.979 1.00 16.86 C ATOM 1536 OD1 ASN A 98 23.587 38.816 -3.895 1.00 18.08 O ATOM 1537 ND2 ASN A 98 24.186 39.243 -6.059 1.00 16.33 N ATOM 1538 HA ASN A 98 22.719 36.561 -6.201 1.00 0.00 H ATOM 1539 HB2 ASN A 98 25.042 36.728 -4.205 1.00 0.00 H ATOM 1540 HB3 ASN A 98 25.406 37.079 -5.911 1.00 0.00 H ATOM 1541 HD22 ASN A 98 24.613 38.856 -6.925 1.00 0.00 H ATOM 1542 HD21 ASN A 98 23.850 40.227 -6.039 1.00 0.00 H ATOM 1543 H ASN A 98 23.514 35.044 -3.714 1.00 0.00 H ATOM 1544 N PHE A 99 24.070 35.056 -7.683 1.00 13.71 N ATOM 1545 CA PHE A 99 24.764 34.064 -8.545 1.00 12.91 C ATOM 1546 C PHE A 99 24.910 34.592 -9.954 1.00 13.03 C ATOM 1547 O PHE A 99 25.940 34.199 -10.562 1.00 14.15 O ATOM 1548 CB PHE A 99 24.139 32.694 -8.528 1.00 13.02 C ATOM 1549 CG PHE A 99 22.705 32.656 -8.947 1.00 13.19 C ATOM 1550 CD1 PHE A 99 21.707 32.948 -8.026 1.00 13.93 C ATOM 1551 CD2 PHE A 99 22.356 32.365 -10.246 1.00 12.58 C ATOM 1552 CE1 PHE A 99 20.362 32.934 -8.376 1.00 12.50 C ATOM 1553 CE2 PHE A 99 21.028 32.356 -10.614 1.00 13.01 C ATOM 1554 CZ PHE A 99 20.044 32.613 -9.682 1.00 13.79 C ATOM 1555 HA PHE A 99 25.756 33.929 -8.115 1.00 0.00 H ATOM 1556 OXT PHE A 99 24.091 35.388 -10.421 1.00 13.01 O ATOM 1557 HB2 PHE A 99 24.707 32.053 -9.202 1.00 0.00 H ATOM 1558 HB3 PHE A 99 24.207 32.302 -7.513 1.00 0.00 H ATOM 1559 HD2 PHE A 99 23.128 32.142 -10.982 1.00 0.00 H ATOM 1560 HE2 PHE A 99 20.754 32.145 -11.647 1.00 0.00 H ATOM 1561 HZ PHE A 99 18.997 32.562 -9.981 1.00 0.00 H ATOM 1562 HE1 PHE A 99 19.586 33.168 -7.647 1.00 0.00 H ATOM 1563 HD1 PHE A 99 21.986 33.195 -7.002 1.00 0.00 H ATOM 1564 H PHE A 99 23.486 35.798 -8.119 1.00 0.00 H TER 1565 PHE A 99 ATOM 1566 N PRO B 1 21.839 36.881 -11.213 1.00 15.02 N ATOM 1567 CA PRO B 1 20.990 37.931 -10.637 1.00 14.80 C ATOM 1568 C PRO B 1 21.248 38.112 -9.150 1.00 14.56 C ATOM 1569 O PRO B 1 22.194 37.577 -8.612 1.00 15.10 O ATOM 1570 CB PRO B 1 19.592 37.312 -10.818 1.00 15.03 C ATOM 1571 CG PRO B 1 19.910 35.857 -10.461 1.00 14.85 C ATOM 1572 CD PRO B 1 21.070 35.605 -11.422 1.00 14.47 C ATOM 1573 HA PRO B 1 21.146 38.908 -11.095 1.00 0.00 H ATOM 1574 HD3 PRO B 1 21.651 34.727 -11.139 1.00 0.00 H ATOM 1575 HD2 PRO B 1 20.730 35.497 -12.452 1.00 0.00 H ATOM 1576 HG3 PRO B 1 19.066 35.196 -10.660 1.00 0.00 H ATOM 1577 HG2 PRO B 1 20.215 35.751 -9.420 1.00 0.00 H ATOM 1578 HB2 PRO B 1 18.863 37.748 -10.135 1.00 0.00 H ATOM 1579 HB3 PRO B 1 19.233 37.410 -11.843 1.00 0.00 H ATOM 1580 N GLN B 2 20.407 38.897 -8.516 1.00 14.63 N ATOM 1581 CA GLN B 2 20.451 39.153 -7.086 1.00 14.55 C ATOM 1582 C GLN B 2 19.044 38.848 -6.589 1.00 14.26 C ATOM 1583 O GLN B 2 18.202 39.653 -6.995 1.00 14.29 O ATOM 1584 CB GLN B 2 20.791 40.583 -6.748 1.00 15.63 C ATOM 1585 CG GLN B 2 22.192 40.670 -6.172 1.00 19.80 C ATOM 1586 CD GLN B 2 22.235 41.505 -4.916 1.00 22.27 C ATOM 1587 OE1 GLN B 2 21.176 41.882 -4.383 1.00 24.65 O ATOM 1588 NE2 GLN B 2 23.462 41.741 -4.437 1.00 24.26 N ATOM 1589 HA GLN B 2 21.228 38.544 -6.624 1.00 0.00 H ATOM 1590 HB2 GLN B 2 20.735 41.189 -7.652 1.00 0.00 H ATOM 1591 HB3 GLN B 2 20.077 40.959 -6.015 1.00 0.00 H ATOM 1592 HG2 GLN B 2 22.540 39.664 -5.938 1.00 0.00 H ATOM 1593 HG3 GLN B 2 22.851 41.118 -6.915 1.00 0.00 H ATOM 1594 HE22 GLN B 2 24.296 41.388 -4.948 1.00 0.00 H ATOM 1595 HE21 GLN B 2 23.581 42.277 -3.554 1.00 0.00 H ATOM 1596 H GLN B 2 19.663 39.365 -9.072 1.00 0.00 H ATOM 1597 N ILE B 3 18.856 37.752 -5.871 1.00 13.59 N ATOM 1598 CA ILE B 3 17.460 37.463 -5.440 1.00 13.58 C ATOM 1599 C ILE B 3 17.243 37.970 -4.021 1.00 12.70 C ATOM 1600 O ILE B 3 17.996 37.699 -3.078 1.00 12.44 O ATOM 1601 CB ILE B 3 17.053 36.015 -5.675 1.00 13.70 C ATOM 1602 CG1 ILE B 3 16.981 35.681 -7.170 1.00 14.74 C ATOM 1603 CG2 ILE B 3 15.685 35.732 -5.055 1.00 14.10 C ATOM 1604 CD1 ILE B 3 17.816 34.454 -7.525 1.00 16.66 C ATOM 1605 HA ILE B 3 16.771 38.017 -6.078 1.00 0.00 H ATOM 1606 HB ILE B 3 17.816 35.395 -5.206 1.00 0.00 H ATOM 1607 HG12 ILE B 3 15.942 35.489 -7.438 1.00 0.00 H ATOM 1608 HG13 ILE B 3 17.350 36.534 -7.739 1.00 0.00 H ATOM 1609 HD11 ILE B 3 18.859 34.639 -7.268 1.00 0.00 H ATOM 1610 HD12 ILE B 3 17.450 33.593 -6.966 1.00 0.00 H ATOM 1611 HD13 ILE B 3 17.734 34.257 -8.594 1.00 0.00 H ATOM 1612 HG21 ILE B 3 15.729 35.917 -3.982 1.00 0.00 H ATOM 1613 HG22 ILE B 3 14.940 36.386 -5.508 1.00 0.00 H ATOM 1614 HG23 ILE B 3 15.414 34.692 -5.235 1.00 0.00 H ATOM 1615 H ILE B 3 19.645 37.123 -5.620 1.00 0.00 H ATOM 1616 N THR B 4 16.176 38.760 -3.896 1.00 11.51 N ATOM 1617 CA THR B 4 15.888 39.298 -2.545 1.00 11.18 C ATOM 1618 C THR B 4 14.878 38.373 -1.911 1.00 11.00 C ATOM 1619 O THR B 4 14.341 37.552 -2.666 1.00 12.13 O ATOM 1620 CB THR B 4 15.522 40.766 -2.613 1.00 10.67 C ATOM 1621 OG1 THR B 4 14.226 40.941 -3.173 1.00 10.94 O ATOM 1622 CG2 THR B 4 16.578 41.445 -3.504 1.00 9.85 C ATOM 1623 HA THR B 4 16.761 39.306 -1.892 1.00 0.00 H ATOM 1624 HB THR B 4 15.504 41.202 -1.614 1.00 0.00 H ATOM 1625 HG1 THR B 4 14.010 41.907 -3.207 1.00 0.00 H ATOM 1626 HG23 THR B 4 17.566 41.305 -3.066 1.00 0.00 H ATOM 1627 HG21 THR B 4 16.554 40.999 -4.498 1.00 0.00 H ATOM 1628 HG22 THR B 4 16.359 42.510 -3.577 1.00 0.00 H ATOM 1629 H THR B 4 15.572 38.989 -4.711 1.00 0.00 H ATOM 1630 N LEU B 5 14.669 38.503 -0.612 1.00 10.56 N ATOM 1631 CA LEU B 5 13.806 37.617 0.141 1.00 9.05 C ATOM 1632 C LEU B 5 12.532 38.221 0.650 1.00 9.50 C ATOM 1633 O LEU B 5 11.962 37.736 1.644 1.00 10.81 O ATOM 1634 CB LEU B 5 14.647 36.926 1.250 1.00 7.47 C ATOM 1635 CG LEU B 5 15.979 36.311 0.699 1.00 5.32 C ATOM 1636 CD1 LEU B 5 16.887 35.849 1.819 1.00 1.82 C ATOM 1637 CD2 LEU B 5 15.615 35.229 -0.310 1.00 3.02 C ATOM 1638 HA LEU B 5 13.430 36.870 -0.558 1.00 0.00 H ATOM 1639 HB2 LEU B 5 14.892 37.664 2.014 1.00 0.00 H ATOM 1640 HB3 LEU B 5 14.051 36.129 1.695 1.00 0.00 H ATOM 1641 HG LEU B 5 16.571 37.065 0.180 1.00 0.00 H ATOM 1642 HD21 LEU B 5 15.020 34.460 0.183 1.00 0.00 H ATOM 1643 HD22 LEU B 5 15.039 35.671 -1.123 1.00 0.00 H ATOM 1644 HD23 LEU B 5 16.527 34.785 -0.709 1.00 0.00 H ATOM 1645 HD11 LEU B 5 17.137 36.698 2.455 1.00 0.00 H ATOM 1646 HD12 LEU B 5 16.376 35.089 2.409 1.00 0.00 H ATOM 1647 HD13 LEU B 5 17.799 35.429 1.396 1.00 0.00 H ATOM 1648 H LEU B 5 15.146 39.277 -0.108 1.00 0.00 H ATOM 1649 N TRP B 6 11.994 39.230 -0.040 1.00 8.40 N ATOM 1650 CA TRP B 6 10.696 39.750 0.394 1.00 7.44 C ATOM 1651 C TRP B 6 9.670 38.646 0.159 1.00 7.85 C ATOM 1652 O TRP B 6 8.713 38.570 0.939 1.00 9.34 O ATOM 1653 CB TRP B 6 10.295 41.094 -0.253 1.00 4.02 C ATOM 1654 CG TRP B 6 11.363 42.068 0.167 1.00 2.12 C ATOM 1655 CD1 TRP B 6 12.470 42.420 -0.527 1.00 2.25 C ATOM 1656 CD2 TRP B 6 11.486 42.652 1.459 1.00 2.56 C ATOM 1657 NE1 TRP B 6 13.268 43.230 0.229 1.00 3.22 N ATOM 1658 CE2 TRP B 6 12.691 43.364 1.480 1.00 2.35 C ATOM 1659 CE3 TRP B 6 10.710 42.631 2.614 1.00 3.66 C ATOM 1660 CZ2 TRP B 6 13.107 44.111 2.568 1.00 1.96 C ATOM 1661 CZ3 TRP B 6 11.148 43.363 3.717 1.00 3.69 C ATOM 1662 CH2 TRP B 6 12.330 44.080 3.691 1.00 2.20 C ATOM 1663 HA TRP B 6 10.752 40.004 1.452 1.00 0.00 H ATOM 1664 HB2 TRP B 6 10.266 41.002 -1.339 1.00 0.00 H ATOM 1665 HB3 TRP B 6 9.319 41.417 0.109 1.00 0.00 H ATOM 1666 HE1 TRP B 6 14.157 43.671 -0.082 1.00 0.00 H ATOM 1667 HD1 TRP B 6 12.693 42.102 -1.545 1.00 0.00 H ATOM 1668 HZ2 TRP B 6 14.022 44.703 2.530 1.00 0.00 H ATOM 1669 HH2 TRP B 6 12.646 44.628 4.579 1.00 0.00 H ATOM 1670 HZ3 TRP B 6 10.543 43.370 4.623 1.00 0.00 H ATOM 1671 HE3 TRP B 6 9.784 42.057 2.655 1.00 0.00 H ATOM 1672 H TRP B 6 12.484 39.635 -0.863 1.00 0.00 H ATOM 1673 N GLN B 7 9.875 37.865 -0.860 1.00 7.71 N ATOM 1674 CA GLN B 7 8.992 36.765 -1.251 1.00 9.09 C ATOM 1675 C GLN B 7 9.796 35.498 -1.440 1.00 7.59 C ATOM 1676 O GLN B 7 11.004 35.644 -1.626 1.00 8.55 O ATOM 1677 CB GLN B 7 8.377 37.083 -2.640 1.00 10.71 C ATOM 1678 CG GLN B 7 8.316 38.557 -2.910 1.00 16.95 C ATOM 1679 CD GLN B 7 6.992 38.988 -3.534 1.00 19.86 C ATOM 1680 OE1 GLN B 7 6.496 38.327 -4.459 1.00 22.38 O ATOM 1681 NE2 GLN B 7 6.443 40.094 -3.027 1.00 20.06 N ATOM 1682 HA GLN B 7 8.233 36.643 -0.478 1.00 0.00 H ATOM 1683 HB2 GLN B 7 8.986 36.610 -3.410 1.00 0.00 H ATOM 1684 HB3 GLN B 7 7.366 36.677 -2.678 1.00 0.00 H ATOM 1685 HG2 GLN B 7 8.448 39.090 -1.968 1.00 0.00 H ATOM 1686 HG3 GLN B 7 9.125 38.821 -3.591 1.00 0.00 H ATOM 1687 HE22 GLN B 7 6.915 40.599 -2.250 1.00 0.00 H ATOM 1688 HE21 GLN B 7 5.544 40.450 -3.409 1.00 0.00 H ATOM 1689 H GLN B 7 10.724 38.033 -1.437 1.00 0.00 H ATOM 1690 N ARG B 8 9.208 34.336 -1.502 1.00 7.01 N ATOM 1691 CA ARG B 8 10.025 33.125 -1.741 1.00 6.66 C ATOM 1692 C ARG B 8 10.897 33.245 -2.991 1.00 6.85 C ATOM 1693 O ARG B 8 10.388 33.590 -4.080 1.00 8.08 O ATOM 1694 CB ARG B 8 9.102 31.914 -2.054 1.00 4.54 C ATOM 1695 CG ARG B 8 8.559 31.304 -0.790 1.00 2.73 C ATOM 1696 CD ARG B 8 7.235 30.611 -1.019 1.00 1.77 C ATOM 1697 NE ARG B 8 6.683 30.363 0.313 1.00 1.77 N ATOM 1698 CZ ARG B 8 5.476 29.872 0.497 1.00 1.77 C ATOM 1699 NH1 ARG B 8 4.794 29.605 -0.596 1.00 1.77 N ATOM 1700 NH2 ARG B 8 4.992 29.674 1.711 1.00 1.77 N ATOM 1701 HA ARG B 8 10.628 33.002 -0.842 1.00 0.00 H ATOM 1702 HB2 ARG B 8 8.270 32.251 -2.673 1.00 0.00 H ATOM 1703 HB3 ARG B 8 9.674 31.161 -2.596 1.00 0.00 H ATOM 1704 HG2 ARG B 8 9.277 30.576 -0.414 1.00 0.00 H ATOM 1705 HG3 ARG B 8 8.421 32.092 -0.050 1.00 0.00 H ATOM 1706 HD2 ARG B 8 7.384 29.671 -1.550 1.00 0.00 H ATOM 1707 HD3 ARG B 8 6.566 31.250 -1.595 1.00 0.00 H ATOM 1708 HE ARG B 8 7.266 30.583 1.145 1.00 0.00 H ATOM 1709 HH12 ARG B 8 3.833 29.215 -0.527 1.00 0.00 H ATOM 1710 HH11 ARG B 8 5.216 29.784 -1.529 1.00 0.00 H ATOM 1711 HH22 ARG B 8 4.035 29.285 1.832 1.00 0.00 H ATOM 1712 HH21 ARG B 8 5.568 29.907 2.545 1.00 0.00 H ATOM 1713 H ARG B 8 8.177 34.261 -1.385 1.00 0.00 H ATOM 1714 N PRO B 9 12.145 32.839 -2.817 1.00 4.84 N ATOM 1715 CA PRO B 9 13.062 32.794 -3.946 1.00 4.10 C ATOM 1716 C PRO B 9 12.719 31.632 -4.867 1.00 4.20 C ATOM 1717 O PRO B 9 13.433 30.605 -4.942 1.00 1.84 O ATOM 1718 CB PRO B 9 14.421 32.620 -3.271 1.00 4.70 C ATOM 1719 CG PRO B 9 14.135 31.915 -1.983 1.00 4.52 C ATOM 1720 CD PRO B 9 12.722 32.363 -1.579 1.00 4.45 C ATOM 1721 HA PRO B 9 13.026 33.677 -4.585 1.00 0.00 H ATOM 1722 HD3 PRO B 9 12.149 31.527 -1.179 1.00 0.00 H ATOM 1723 HD2 PRO B 9 12.764 33.161 -0.838 1.00 0.00 H ATOM 1724 HG3 PRO B 9 14.859 32.203 -1.221 1.00 0.00 H ATOM 1725 HG2 PRO B 9 14.167 30.835 -2.124 1.00 0.00 H ATOM 1726 HB2 PRO B 9 15.084 32.021 -3.895 1.00 0.00 H ATOM 1727 HB3 PRO B 9 14.881 33.590 -3.082 1.00 0.00 H ATOM 1728 N LEU B 10 11.584 31.823 -5.569 1.00 4.11 N ATOM 1729 CA LEU B 10 11.191 30.786 -6.553 1.00 5.01 C ATOM 1730 C LEU B 10 11.917 31.080 -7.875 1.00 6.58 C ATOM 1731 O LEU B 10 12.126 32.261 -8.184 1.00 7.43 O ATOM 1732 CB LEU B 10 9.689 30.777 -6.746 1.00 2.14 C ATOM 1733 CG LEU B 10 8.889 30.179 -5.581 1.00 1.77 C ATOM 1734 CD1 LEU B 10 7.434 30.531 -5.625 1.00 1.77 C ATOM 1735 CD2 LEU B 10 9.070 28.678 -5.588 1.00 2.35 C ATOM 1736 HA LEU B 10 11.475 29.798 -6.191 1.00 0.00 H ATOM 1737 HB2 LEU B 10 9.360 31.806 -6.889 1.00 0.00 H ATOM 1738 HB3 LEU B 10 9.466 30.198 -7.642 1.00 0.00 H ATOM 1739 HG LEU B 10 9.274 30.608 -4.656 1.00 0.00 H ATOM 1740 HD21 LEU B 10 8.707 28.274 -6.533 1.00 0.00 H ATOM 1741 HD22 LEU B 10 10.127 28.440 -5.472 1.00 0.00 H ATOM 1742 HD23 LEU B 10 8.506 28.241 -4.764 1.00 0.00 H ATOM 1743 HD11 LEU B 10 7.322 31.614 -5.581 1.00 0.00 H ATOM 1744 HD12 LEU B 10 6.999 30.157 -6.552 1.00 0.00 H ATOM 1745 HD13 LEU B 10 6.926 30.077 -4.774 1.00 0.00 H ATOM 1746 H LEU B 10 11.002 32.672 -5.425 1.00 0.00 H ATOM 1747 N VAL B 11 12.348 30.050 -8.590 1.00 7.80 N ATOM 1748 CA VAL B 11 12.939 30.161 -9.910 1.00 8.68 C ATOM 1749 C VAL B 11 12.427 29.034 -10.794 1.00 10.25 C ATOM 1750 O VAL B 11 11.854 28.059 -10.300 1.00 11.97 O ATOM 1751 CB VAL B 11 14.428 30.350 -10.072 1.00 8.09 C ATOM 1752 CG1 VAL B 11 14.783 31.580 -9.214 1.00 8.16 C ATOM 1753 CG2 VAL B 11 15.301 29.199 -9.655 1.00 8.09 C ATOM 1754 HA VAL B 11 12.594 31.146 -10.225 1.00 0.00 H ATOM 1755 HB VAL B 11 14.627 30.455 -11.139 1.00 0.00 H ATOM 1756 HG11 VAL B 11 14.230 32.446 -9.576 1.00 0.00 H ATOM 1757 HG12 VAL B 11 14.517 31.386 -8.175 1.00 0.00 H ATOM 1758 HG13 VAL B 11 15.853 31.775 -9.286 1.00 0.00 H ATOM 1759 HG21 VAL B 11 15.141 28.988 -8.598 1.00 0.00 H ATOM 1760 HG22 VAL B 11 15.046 28.319 -10.246 1.00 0.00 H ATOM 1761 HG23 VAL B 11 16.347 29.459 -9.820 1.00 0.00 H ATOM 1762 H VAL B 11 12.256 29.100 -8.177 1.00 0.00 H ATOM 1763 N THR B 12 12.579 29.256 -12.077 1.00 11.03 N ATOM 1764 CA THR B 12 12.175 28.306 -13.132 1.00 10.89 C ATOM 1765 C THR B 12 13.454 27.508 -13.363 1.00 10.03 C ATOM 1766 O THR B 12 14.537 28.128 -13.398 1.00 10.55 O ATOM 1767 CB THR B 12 11.840 29.050 -14.436 1.00 13.48 C ATOM 1768 OG1 THR B 12 10.465 29.498 -14.462 1.00 16.97 O ATOM 1769 CG2 THR B 12 12.043 28.207 -15.686 1.00 13.68 C ATOM 1770 HA THR B 12 11.301 27.716 -12.854 1.00 0.00 H ATOM 1771 HB THR B 12 12.533 29.891 -14.445 1.00 0.00 H ATOM 1772 HG1 THR B 12 9.863 28.716 -14.387 1.00 0.00 H ATOM 1773 HG23 THR B 12 13.070 27.843 -15.714 1.00 0.00 H ATOM 1774 HG21 THR B 12 11.356 27.361 -15.667 1.00 0.00 H ATOM 1775 HG22 THR B 12 11.848 28.816 -16.569 1.00 0.00 H ATOM 1776 H THR B 12 13.010 30.156 -12.369 1.00 0.00 H ATOM 1777 N ILE B 13 13.313 26.216 -13.486 1.00 8.80 N ATOM 1778 CA ILE B 13 14.507 25.399 -13.774 1.00 6.93 C ATOM 1779 C ILE B 13 14.063 24.516 -14.945 1.00 7.90 C ATOM 1780 O ILE B 13 12.865 24.387 -15.242 1.00 6.10 O ATOM 1781 CB ILE B 13 14.891 24.536 -12.574 1.00 6.97 C ATOM 1782 CG1 ILE B 13 13.770 23.566 -12.197 1.00 5.47 C ATOM 1783 CG2 ILE B 13 15.272 25.344 -11.318 1.00 7.05 C ATOM 1784 CD1 ILE B 13 14.338 22.269 -11.619 1.00 4.37 C ATOM 1785 HA ILE B 13 15.384 26.007 -13.998 1.00 0.00 H ATOM 1786 HB ILE B 13 15.775 23.990 -12.904 1.00 0.00 H ATOM 1787 HG12 ILE B 13 13.127 24.036 -11.453 1.00 0.00 H ATOM 1788 HG13 ILE B 13 13.185 23.334 -13.087 1.00 0.00 H ATOM 1789 HD11 ILE B 13 14.979 21.792 -12.361 1.00 0.00 H ATOM 1790 HD12 ILE B 13 14.920 22.495 -10.726 1.00 0.00 H ATOM 1791 HD13 ILE B 13 13.518 21.599 -11.360 1.00 0.00 H ATOM 1792 HG21 ILE B 13 16.127 25.982 -11.543 1.00 0.00 H ATOM 1793 HG22 ILE B 13 14.426 25.961 -11.014 1.00 0.00 H ATOM 1794 HG23 ILE B 13 15.531 24.658 -10.511 1.00 0.00 H ATOM 1795 H ILE B 13 12.378 25.772 -13.383 1.00 0.00 H ATOM 1796 N LYS B 14 15.043 23.880 -15.548 1.00 7.94 N ATOM 1797 CA LYS B 14 14.695 22.955 -16.606 1.00 8.84 C ATOM 1798 C LYS B 14 15.286 21.576 -16.352 1.00 9.81 C ATOM 1799 O LYS B 14 16.479 21.434 -16.068 1.00 10.56 O ATOM 1800 CB LYS B 14 15.240 23.451 -17.893 1.00 10.65 C ATOM 1801 CG LYS B 14 14.245 24.239 -18.742 1.00 12.34 C ATOM 1802 CD LYS B 14 14.940 24.295 -20.113 1.00 13.60 C ATOM 1803 CE LYS B 14 15.448 22.888 -20.437 1.00 11.34 C ATOM 1804 NZ LYS B 14 15.703 22.943 -21.933 1.00 15.95 N ATOM 1805 HA LYS B 14 13.608 22.882 -16.639 1.00 0.00 H ATOM 1806 HB2 LYS B 14 16.090 24.098 -17.676 1.00 0.00 H ATOM 1807 HB3 LYS B 14 15.578 22.592 -18.473 1.00 0.00 H ATOM 1808 HG2 LYS B 14 13.288 23.722 -18.807 1.00 0.00 H ATOM 1809 HG3 LYS B 14 14.090 25.240 -18.339 1.00 0.00 H ATOM 1810 HD2 LYS B 14 14.231 24.619 -20.875 1.00 0.00 H ATOM 1811 HD3 LYS B 14 15.777 24.993 -20.077 1.00 0.00 H ATOM 1812 HE2 LYS B 14 14.696 22.136 -20.196 1.00 0.00 H ATOM 1813 HE3 LYS B 14 16.366 22.669 -19.892 1.00 0.00 H ATOM 1814 HZ1 LYS B 14 14.816 23.169 -22.427 1.00 0.00 H ATOM 1815 HZ2 LYS B 14 16.411 23.678 -22.136 1.00 0.00 H ATOM 1816 HZ3 LYS B 14 16.057 22.020 -22.257 1.00 0.00 H ATOM 1817 H LYS B 14 16.034 24.036 -15.274 1.00 0.00 H ATOM 1818 N ILE B 15 14.405 20.618 -16.504 1.00 9.73 N ATOM 1819 CA ILE B 15 14.889 19.225 -16.304 1.00 10.69 C ATOM 1820 C ILE B 15 14.141 18.428 -17.350 1.00 12.70 C ATOM 1821 O ILE B 15 12.964 18.754 -17.583 1.00 12.48 O ATOM 1822 CB ILE B 15 14.722 18.869 -14.848 1.00 9.70 C ATOM 1823 CG1 ILE B 15 15.224 17.453 -14.592 1.00 8.59 C ATOM 1824 CG2 ILE B 15 13.309 19.108 -14.349 1.00 9.33 C ATOM 1825 CD1 ILE B 15 15.291 17.191 -13.100 1.00 10.47 C ATOM 1826 HA ILE B 15 15.949 19.028 -16.463 1.00 0.00 H ATOM 1827 HB ILE B 15 15.341 19.544 -14.257 1.00 0.00 H ATOM 1828 HG12 ILE B 15 14.543 16.739 -15.054 1.00 0.00 H ATOM 1829 HG13 ILE B 15 16.218 17.338 -15.024 1.00 0.00 H ATOM 1830 HD11 ILE B 15 15.973 17.904 -12.637 1.00 0.00 H ATOM 1831 HD12 ILE B 15 14.297 17.304 -12.667 1.00 0.00 H ATOM 1832 HD13 ILE B 15 15.651 16.177 -12.926 1.00 0.00 H ATOM 1833 HG21 ILE B 15 13.056 20.162 -14.468 1.00 0.00 H ATOM 1834 HG22 ILE B 15 12.613 18.498 -14.926 1.00 0.00 H ATOM 1835 HG23 ILE B 15 13.246 18.835 -13.296 1.00 0.00 H ATOM 1836 H ILE B 15 13.416 20.821 -16.752 1.00 0.00 H ATOM 1837 N GLY B 16 14.868 17.548 -18.012 1.00 13.69 N ATOM 1838 CA GLY B 16 14.331 16.760 -19.122 1.00 15.45 C ATOM 1839 C GLY B 16 13.549 17.600 -20.125 1.00 16.01 C ATOM 1840 O GLY B 16 12.409 17.185 -20.472 1.00 18.07 O ATOM 1841 HA3 GLY B 16 13.668 15.996 -18.717 1.00 0.00 H ATOM 1842 HA2 GLY B 16 15.161 16.281 -19.642 1.00 0.00 H ATOM 1843 H GLY B 16 15.861 17.409 -17.734 1.00 0.00 H ATOM 1844 N GLY B 17 14.078 18.724 -20.548 1.00 15.48 N ATOM 1845 CA GLY B 17 13.378 19.586 -21.499 1.00 16.07 C ATOM 1846 C GLY B 17 12.152 20.276 -20.885 1.00 16.92 C ATOM 1847 O GLY B 17 11.426 21.008 -21.603 1.00 16.80 O ATOM 1848 HA3 GLY B 17 13.050 18.980 -22.343 1.00 0.00 H ATOM 1849 HA2 GLY B 17 14.070 20.352 -21.850 1.00 0.00 H ATOM 1850 H GLY B 17 15.016 19.008 -20.199 1.00 0.00 H ATOM 1851 N GLN B 18 11.935 20.047 -19.601 1.00 15.93 N ATOM 1852 CA GLN B 18 10.837 20.619 -18.853 1.00 16.23 C ATOM 1853 C GLN B 18 11.174 21.849 -18.001 1.00 14.16 C ATOM 1854 O GLN B 18 12.220 21.774 -17.325 1.00 15.47 O ATOM 1855 CB GLN B 18 10.411 19.606 -17.773 1.00 20.88 C ATOM 1856 CG GLN B 18 9.574 18.456 -18.277 1.00 25.11 C ATOM 1857 CD GLN B 18 9.962 17.265 -17.383 1.00 28.07 C ATOM 1858 OE1 GLN B 18 9.079 16.751 -16.699 1.00 30.91 O ATOM 1859 NE2 GLN B 18 11.251 16.951 -17.422 1.00 28.09 N ATOM 1860 HA GLN B 18 10.108 20.879 -19.620 1.00 0.00 H ATOM 1861 HB2 GLN B 18 11.313 19.196 -17.319 1.00 0.00 H ATOM 1862 HB3 GLN B 18 9.835 20.139 -17.017 1.00 0.00 H ATOM 1863 HG2 GLN B 18 8.512 18.681 -18.178 1.00 0.00 H ATOM 1864 HG3 GLN B 18 9.803 18.243 -19.321 1.00 0.00 H ATOM 1865 HE22 GLN B 18 11.894 17.472 -18.052 1.00 0.00 H ATOM 1866 HE21 GLN B 18 11.618 16.184 -16.823 1.00 0.00 H ATOM 1867 H GLN B 18 12.593 19.418 -19.099 1.00 0.00 H ATOM 1868 N LEU B 19 10.298 22.829 -17.985 1.00 10.50 N ATOM 1869 CA LEU B 19 10.489 24.023 -17.187 1.00 8.64 C ATOM 1870 C LEU B 19 9.629 23.785 -15.939 1.00 8.74 C ATOM 1871 O LEU B 19 8.446 23.573 -16.220 1.00 10.93 O ATOM 1872 CB LEU B 19 9.870 25.315 -17.713 1.00 6.12 C ATOM 1873 CG LEU B 19 10.309 25.949 -19.009 1.00 3.96 C ATOM 1874 CD1 LEU B 19 9.356 27.079 -19.371 1.00 3.25 C ATOM 1875 CD2 LEU B 19 11.734 26.423 -18.973 1.00 2.04 C ATOM 1876 HA LEU B 19 11.568 24.153 -17.106 1.00 0.00 H ATOM 1877 HB2 LEU B 19 8.802 25.121 -17.816 1.00 0.00 H ATOM 1878 HB3 LEU B 19 10.028 26.065 -16.938 1.00 0.00 H ATOM 1879 HG LEU B 19 10.271 25.183 -19.784 1.00 0.00 H ATOM 1880 HD21 LEU B 19 11.849 27.165 -18.183 1.00 0.00 H ATOM 1881 HD22 LEU B 19 12.392 25.577 -18.776 1.00 0.00 H ATOM 1882 HD23 LEU B 19 11.991 26.870 -19.933 1.00 0.00 H ATOM 1883 HD11 LEU B 19 8.348 26.680 -19.485 1.00 0.00 H ATOM 1884 HD12 LEU B 19 9.365 27.828 -18.579 1.00 0.00 H ATOM 1885 HD13 LEU B 19 9.675 27.536 -20.308 1.00 0.00 H ATOM 1886 H LEU B 19 9.439 22.744 -18.565 1.00 0.00 H ATOM 1887 N LYS B 20 10.185 23.904 -14.787 1.00 8.21 N ATOM 1888 CA LYS B 20 9.435 23.755 -13.537 1.00 6.81 C ATOM 1889 C LYS B 20 9.946 24.820 -12.589 1.00 7.43 C ATOM 1890 O LYS B 20 10.998 25.433 -12.806 1.00 9.49 O ATOM 1891 CB LYS B 20 9.627 22.375 -12.952 1.00 5.94 C ATOM 1892 CG LYS B 20 9.122 21.249 -13.817 1.00 5.36 C ATOM 1893 CD LYS B 20 9.718 19.935 -13.361 1.00 8.24 C ATOM 1894 CE LYS B 20 9.262 18.739 -14.149 1.00 9.36 C ATOM 1895 NZ LYS B 20 7.833 18.781 -14.603 1.00 11.04 N ATOM 1896 HA LYS B 20 8.366 23.874 -13.712 1.00 0.00 H ATOM 1897 HB2 LYS B 20 10.693 22.222 -12.784 1.00 0.00 H ATOM 1898 HB3 LYS B 20 9.100 22.334 -11.999 1.00 0.00 H ATOM 1899 HG2 LYS B 20 8.036 21.197 -13.744 1.00 0.00 H ATOM 1900 HG3 LYS B 20 9.407 21.434 -14.853 1.00 0.00 H ATOM 1901 HD2 LYS B 20 10.803 20.005 -13.444 1.00 0.00 H ATOM 1902 HD3 LYS B 20 9.444 19.780 -12.317 1.00 0.00 H ATOM 1903 HE2 LYS B 20 9.392 17.854 -13.526 1.00 0.00 H ATOM 1904 HE3 LYS B 20 9.895 18.656 -15.033 1.00 0.00 H ATOM 1905 HZ1 LYS B 20 7.209 18.846 -13.774 1.00 0.00 H ATOM 1906 HZ2 LYS B 20 7.689 19.611 -15.213 1.00 0.00 H ATOM 1907 HZ3 LYS B 20 7.614 17.915 -15.136 1.00 0.00 H ATOM 1908 H LYS B 20 11.203 24.113 -14.740 1.00 0.00 H ATOM 1909 N GLU B 21 9.196 25.008 -11.553 1.00 8.14 N ATOM 1910 CA GLU B 21 9.492 25.972 -10.499 1.00 8.62 C ATOM 1911 C GLU B 21 10.224 25.201 -9.377 1.00 7.34 C ATOM 1912 O GLU B 21 9.839 24.027 -9.131 1.00 8.29 O ATOM 1913 CB GLU B 21 8.175 26.491 -9.952 1.00 13.27 C ATOM 1914 CG GLU B 21 8.304 27.887 -9.324 1.00 18.61 C ATOM 1915 CD GLU B 21 7.080 28.683 -9.853 1.00 22.10 C ATOM 1916 OE1 GLU B 21 5.974 28.255 -9.421 1.00 22.70 O ATOM 1917 OE2 GLU B 21 7.364 29.578 -10.686 1.00 21.96 O ATOM 1918 HA GLU B 21 10.097 26.800 -10.868 1.00 0.00 H ATOM 1919 HB2 GLU B 21 7.453 26.540 -10.767 1.00 0.00 H ATOM 1920 HB3 GLU B 21 7.815 25.798 -9.192 1.00 0.00 H ATOM 1921 HG2 GLU B 21 8.277 27.822 -8.236 1.00 0.00 H ATOM 1922 HG3 GLU B 21 9.234 28.363 -9.635 1.00 0.00 H ATOM 1923 H GLU B 21 8.330 24.438 -11.466 1.00 0.00 H ATOM 1924 N ALA B 22 11.198 25.862 -8.830 1.00 3.71 N ATOM 1925 CA ALA B 22 12.049 25.459 -7.748 1.00 2.49 C ATOM 1926 C ALA B 22 12.286 26.680 -6.824 1.00 2.27 C ATOM 1927 O ALA B 22 12.151 27.829 -7.260 1.00 2.60 O ATOM 1928 CB ALA B 22 13.394 24.952 -8.213 1.00 1.77 C ATOM 1929 HA ALA B 22 11.548 24.642 -7.229 1.00 0.00 H ATOM 1930 HB1 ALA B 22 13.251 24.088 -8.862 1.00 0.00 H ATOM 1931 HB2 ALA B 22 13.908 25.740 -8.763 1.00 0.00 H ATOM 1932 HB3 ALA B 22 13.991 24.663 -7.348 1.00 0.00 H ATOM 1933 H ALA B 22 11.385 26.805 -9.227 1.00 0.00 H ATOM 1934 N LEU B 23 12.670 26.384 -5.635 1.00 1.77 N ATOM 1935 CA LEU B 23 12.973 27.200 -4.502 1.00 1.93 C ATOM 1936 C LEU B 23 14.445 27.127 -4.142 1.00 3.15 C ATOM 1937 O LEU B 23 14.842 25.983 -3.813 1.00 5.15 O ATOM 1938 CB LEU B 23 12.230 26.559 -3.299 1.00 1.77 C ATOM 1939 CG LEU B 23 12.215 27.325 -1.996 1.00 1.77 C ATOM 1940 CD1 LEU B 23 11.089 28.384 -1.930 1.00 1.77 C ATOM 1941 CD2 LEU B 23 11.979 26.359 -0.839 1.00 1.86 C ATOM 1942 HA LEU B 23 12.694 28.231 -4.721 1.00 0.00 H ATOM 1943 HB2 LEU B 23 11.193 26.406 -3.600 1.00 0.00 H ATOM 1944 HB3 LEU B 23 12.697 25.593 -3.104 1.00 0.00 H ATOM 1945 HG LEU B 23 13.179 27.828 -1.929 1.00 0.00 H ATOM 1946 HD21 LEU B 23 11.021 25.857 -0.976 1.00 0.00 H ATOM 1947 HD22 LEU B 23 12.779 25.619 -0.816 1.00 0.00 H ATOM 1948 HD23 LEU B 23 11.969 26.914 0.099 1.00 0.00 H ATOM 1949 HD11 LEU B 23 11.222 29.105 -2.737 1.00 0.00 H ATOM 1950 HD12 LEU B 23 10.122 27.892 -2.036 1.00 0.00 H ATOM 1951 HD13 LEU B 23 11.132 28.899 -0.970 1.00 0.00 H ATOM 1952 H LEU B 23 12.781 25.364 -5.466 1.00 0.00 H ATOM 1953 N LEU B 24 15.173 28.202 -4.182 1.00 2.95 N ATOM 1954 CA LEU B 24 16.581 28.228 -3.795 1.00 2.48 C ATOM 1955 C LEU B 24 16.670 28.262 -2.252 1.00 4.37 C ATOM 1956 O LEU B 24 16.450 29.220 -1.502 1.00 4.13 O ATOM 1957 CB LEU B 24 17.322 29.325 -4.492 1.00 1.87 C ATOM 1958 CG LEU B 24 17.187 29.655 -5.978 1.00 1.77 C ATOM 1959 CD1 LEU B 24 18.165 30.792 -6.320 1.00 1.77 C ATOM 1960 CD2 LEU B 24 17.486 28.540 -6.961 1.00 1.77 C ATOM 1961 HA LEU B 24 17.087 27.320 -4.124 1.00 0.00 H ATOM 1962 HB2 LEU B 24 17.056 30.240 -3.963 1.00 0.00 H ATOM 1963 HB3 LEU B 24 18.379 29.111 -4.334 1.00 0.00 H ATOM 1964 HG LEU B 24 16.131 29.898 -6.095 1.00 0.00 H ATOM 1965 HD21 LEU B 24 18.515 28.205 -6.827 1.00 0.00 H ATOM 1966 HD22 LEU B 24 16.805 27.708 -6.782 1.00 0.00 H ATOM 1967 HD23 LEU B 24 17.352 28.908 -7.978 1.00 0.00 H ATOM 1968 HD11 LEU B 24 17.923 31.670 -5.721 1.00 0.00 H ATOM 1969 HD12 LEU B 24 19.184 30.471 -6.102 1.00 0.00 H ATOM 1970 HD13 LEU B 24 18.079 31.038 -7.378 1.00 0.00 H ATOM 1971 H LEU B 24 14.732 29.087 -4.505 1.00 0.00 H ATOM 1972 N ASP B 25 17.096 27.093 -1.740 1.00 4.83 N ATOM 1973 CA ASP B 25 17.233 26.727 -0.382 1.00 3.67 C ATOM 1974 C ASP B 25 18.585 26.522 0.225 1.00 3.56 C ATOM 1975 O ASP B 25 19.128 25.418 0.242 1.00 4.25 O ATOM 1976 CB ASP B 25 16.390 25.414 -0.209 1.00 4.83 C ATOM 1977 CG ASP B 25 16.074 25.249 1.261 1.00 8.12 C ATOM 1978 OD1 ASP B 25 16.887 25.815 2.046 1.00 8.65 O ATOM 1979 OD2 ASP B 25 15.085 24.600 1.658 1.00 8.76 O ATOM 1980 HA ASP B 25 16.900 27.608 0.167 1.00 0.00 H ATOM 1981 HB2 ASP B 25 15.465 25.491 -0.780 1.00 0.00 H ATOM 1982 HB3 ASP B 25 16.963 24.557 -0.562 1.00 0.00 H ATOM 1983 H ASP B 25 17.359 26.364 -2.434 1.00 0.00 H ATOM 1984 N THR B 26 19.132 27.531 0.893 1.00 3.14 N ATOM 1985 CA THR B 26 20.383 27.490 1.613 1.00 2.44 C ATOM 1986 C THR B 26 20.231 26.638 2.873 1.00 3.49 C ATOM 1987 O THR B 26 21.245 26.362 3.567 1.00 5.67 O ATOM 1988 CB THR B 26 20.845 28.883 2.095 1.00 2.40 C ATOM 1989 OG1 THR B 26 19.774 29.405 2.896 1.00 4.06 O ATOM 1990 CG2 THR B 26 21.214 29.821 0.982 1.00 1.77 C ATOM 1991 HA THR B 26 21.113 27.082 0.914 1.00 0.00 H ATOM 1992 HB THR B 26 21.768 28.783 2.667 1.00 0.00 H ATOM 1993 HG1 THR B 26 19.610 28.799 3.661 1.00 0.00 H ATOM 1994 HG23 THR B 26 22.028 29.389 0.400 1.00 0.00 H ATOM 1995 HG21 THR B 26 20.348 29.978 0.339 1.00 0.00 H ATOM 1996 HG22 THR B 26 21.533 30.775 1.403 1.00 0.00 H ATOM 1997 H THR B 26 18.613 28.432 0.898 1.00 0.00 H ATOM 1998 N GLY B 27 19.023 26.195 3.202 1.00 2.90 N ATOM 1999 CA GLY B 27 18.867 25.338 4.382 1.00 2.17 C ATOM 2000 C GLY B 27 18.712 23.850 4.135 1.00 1.95 C ATOM 2001 O GLY B 27 18.402 23.084 5.073 1.00 1.77 O ATOM 2002 HA3 GLY B 27 17.982 25.676 4.920 1.00 0.00 H ATOM 2003 HA2 GLY B 27 19.747 25.478 5.009 1.00 0.00 H ATOM 2004 H GLY B 27 18.195 26.453 2.628 1.00 0.00 H ATOM 2005 N ALA B 28 18.886 23.428 2.905 1.00 2.03 N ATOM 2006 CA ALA B 28 18.819 22.105 2.353 1.00 1.77 C ATOM 2007 C ALA B 28 20.188 21.570 1.945 1.00 2.45 C ATOM 2008 O ALA B 28 20.853 22.177 1.122 1.00 2.65 O ATOM 2009 CB ALA B 28 17.924 22.127 1.121 1.00 1.77 C ATOM 2010 HA ALA B 28 18.420 21.450 3.127 1.00 0.00 H ATOM 2011 HB1 ALA B 28 16.925 22.459 1.405 1.00 0.00 H ATOM 2012 HB2 ALA B 28 18.340 22.813 0.383 1.00 0.00 H ATOM 2013 HB3 ALA B 28 17.868 21.125 0.696 1.00 0.00 H ATOM 2014 H ALA B 28 19.109 24.175 2.217 1.00 0.00 H ATOM 2015 N ASP B 29 20.616 20.437 2.477 1.00 4.43 N ATOM 2016 CA ASP B 29 21.909 19.852 2.108 1.00 5.81 C ATOM 2017 C ASP B 29 21.835 19.225 0.726 1.00 6.19 C ATOM 2018 O ASP B 29 22.846 19.176 0.009 1.00 6.98 O ATOM 2019 CB ASP B 29 22.344 18.763 3.079 1.00 7.39 C ATOM 2020 CG ASP B 29 22.800 19.346 4.401 1.00 11.34 C ATOM 2021 OD1 ASP B 29 21.975 19.977 5.098 1.00 11.43 O ATOM 2022 OD2 ASP B 29 23.995 19.168 4.751 1.00 13.59 O ATOM 2023 HA ASP B 29 22.631 20.668 2.131 1.00 0.00 H ATOM 2024 HB2 ASP B 29 21.504 18.092 3.259 1.00 0.00 H ATOM 2025 HB3 ASP B 29 23.167 18.202 2.637 1.00 0.00 H ATOM 2026 H ASP B 29 20.020 19.948 3.175 1.00 0.00 H ATOM 2027 N ASP B 30 20.666 18.704 0.417 1.00 6.48 N ATOM 2028 CA ASP B 30 20.457 17.997 -0.850 1.00 6.57 C ATOM 2029 C ASP B 30 19.315 18.648 -1.626 1.00 6.23 C ATOM 2030 O ASP B 30 18.535 19.427 -1.076 1.00 6.21 O ATOM 2031 CB ASP B 30 20.165 16.550 -0.521 1.00 8.59 C ATOM 2032 CG ASP B 30 21.292 15.709 -0.027 1.00 13.61 C ATOM 2033 OD1 ASP B 30 22.425 15.668 -0.565 1.00 15.02 O ATOM 2034 OD2 ASP B 30 21.110 14.893 0.953 1.00 18.18 O ATOM 2035 HA ASP B 30 21.341 18.050 -1.485 1.00 0.00 H ATOM 2036 HB2 ASP B 30 19.391 16.541 0.246 1.00 0.00 H ATOM 2037 HB3 ASP B 30 19.782 16.081 -1.427 1.00 0.00 H ATOM 2038 H ASP B 30 19.875 18.796 1.086 1.00 0.00 H ATOM 2039 N THR B 31 19.249 18.369 -2.917 1.00 5.36 N ATOM 2040 CA THR B 31 18.177 18.832 -3.802 1.00 4.30 C ATOM 2041 C THR B 31 17.055 17.791 -3.681 1.00 5.34 C ATOM 2042 O THR B 31 17.407 16.593 -3.729 1.00 7.18 O ATOM 2043 CB THR B 31 18.632 18.871 -5.253 1.00 1.77 C ATOM 2044 OG1 THR B 31 19.607 19.888 -5.367 1.00 1.77 O ATOM 2045 CG2 THR B 31 17.468 19.124 -6.183 1.00 1.77 C ATOM 2046 HA THR B 31 17.865 19.838 -3.520 1.00 0.00 H ATOM 2047 HB THR B 31 19.056 17.909 -5.541 1.00 0.00 H ATOM 2048 HG1 THR B 31 20.370 19.681 -4.771 1.00 0.00 H ATOM 2049 HG23 THR B 31 16.735 18.325 -6.072 1.00 0.00 H ATOM 2050 HG21 THR B 31 17.006 20.079 -5.933 1.00 0.00 H ATOM 2051 HG22 THR B 31 17.826 19.150 -7.212 1.00 0.00 H ATOM 2052 H THR B 31 20.004 17.785 -3.329 1.00 0.00 H ATOM 2053 N VAL B 32 15.833 18.225 -3.544 1.00 4.95 N ATOM 2054 CA VAL B 32 14.660 17.370 -3.408 1.00 5.16 C ATOM 2055 C VAL B 32 13.659 17.813 -4.476 1.00 5.60 C ATOM 2056 O VAL B 32 13.287 18.991 -4.451 1.00 5.61 O ATOM 2057 CB VAL B 32 13.995 17.502 -2.029 1.00 5.99 C ATOM 2058 CG1 VAL B 32 12.827 16.529 -1.876 1.00 6.35 C ATOM 2059 CG2 VAL B 32 14.954 17.281 -0.865 1.00 5.65 C ATOM 2060 HA VAL B 32 14.966 16.330 -3.522 1.00 0.00 H ATOM 2061 HB VAL B 32 13.642 18.532 -1.989 1.00 0.00 H ATOM 2062 HG11 VAL B 32 12.080 16.737 -2.642 1.00 0.00 H ATOM 2063 HG12 VAL B 32 13.190 15.507 -1.989 1.00 0.00 H ATOM 2064 HG13 VAL B 32 12.381 16.651 -0.889 1.00 0.00 H ATOM 2065 HG21 VAL B 32 15.376 16.278 -0.929 1.00 0.00 H ATOM 2066 HG22 VAL B 32 15.756 18.018 -0.912 1.00 0.00 H ATOM 2067 HG23 VAL B 32 14.413 17.390 0.075 1.00 0.00 H ATOM 2068 H VAL B 32 15.685 19.254 -3.531 1.00 0.00 H ATOM 2069 N LEU B 33 13.265 16.903 -5.345 1.00 5.32 N ATOM 2070 CA LEU B 33 12.329 17.331 -6.411 1.00 6.74 C ATOM 2071 C LEU B 33 10.993 16.629 -6.231 1.00 8.38 C ATOM 2072 O LEU B 33 10.919 15.645 -5.488 1.00 9.31 O ATOM 2073 CB LEU B 33 12.951 17.046 -7.744 1.00 5.64 C ATOM 2074 CG LEU B 33 14.247 17.485 -8.344 1.00 5.03 C ATOM 2075 CD1 LEU B 33 14.382 16.869 -9.760 1.00 4.42 C ATOM 2076 CD2 LEU B 33 14.485 18.979 -8.497 1.00 4.08 C ATOM 2077 HA LEU B 33 12.138 18.402 -6.352 1.00 0.00 H ATOM 2078 HB2 LEU B 33 13.005 15.958 -7.777 1.00 0.00 H ATOM 2079 HB3 LEU B 33 12.204 17.393 -8.458 1.00 0.00 H ATOM 2080 HG LEU B 33 14.985 17.140 -7.619 1.00 0.00 H ATOM 2081 HD21 LEU B 33 13.713 19.405 -9.138 1.00 0.00 H ATOM 2082 HD22 LEU B 33 14.447 19.454 -7.517 1.00 0.00 H ATOM 2083 HD23 LEU B 33 15.464 19.146 -8.945 1.00 0.00 H ATOM 2084 HD11 LEU B 33 14.360 15.782 -9.685 1.00 0.00 H ATOM 2085 HD12 LEU B 33 13.554 17.208 -10.383 1.00 0.00 H ATOM 2086 HD13 LEU B 33 15.326 17.185 -10.204 1.00 0.00 H ATOM 2087 H LEU B 33 13.599 15.920 -5.284 1.00 0.00 H ATOM 2088 N GLU B 34 9.933 17.098 -6.896 1.00 10.57 N ATOM 2089 CA GLU B 34 8.628 16.440 -6.785 1.00 11.24 C ATOM 2090 C GLU B 34 8.680 15.137 -7.589 1.00 12.76 C ATOM 2091 O GLU B 34 9.600 14.790 -8.344 1.00 11.97 O ATOM 2092 CB GLU B 34 7.449 17.294 -7.102 1.00 12.49 C ATOM 2093 CG GLU B 34 7.198 17.758 -8.514 1.00 13.61 C ATOM 2094 CD GLU B 34 6.934 19.252 -8.624 1.00 15.76 C ATOM 2095 OE1 GLU B 34 6.510 19.899 -7.634 1.00 15.81 O ATOM 2096 OE2 GLU B 34 7.203 19.844 -9.720 1.00 16.74 O ATOM 2097 HA GLU B 34 8.456 16.218 -5.732 1.00 0.00 H ATOM 2098 HB2 GLU B 34 6.566 16.734 -6.795 1.00 0.00 H ATOM 2099 HB3 GLU B 34 7.539 18.191 -6.490 1.00 0.00 H ATOM 2100 HG2 GLU B 34 8.073 17.517 -9.117 1.00 0.00 H ATOM 2101 HG3 GLU B 34 6.331 17.225 -8.904 1.00 0.00 H ATOM 2102 H GLU B 34 10.035 17.939 -7.499 1.00 0.00 H ATOM 2103 N GLU B 35 7.626 14.391 -7.295 1.00 14.52 N ATOM 2104 CA GLU B 35 7.424 13.087 -7.856 1.00 16.90 C ATOM 2105 C GLU B 35 7.604 13.222 -9.363 1.00 18.34 C ATOM 2106 O GLU B 35 6.880 14.063 -9.888 1.00 18.93 O ATOM 2107 CB GLU B 35 6.011 12.518 -7.610 1.00 18.94 C ATOM 2108 CG GLU B 35 5.931 11.163 -8.365 1.00 20.63 C ATOM 2109 CD GLU B 35 7.107 10.336 -7.831 1.00 23.52 C ATOM 2110 OE1 GLU B 35 7.365 10.394 -6.592 1.00 23.67 O ATOM 2111 OE2 GLU B 35 7.745 9.685 -8.680 1.00 25.72 O ATOM 2112 HA GLU B 35 8.133 12.408 -7.383 1.00 0.00 H ATOM 2113 HB2 GLU B 35 5.850 12.363 -6.543 1.00 0.00 H ATOM 2114 HB3 GLU B 35 5.258 13.206 -7.994 1.00 0.00 H ATOM 2115 HG2 GLU B 35 4.985 10.663 -8.155 1.00 0.00 H ATOM 2116 HG3 GLU B 35 6.028 11.317 -9.440 1.00 0.00 H ATOM 2117 H GLU B 35 6.918 14.765 -6.632 1.00 0.00 H ATOM 2118 N MET B 36 8.487 12.416 -9.906 1.00 20.31 N ATOM 2119 CA MET B 36 8.736 12.486 -11.349 1.00 22.01 C ATOM 2120 C MET B 36 9.533 11.318 -11.881 1.00 23.04 C ATOM 2121 O MET B 36 10.095 10.550 -11.074 1.00 24.09 O ATOM 2122 CB MET B 36 9.388 13.815 -11.651 1.00 25.16 C ATOM 2123 CG MET B 36 10.872 14.000 -11.408 1.00 27.92 C ATOM 2124 SD MET B 36 11.225 15.770 -11.695 1.00 32.64 S ATOM 2125 CE MET B 36 10.535 15.948 -13.338 1.00 32.17 C ATOM 2126 HA MET B 36 7.782 12.415 -11.872 1.00 0.00 H ATOM 2127 HB2 MET B 36 9.213 14.019 -12.707 1.00 0.00 H ATOM 2128 HB3 MET B 36 8.874 14.563 -11.048 1.00 0.00 H ATOM 2129 HG2 MET B 36 11.447 13.384 -12.099 1.00 0.00 H ATOM 2130 HG3 MET B 36 11.124 13.726 -10.383 1.00 0.00 H ATOM 2131 HE1 MET B 36 11.050 15.273 -14.022 1.00 0.00 H ATOM 2132 HE2 MET B 36 9.473 15.702 -13.313 1.00 0.00 H ATOM 2133 HE3 MET B 36 10.664 16.977 -13.675 1.00 0.00 H ATOM 2134 H MET B 36 9.006 11.733 -9.317 1.00 0.00 H ATOM 2135 N ASN B 37 9.551 11.203 -13.214 1.00 22.93 N ATOM 2136 CA ASN B 37 10.309 10.117 -13.819 1.00 24.19 C ATOM 2137 C ASN B 37 11.693 10.562 -14.223 1.00 24.75 C ATOM 2138 O ASN B 37 11.790 11.420 -15.107 1.00 25.03 O ATOM 2139 CB ASN B 37 9.602 9.577 -15.069 1.00 27.53 C ATOM 2140 CG ASN B 37 8.419 8.767 -14.514 1.00 30.37 C ATOM 2141 OD1 ASN B 37 7.854 7.907 -15.180 1.00 31.21 O ATOM 2142 ND2 ASN B 37 8.206 9.163 -13.252 1.00 31.49 N ATOM 2143 HA ASN B 37 10.382 9.336 -13.062 1.00 0.00 H ATOM 2144 HB2 ASN B 37 9.250 10.395 -15.698 1.00 0.00 H ATOM 2145 HB3 ASN B 37 10.271 8.939 -15.646 1.00 0.00 H ATOM 2146 HD22 ASN B 37 8.788 9.919 -12.839 1.00 0.00 H ATOM 2147 HD21 ASN B 37 7.458 8.714 -12.685 1.00 0.00 H ATOM 2148 H ASN B 37 9.031 11.879 -13.809 1.00 0.00 H ATOM 2149 N LEU B 38 12.672 9.952 -13.539 1.00 23.69 N ATOM 2150 CA LEU B 38 14.059 10.304 -13.909 1.00 21.77 C ATOM 2151 C LEU B 38 14.706 9.024 -14.438 1.00 21.71 C ATOM 2152 O LEU B 38 14.307 7.906 -14.070 1.00 22.44 O ATOM 2153 CB LEU B 38 14.828 10.932 -12.772 1.00 18.79 C ATOM 2154 CG LEU B 38 14.474 12.369 -12.406 1.00 17.57 C ATOM 2155 CD1 LEU B 38 14.318 12.510 -10.893 1.00 16.43 C ATOM 2156 CD2 LEU B 38 15.469 13.378 -12.938 1.00 16.31 C ATOM 2157 HA LEU B 38 14.066 11.076 -14.679 1.00 0.00 H ATOM 2158 HB2 LEU B 38 14.666 10.318 -11.886 1.00 0.00 H ATOM 2159 HB3 LEU B 38 15.885 10.911 -13.039 1.00 0.00 H ATOM 2160 HG LEU B 38 13.522 12.591 -12.888 1.00 0.00 H ATOM 2161 HD21 LEU B 38 16.456 13.165 -12.527 1.00 0.00 H ATOM 2162 HD22 LEU B 38 15.505 13.312 -14.025 1.00 0.00 H ATOM 2163 HD23 LEU B 38 15.160 14.381 -12.643 1.00 0.00 H ATOM 2164 HD11 LEU B 38 13.523 11.849 -10.548 1.00 0.00 H ATOM 2165 HD12 LEU B 38 15.255 12.239 -10.406 1.00 0.00 H ATOM 2166 HD13 LEU B 38 14.065 13.542 -10.650 1.00 0.00 H ATOM 2167 H LEU B 38 12.466 9.265 -12.786 1.00 0.00 H ATOM 2168 N PRO B 39 15.664 9.244 -15.326 1.00 20.81 N ATOM 2169 CA PRO B 39 16.406 8.133 -15.888 1.00 20.43 C ATOM 2170 C PRO B 39 17.247 7.386 -14.856 1.00 20.27 C ATOM 2171 O PRO B 39 18.006 8.050 -14.108 1.00 21.00 O ATOM 2172 CB PRO B 39 17.316 8.857 -16.909 1.00 20.17 C ATOM 2173 CG PRO B 39 17.531 10.225 -16.311 1.00 19.84 C ATOM 2174 CD PRO B 39 16.137 10.566 -15.792 1.00 20.44 C ATOM 2175 HA PRO B 39 15.758 7.363 -16.306 1.00 0.00 H ATOM 2176 HD3 PRO B 39 16.181 11.285 -14.974 1.00 0.00 H ATOM 2177 HD2 PRO B 39 15.502 10.960 -16.585 1.00 0.00 H ATOM 2178 HG3 PRO B 39 17.859 10.940 -17.065 1.00 0.00 H ATOM 2179 HG2 PRO B 39 18.259 10.194 -15.501 1.00 0.00 H ATOM 2180 HB2 PRO B 39 18.264 8.331 -17.023 1.00 0.00 H ATOM 2181 HB3 PRO B 39 16.825 8.932 -17.879 1.00 0.00 H ATOM 2182 N GLY B 40 17.174 6.045 -14.828 1.00 18.28 N ATOM 2183 CA GLY B 40 18.030 5.245 -14.014 1.00 15.91 C ATOM 2184 C GLY B 40 17.692 4.435 -12.834 1.00 15.36 C ATOM 2185 O GLY B 40 16.520 4.150 -12.512 1.00 15.81 O ATOM 2186 HA3 GLY B 40 18.792 5.939 -13.658 1.00 0.00 H ATOM 2187 HA2 GLY B 40 18.481 4.537 -14.709 1.00 0.00 H ATOM 2188 H GLY B 40 16.465 5.571 -15.423 1.00 0.00 H ATOM 2189 N ARG B 41 18.737 4.008 -12.090 1.00 13.72 N ATOM 2190 CA ARG B 41 18.449 3.240 -10.876 1.00 13.45 C ATOM 2191 C ARG B 41 18.613 4.109 -9.633 1.00 12.71 C ATOM 2192 O ARG B 41 19.684 4.682 -9.439 1.00 14.36 O ATOM 2193 CB ARG B 41 19.330 1.996 -10.694 1.00 11.33 C ATOM 2194 CG ARG B 41 19.156 0.944 -11.746 1.00 10.71 C ATOM 2195 CD ARG B 41 20.248 -0.114 -11.651 1.00 12.31 C ATOM 2196 NE ARG B 41 20.273 -0.691 -10.315 1.00 12.35 N ATOM 2197 CZ ARG B 41 19.348 -1.503 -9.824 1.00 13.49 C ATOM 2198 NH1 ARG B 41 18.298 -1.832 -10.573 1.00 11.89 N ATOM 2199 NH2 ARG B 41 19.483 -1.971 -8.572 1.00 14.06 N ATOM 2200 HA ARG B 41 17.418 2.907 -10.999 1.00 0.00 H ATOM 2201 HB2 ARG B 41 20.372 2.314 -10.701 1.00 0.00 H ATOM 2202 HB3 ARG B 41 19.094 1.551 -9.727 1.00 0.00 H ATOM 2203 HG2 ARG B 41 18.185 0.466 -11.615 1.00 0.00 H ATOM 2204 HG3 ARG B 41 19.199 1.413 -12.729 1.00 0.00 H ATOM 2205 HD2 ARG B 41 21.214 0.345 -11.864 1.00 0.00 H ATOM 2206 HD3 ARG B 41 20.052 -0.901 -12.380 1.00 0.00 H ATOM 2207 HE ARG B 41 21.076 -0.448 -9.700 1.00 0.00 H ATOM 2208 HH12 ARG B 41 17.568 -2.469 -10.194 1.00 0.00 H ATOM 2209 HH11 ARG B 41 18.207 -1.452 -11.537 1.00 0.00 H ATOM 2210 HH22 ARG B 41 18.764 -2.609 -8.175 1.00 0.00 H ATOM 2211 HH21 ARG B 41 20.307 -1.695 -8.000 1.00 0.00 H ATOM 2212 H ARG B 41 19.716 4.218 -12.371 1.00 0.00 H ATOM 2213 N TRP B 42 17.634 4.085 -8.766 1.00 11.15 N ATOM 2214 CA TRP B 42 17.732 4.822 -7.510 1.00 10.65 C ATOM 2215 C TRP B 42 18.119 3.957 -6.320 1.00 12.28 C ATOM 2216 O TRP B 42 17.907 2.729 -6.367 1.00 14.47 O ATOM 2217 CB TRP B 42 16.334 5.365 -7.231 1.00 7.65 C ATOM 2218 CG TRP B 42 15.234 4.378 -7.129 1.00 5.31 C ATOM 2219 CD1 TRP B 42 14.542 3.781 -8.150 1.00 4.10 C ATOM 2220 CD2 TRP B 42 14.633 3.919 -5.908 1.00 4.75 C ATOM 2221 NE1 TRP B 42 13.555 2.962 -7.624 1.00 2.32 N ATOM 2222 CE2 TRP B 42 13.569 3.054 -6.265 1.00 3.29 C ATOM 2223 CE3 TRP B 42 14.875 4.173 -4.553 1.00 5.39 C ATOM 2224 CZ2 TRP B 42 12.768 2.444 -5.304 1.00 3.74 C ATOM 2225 CZ3 TRP B 42 14.060 3.545 -3.617 1.00 5.01 C ATOM 2226 CH2 TRP B 42 13.025 2.681 -3.985 1.00 3.76 C ATOM 2227 HA TRP B 42 18.505 5.583 -7.621 1.00 0.00 H ATOM 2228 HB2 TRP B 42 16.375 5.910 -6.288 1.00 0.00 H ATOM 2229 HB3 TRP B 42 16.083 6.055 -8.037 1.00 0.00 H ATOM 2230 HE1 TRP B 42 12.905 2.370 -8.180 1.00 0.00 H ATOM 2231 HD1 TRP B 42 14.738 3.928 -9.212 1.00 0.00 H ATOM 2232 HZ2 TRP B 42 11.949 1.788 -5.600 1.00 0.00 H ATOM 2233 HH2 TRP B 42 12.422 2.196 -3.217 1.00 0.00 H ATOM 2234 HZ3 TRP B 42 14.235 3.734 -2.558 1.00 0.00 H ATOM 2235 HE3 TRP B 42 15.677 4.842 -4.241 1.00 0.00 H ATOM 2236 H TRP B 42 16.776 3.535 -8.974 1.00 0.00 H ATOM 2237 N LYS B 43 18.636 4.593 -5.286 1.00 12.94 N ATOM 2238 CA LYS B 43 18.927 3.927 -4.001 1.00 13.84 C ATOM 2239 C LYS B 43 17.990 4.623 -3.006 1.00 12.79 C ATOM 2240 O LYS B 43 17.442 5.680 -3.352 1.00 14.96 O ATOM 2241 CB LYS B 43 20.349 3.996 -3.531 1.00 15.46 C ATOM 2242 CG LYS B 43 21.402 4.352 -4.544 1.00 19.74 C ATOM 2243 CD LYS B 43 22.810 4.425 -3.957 1.00 24.29 C ATOM 2244 CE LYS B 43 22.835 5.159 -2.611 1.00 25.53 C ATOM 2245 NZ LYS B 43 22.467 4.173 -1.518 1.00 28.50 N ATOM 2246 HA LYS B 43 18.768 2.854 -4.105 1.00 0.00 H ATOM 2247 HB2 LYS B 43 20.394 4.742 -2.738 1.00 0.00 H ATOM 2248 HB3 LYS B 43 20.606 3.018 -3.124 1.00 0.00 H ATOM 2249 HG2 LYS B 43 21.394 3.597 -5.330 1.00 0.00 H ATOM 2250 HG3 LYS B 43 21.155 5.324 -4.972 1.00 0.00 H ATOM 2251 HD2 LYS B 43 23.184 3.411 -3.812 1.00 0.00 H ATOM 2252 HD3 LYS B 43 23.457 4.953 -4.658 1.00 0.00 H ATOM 2253 HE2 LYS B 43 22.116 5.978 -2.625 1.00 0.00 H ATOM 2254 HE3 LYS B 43 23.833 5.557 -2.427 1.00 0.00 H ATOM 2255 HZ1 LYS B 43 21.515 3.796 -1.699 1.00 0.00 H ATOM 2256 HZ2 LYS B 43 23.155 3.393 -1.510 1.00 0.00 H ATOM 2257 HZ3 LYS B 43 22.480 4.657 -0.598 1.00 0.00 H ATOM 2258 H LYS B 43 18.848 5.607 -5.380 1.00 0.00 H ATOM 2259 N PRO B 44 17.856 4.086 -1.838 1.00 12.08 N ATOM 2260 CA PRO B 44 16.986 4.691 -0.822 1.00 12.10 C ATOM 2261 C PRO B 44 17.784 5.667 0.023 1.00 12.13 C ATOM 2262 O PRO B 44 18.954 5.388 0.282 1.00 12.20 O ATOM 2263 CB PRO B 44 16.526 3.488 0.006 1.00 11.04 C ATOM 2264 CG PRO B 44 17.356 2.334 -0.434 1.00 11.45 C ATOM 2265 CD PRO B 44 18.484 2.861 -1.308 1.00 11.50 C ATOM 2266 HA PRO B 44 16.151 5.257 -1.236 1.00 0.00 H ATOM 2267 HD3 PRO B 44 19.376 3.085 -0.724 1.00 0.00 H ATOM 2268 HD2 PRO B 44 18.739 2.161 -2.104 1.00 0.00 H ATOM 2269 HG3 PRO B 44 16.744 1.635 -1.004 1.00 0.00 H ATOM 2270 HG2 PRO B 44 17.771 1.825 0.436 1.00 0.00 H ATOM 2271 HB2 PRO B 44 16.679 3.680 1.068 1.00 0.00 H ATOM 2272 HB3 PRO B 44 15.471 3.285 -0.177 1.00 0.00 H ATOM 2273 N LYS B 45 17.125 6.743 0.440 1.00 12.91 N ATOM 2274 CA LYS B 45 17.767 7.739 1.311 1.00 12.65 C ATOM 2275 C LYS B 45 16.826 8.340 2.338 1.00 13.74 C ATOM 2276 O LYS B 45 15.630 8.495 2.028 1.00 15.36 O ATOM 2277 CB LYS B 45 18.391 8.840 0.461 1.00 11.28 C ATOM 2278 CG LYS B 45 19.688 9.370 1.093 1.00 9.87 C ATOM 2279 CD LYS B 45 19.558 10.874 1.131 1.00 12.11 C ATOM 2280 CE LYS B 45 20.640 11.455 2.036 1.00 15.31 C ATOM 2281 NZ LYS B 45 21.901 11.649 1.229 1.00 20.07 N ATOM 2282 HA LYS B 45 18.538 7.214 1.874 1.00 0.00 H ATOM 2283 HB2 LYS B 45 18.616 8.441 -0.528 1.00 0.00 H ATOM 2284 HB3 LYS B 45 17.681 9.661 0.367 1.00 0.00 H ATOM 2285 HG2 LYS B 45 19.805 8.975 2.102 1.00 0.00 H ATOM 2286 HG3 LYS B 45 20.548 9.080 0.489 1.00 0.00 H ATOM 2287 HD2 LYS B 45 19.673 11.275 0.124 1.00 0.00 H ATOM 2288 HD3 LYS B 45 18.576 11.144 1.519 1.00 0.00 H ATOM 2289 HE2 LYS B 45 20.835 10.769 2.860 1.00 0.00 H ATOM 2290 HE3 LYS B 45 20.309 12.414 2.434 1.00 0.00 H ATOM 2291 HZ1 LYS B 45 22.214 10.732 0.851 1.00 0.00 H ATOM 2292 HZ2 LYS B 45 21.711 12.303 0.443 1.00 0.00 H ATOM 2293 HZ3 LYS B 45 22.644 12.045 1.839 1.00 0.00 H ATOM 2294 H LYS B 45 16.138 6.883 0.145 1.00 0.00 H ATOM 2295 N MET B 46 17.346 8.670 3.506 1.00 14.34 N ATOM 2296 CA MET B 46 16.610 9.309 4.581 1.00 15.04 C ATOM 2297 C MET B 46 17.082 10.758 4.768 1.00 13.42 C ATOM 2298 O MET B 46 18.267 11.046 4.729 1.00 13.37 O ATOM 2299 CB MET B 46 16.679 8.618 5.943 1.00 19.04 C ATOM 2300 CG MET B 46 15.598 7.546 6.111 1.00 24.40 C ATOM 2301 SD MET B 46 15.032 7.448 7.842 1.00 31.80 S ATOM 2302 CE MET B 46 13.264 7.199 7.549 1.00 28.81 C ATOM 2303 HA MET B 46 15.572 9.247 4.253 1.00 0.00 H ATOM 2304 HB2 MET B 46 17.657 8.148 6.048 1.00 0.00 H ATOM 2305 HB3 MET B 46 16.552 9.369 6.723 1.00 0.00 H ATOM 2306 HG2 MET B 46 16.006 6.580 5.814 1.00 0.00 H ATOM 2307 HG3 MET B 46 14.750 7.793 5.472 1.00 0.00 H ATOM 2308 HE1 MET B 46 12.866 8.047 6.992 1.00 0.00 H ATOM 2309 HE2 MET B 46 13.118 6.284 6.974 1.00 0.00 H ATOM 2310 HE3 MET B 46 12.747 7.116 8.505 1.00 0.00 H ATOM 2311 H MET B 46 18.351 8.458 3.666 1.00 0.00 H ATOM 2312 N ILE B 47 16.089 11.608 4.978 1.00 11.94 N ATOM 2313 CA ILE B 47 16.271 13.033 5.188 1.00 10.57 C ATOM 2314 C ILE B 47 15.307 13.505 6.274 1.00 10.95 C ATOM 2315 O ILE B 47 14.260 12.881 6.446 1.00 11.79 O ATOM 2316 CB ILE B 47 16.135 13.812 3.890 1.00 9.46 C ATOM 2317 CG1 ILE B 47 14.826 13.482 3.143 1.00 8.97 C ATOM 2318 CG2 ILE B 47 17.321 13.571 2.945 1.00 7.18 C ATOM 2319 CD1 ILE B 47 14.514 14.662 2.202 1.00 9.04 C ATOM 2320 HA ILE B 47 17.287 13.225 5.533 1.00 0.00 H ATOM 2321 HB ILE B 47 16.119 14.862 4.182 1.00 0.00 H ATOM 2322 HG12 ILE B 47 14.949 12.567 2.564 1.00 0.00 H ATOM 2323 HG13 ILE B 47 14.013 13.351 3.857 1.00 0.00 H ATOM 2324 HD11 ILE B 47 14.397 15.573 2.790 1.00 0.00 H ATOM 2325 HD12 ILE B 47 15.334 14.788 1.495 1.00 0.00 H ATOM 2326 HD13 ILE B 47 13.592 14.458 1.659 1.00 0.00 H ATOM 2327 HG21 ILE B 47 18.243 13.884 3.434 1.00 0.00 H ATOM 2328 HG22 ILE B 47 17.380 12.510 2.701 1.00 0.00 H ATOM 2329 HG23 ILE B 47 17.179 14.148 2.031 1.00 0.00 H ATOM 2330 H ILE B 47 15.119 11.232 4.993 1.00 0.00 H ATOM 2331 N GLY B 48 15.697 14.519 7.038 1.00 10.30 N ATOM 2332 CA GLY B 48 14.955 15.051 8.148 1.00 8.94 C ATOM 2333 C GLY B 48 14.748 16.537 7.947 1.00 10.49 C ATOM 2334 O GLY B 48 15.499 17.272 7.298 1.00 10.76 O ATOM 2335 HA3 GLY B 48 15.509 14.882 9.071 1.00 0.00 H ATOM 2336 HA2 GLY B 48 13.987 14.554 8.211 1.00 0.00 H ATOM 2337 H GLY B 48 16.611 14.963 6.816 1.00 0.00 H ATOM 2338 N GLY B 49 13.657 16.986 8.516 1.00 10.79 N ATOM 2339 CA GLY B 49 13.255 18.401 8.464 1.00 11.11 C ATOM 2340 C GLY B 49 12.427 18.617 9.736 1.00 10.89 C ATOM 2341 O GLY B 49 12.607 17.910 10.719 1.00 12.79 O ATOM 2342 HA3 GLY B 49 12.655 18.598 7.576 1.00 0.00 H ATOM 2343 HA2 GLY B 49 14.131 19.050 8.460 1.00 0.00 H ATOM 2344 H GLY B 49 13.049 16.314 9.026 1.00 0.00 H ATOM 2345 N ILE B 50 11.540 19.539 9.647 1.00 10.56 N ATOM 2346 CA ILE B 50 10.631 19.840 10.741 1.00 10.67 C ATOM 2347 C ILE B 50 9.880 18.628 11.204 1.00 11.46 C ATOM 2348 O ILE B 50 10.087 18.116 12.331 1.00 12.12 O ATOM 2349 CB ILE B 50 9.739 21.013 10.236 1.00 10.22 C ATOM 2350 CG1 ILE B 50 10.525 22.311 10.558 1.00 7.61 C ATOM 2351 CG2 ILE B 50 8.375 21.067 10.875 1.00 10.63 C ATOM 2352 CD1 ILE B 50 10.901 22.189 12.047 1.00 7.22 C ATOM 2353 HA ILE B 50 11.158 20.149 11.644 1.00 0.00 H ATOM 2354 HB ILE B 50 9.545 20.880 9.172 1.00 0.00 H ATOM 2355 HG12 ILE B 50 11.421 22.380 9.941 1.00 0.00 H ATOM 2356 HG13 ILE B 50 9.901 23.189 10.391 1.00 0.00 H ATOM 2357 HD11 ILE B 50 9.993 22.109 12.644 1.00 0.00 H ATOM 2358 HD12 ILE B 50 11.514 21.300 12.194 1.00 0.00 H ATOM 2359 HD13 ILE B 50 11.462 23.073 12.352 1.00 0.00 H ATOM 2360 HG21 ILE B 50 7.839 20.141 10.664 1.00 0.00 H ATOM 2361 HG22 ILE B 50 8.485 21.187 11.953 1.00 0.00 H ATOM 2362 HG23 ILE B 50 7.818 21.911 10.469 1.00 0.00 H ATOM 2363 H ILE B 50 11.469 20.088 8.766 1.00 0.00 H ATOM 2364 N GLY B 51 8.964 18.112 10.392 1.00 11.27 N ATOM 2365 CA GLY B 51 8.178 16.977 10.896 1.00 12.28 C ATOM 2366 C GLY B 51 8.984 15.808 11.418 1.00 12.19 C ATOM 2367 O GLY B 51 8.433 15.012 12.174 1.00 12.46 O ATOM 2368 HA3 GLY B 51 7.550 16.615 10.082 1.00 0.00 H ATOM 2369 HA2 GLY B 51 7.547 17.339 11.707 1.00 0.00 H ATOM 2370 H GLY B 51 8.809 18.496 9.438 1.00 0.00 H ATOM 2371 N GLY B 52 10.212 15.649 10.997 1.00 11.92 N ATOM 2372 CA GLY B 52 11.101 14.554 11.281 1.00 11.75 C ATOM 2373 C GLY B 52 11.715 14.006 9.988 1.00 12.86 C ATOM 2374 O GLY B 52 11.948 14.733 8.991 1.00 12.71 O ATOM 2375 HA3 GLY B 52 10.544 13.760 11.778 1.00 0.00 H ATOM 2376 HA2 GLY B 52 11.899 14.901 11.937 1.00 0.00 H ATOM 2377 H GLY B 52 10.590 16.401 10.386 1.00 0.00 H ATOM 2378 N PHE B 53 11.976 12.706 9.991 1.00 12.70 N ATOM 2379 CA PHE B 53 12.593 12.001 8.883 1.00 12.09 C ATOM 2380 C PHE B 53 11.658 11.229 7.975 1.00 12.39 C ATOM 2381 O PHE B 53 10.600 10.699 8.365 1.00 12.79 O ATOM 2382 CB PHE B 53 13.617 11.007 9.484 1.00 12.74 C ATOM 2383 CG PHE B 53 14.744 11.765 10.129 1.00 13.41 C ATOM 2384 CD1 PHE B 53 14.530 12.477 11.291 1.00 12.97 C ATOM 2385 CD2 PHE B 53 15.998 11.775 9.534 1.00 14.02 C ATOM 2386 CE1 PHE B 53 15.544 13.192 11.868 1.00 12.52 C ATOM 2387 CE2 PHE B 53 17.037 12.509 10.098 1.00 14.68 C ATOM 2388 CZ PHE B 53 16.797 13.223 11.273 1.00 15.14 C ATOM 2389 HA PHE B 53 13.033 12.769 8.246 1.00 0.00 H ATOM 2390 HB2 PHE B 53 13.123 10.386 10.232 1.00 0.00 H ATOM 2391 HB3 PHE B 53 14.014 10.373 8.692 1.00 0.00 H ATOM 2392 HD2 PHE B 53 16.170 11.205 8.621 1.00 0.00 H ATOM 2393 HE2 PHE B 53 18.021 12.526 9.630 1.00 0.00 H ATOM 2394 HZ PHE B 53 17.598 13.808 11.725 1.00 0.00 H ATOM 2395 HE1 PHE B 53 15.367 13.737 12.795 1.00 0.00 H ATOM 2396 HD1 PHE B 53 13.543 12.470 11.754 1.00 0.00 H ATOM 2397 H PHE B 53 11.723 12.159 10.838 1.00 0.00 H ATOM 2398 N ILE B 54 12.107 11.130 6.718 1.00 11.24 N ATOM 2399 CA ILE B 54 11.388 10.364 5.700 1.00 11.16 C ATOM 2400 C ILE B 54 12.381 9.646 4.797 1.00 12.03 C ATOM 2401 O ILE B 54 13.587 9.960 4.839 1.00 12.10 O ATOM 2402 CB ILE B 54 10.384 11.181 4.913 1.00 10.58 C ATOM 2403 CG1 ILE B 54 11.067 12.205 4.007 1.00 11.21 C ATOM 2404 CG2 ILE B 54 9.423 11.951 5.831 1.00 11.81 C ATOM 2405 CD1 ILE B 54 10.012 12.816 3.100 1.00 11.54 C ATOM 2406 HA ILE B 54 10.784 9.622 6.223 1.00 0.00 H ATOM 2407 HB ILE B 54 9.831 10.458 4.313 1.00 0.00 H ATOM 2408 HG12 ILE B 54 11.529 12.984 4.613 1.00 0.00 H ATOM 2409 HG13 ILE B 54 11.832 11.714 3.405 1.00 0.00 H ATOM 2410 HD11 ILE B 54 9.553 12.031 2.499 1.00 0.00 H ATOM 2411 HD12 ILE B 54 9.250 13.303 3.708 1.00 0.00 H ATOM 2412 HD13 ILE B 54 10.480 13.551 2.444 1.00 0.00 H ATOM 2413 HG21 ILE B 54 8.874 11.245 6.455 1.00 0.00 H ATOM 2414 HG22 ILE B 54 9.994 12.630 6.465 1.00 0.00 H ATOM 2415 HG23 ILE B 54 8.721 12.522 5.223 1.00 0.00 H ATOM 2416 H ILE B 54 12.992 11.611 6.458 1.00 0.00 H ATOM 2417 N LYS B 55 11.882 8.640 4.069 1.00 12.04 N ATOM 2418 CA LYS B 55 12.823 7.946 3.148 1.00 12.68 C ATOM 2419 C LYS B 55 12.407 8.440 1.755 1.00 11.21 C ATOM 2420 O LYS B 55 11.180 8.427 1.546 1.00 11.21 O ATOM 2421 CB LYS B 55 12.830 6.459 3.205 1.00 16.89 C ATOM 2422 CG LYS B 55 13.258 5.767 4.506 1.00 20.78 C ATOM 2423 CD LYS B 55 12.809 4.278 4.411 1.00 22.71 C ATOM 2424 CE LYS B 55 13.396 3.718 3.092 1.00 24.40 C ATOM 2425 NZ LYS B 55 13.458 2.226 3.139 1.00 23.96 N ATOM 2426 HA LYS B 55 13.847 8.187 3.433 1.00 0.00 H ATOM 2427 HB2 LYS B 55 11.816 6.126 2.984 1.00 0.00 H ATOM 2428 HB3 LYS B 55 13.504 6.112 2.422 1.00 0.00 H ATOM 2429 HG2 LYS B 55 14.341 5.824 4.620 1.00 0.00 H ATOM 2430 HG3 LYS B 55 12.779 6.247 5.359 1.00 0.00 H ATOM 2431 HD2 LYS B 55 13.192 3.715 5.262 1.00 0.00 H ATOM 2432 HD3 LYS B 55 11.721 4.214 4.395 1.00 0.00 H ATOM 2433 HE2 LYS B 55 14.401 4.115 2.949 1.00 0.00 H ATOM 2434 HE3 LYS B 55 12.764 4.025 2.259 1.00 0.00 H ATOM 2435 HZ1 LYS B 55 14.063 1.930 3.931 1.00 0.00 H ATOM 2436 HZ2 LYS B 55 12.500 1.844 3.272 1.00 0.00 H ATOM 2437 HZ3 LYS B 55 13.854 1.868 2.246 1.00 0.00 H ATOM 2438 H LYS B 55 10.884 8.357 4.143 1.00 0.00 H ATOM 2439 N VAL B 56 13.421 8.855 1.008 1.00 9.21 N ATOM 2440 CA VAL B 56 13.140 9.392 -0.330 1.00 8.73 C ATOM 2441 C VAL B 56 13.916 8.459 -1.256 1.00 7.62 C ATOM 2442 O VAL B 56 14.523 7.576 -0.640 1.00 8.78 O ATOM 2443 CB VAL B 56 13.494 10.860 -0.536 1.00 10.64 C ATOM 2444 CG1 VAL B 56 13.072 11.816 0.582 1.00 8.33 C ATOM 2445 CG2 VAL B 56 14.981 11.097 -0.835 1.00 11.06 C ATOM 2446 HA VAL B 56 12.068 9.408 -0.525 1.00 0.00 H ATOM 2447 HB VAL B 56 12.892 11.101 -1.412 1.00 0.00 H ATOM 2448 HG11 VAL B 56 11.989 11.779 0.700 1.00 0.00 H ATOM 2449 HG12 VAL B 56 13.551 11.517 1.514 1.00 0.00 H ATOM 2450 HG13 VAL B 56 13.376 12.831 0.325 1.00 0.00 H ATOM 2451 HG21 VAL B 56 15.581 10.731 -0.002 1.00 0.00 H ATOM 2452 HG22 VAL B 56 15.257 10.564 -1.745 1.00 0.00 H ATOM 2453 HG23 VAL B 56 15.158 12.164 -0.970 1.00 0.00 H ATOM 2454 H VAL B 56 14.397 8.801 1.363 1.00 0.00 H ATOM 2455 N ARG B 57 13.855 8.646 -2.526 1.00 6.86 N ATOM 2456 CA ARG B 57 14.613 7.926 -3.525 1.00 7.87 C ATOM 2457 C ARG B 57 15.701 8.920 -4.057 1.00 9.51 C ATOM 2458 O ARG B 57 15.468 10.139 -4.085 1.00 10.25 O ATOM 2459 CB ARG B 57 13.870 7.480 -4.740 1.00 7.25 C ATOM 2460 CG ARG B 57 12.407 7.157 -4.741 1.00 6.69 C ATOM 2461 CD ARG B 57 12.045 6.621 -6.100 1.00 8.35 C ATOM 2462 NE ARG B 57 11.717 7.481 -7.202 1.00 7.62 N ATOM 2463 CZ ARG B 57 10.546 8.069 -7.376 1.00 7.48 C ATOM 2464 NH1 ARG B 57 9.600 7.943 -6.462 1.00 8.26 N ATOM 2465 NH2 ARG B 57 10.282 8.808 -8.451 1.00 9.77 N ATOM 2466 HA ARG B 57 14.967 7.025 -3.025 1.00 0.00 H ATOM 2467 HB2 ARG B 57 14.001 8.272 -5.477 1.00 0.00 H ATOM 2468 HB3 ARG B 57 14.375 6.577 -5.084 1.00 0.00 H ATOM 2469 HG2 ARG B 57 12.194 6.407 -3.979 1.00 0.00 H ATOM 2470 HG3 ARG B 57 11.830 8.058 -4.534 1.00 0.00 H ATOM 2471 HD2 ARG B 57 11.180 5.975 -5.951 1.00 0.00 H ATOM 2472 HD3 ARG B 57 12.894 6.020 -6.426 1.00 0.00 H ATOM 2473 HE ARG B 57 12.454 7.654 -7.915 1.00 0.00 H ATOM 2474 HH12 ARG B 57 8.679 8.406 -6.600 1.00 0.00 H ATOM 2475 HH11 ARG B 57 9.777 7.381 -5.605 1.00 0.00 H ATOM 2476 HH22 ARG B 57 9.350 9.257 -8.557 1.00 0.00 H ATOM 2477 HH21 ARG B 57 11.008 8.936 -9.185 1.00 0.00 H ATOM 2478 H ARG B 57 13.202 9.381 -2.866 1.00 0.00 H ATOM 2479 N GLN B 58 16.804 8.337 -4.503 1.00 9.18 N ATOM 2480 CA GLN B 58 17.931 9.091 -5.000 1.00 8.59 C ATOM 2481 C GLN B 58 18.490 8.679 -6.345 1.00 8.84 C ATOM 2482 O GLN B 58 18.850 7.516 -6.547 1.00 8.99 O ATOM 2483 CB GLN B 58 19.067 8.866 -3.957 1.00 9.01 C ATOM 2484 CG GLN B 58 20.455 9.023 -4.540 1.00 9.71 C ATOM 2485 CD GLN B 58 21.503 8.933 -3.435 1.00 12.31 C ATOM 2486 OE1 GLN B 58 21.176 8.813 -2.257 1.00 12.25 O ATOM 2487 NE2 GLN B 58 22.778 8.946 -3.796 1.00 12.94 N ATOM 2488 HA GLN B 58 17.584 10.115 -5.136 1.00 0.00 H ATOM 2489 HB2 GLN B 58 18.946 9.590 -3.151 1.00 0.00 H ATOM 2490 HB3 GLN B 58 18.973 7.857 -3.554 1.00 0.00 H ATOM 2491 HG2 GLN B 58 20.631 8.232 -5.269 1.00 0.00 H ATOM 2492 HG3 GLN B 58 20.532 9.993 -5.032 1.00 0.00 H ATOM 2493 HE22 GLN B 58 23.033 9.049 -4.799 1.00 0.00 H ATOM 2494 HE21 GLN B 58 23.523 8.854 -3.076 1.00 0.00 H ATOM 2495 H GLN B 58 16.860 7.299 -4.495 1.00 0.00 H ATOM 2496 N TYR B 59 18.679 9.680 -7.192 1.00 7.64 N ATOM 2497 CA TYR B 59 19.286 9.499 -8.509 1.00 6.38 C ATOM 2498 C TYR B 59 20.584 10.281 -8.614 1.00 7.72 C ATOM 2499 O TYR B 59 20.747 11.365 -8.021 1.00 8.70 O ATOM 2500 CB TYR B 59 18.283 9.959 -9.537 1.00 4.62 C ATOM 2501 CG TYR B 59 16.928 9.328 -9.384 1.00 2.17 C ATOM 2502 CD1 TYR B 59 16.052 9.625 -8.384 1.00 1.77 C ATOM 2503 CD2 TYR B 59 16.517 8.411 -10.331 1.00 2.45 C ATOM 2504 CE1 TYR B 59 14.806 9.018 -8.346 1.00 3.12 C ATOM 2505 CE2 TYR B 59 15.277 7.792 -10.320 1.00 1.77 C ATOM 2506 CZ TYR B 59 14.426 8.108 -9.323 1.00 2.68 C ATOM 2507 OH TYR B 59 13.176 7.528 -9.273 1.00 4.79 O ATOM 2508 HA TYR B 59 19.537 8.451 -8.676 1.00 0.00 H ATOM 2509 HB3 TYR B 59 18.667 9.714 -10.527 1.00 0.00 H ATOM 2510 HB2 TYR B 59 18.171 11.040 -9.450 1.00 0.00 H ATOM 2511 HD2 TYR B 59 17.209 8.159 -11.135 1.00 0.00 H ATOM 2512 HE2 TYR B 59 14.999 7.074 -11.091 1.00 0.00 H ATOM 2513 HE1 TYR B 59 14.115 9.259 -7.538 1.00 0.00 H ATOM 2514 HD1 TYR B 59 16.331 10.342 -7.612 1.00 0.00 H ATOM 2515 HH TYR B 59 12.686 7.869 -8.483 1.00 0.00 H ATOM 2516 H TYR B 59 18.383 10.635 -6.908 1.00 0.00 H ATOM 2517 N ASP B 60 21.526 9.773 -9.366 1.00 9.40 N ATOM 2518 CA ASP B 60 22.825 10.402 -9.537 1.00 11.96 C ATOM 2519 C ASP B 60 23.019 11.016 -10.869 1.00 13.34 C ATOM 2520 O ASP B 60 22.265 10.778 -11.836 1.00 14.58 O ATOM 2521 CB ASP B 60 23.878 9.325 -9.197 1.00 16.92 C ATOM 2522 CG ASP B 60 23.877 9.195 -7.659 1.00 20.42 C ATOM 2523 OD1 ASP B 60 22.852 9.595 -7.043 1.00 20.57 O ATOM 2524 OD2 ASP B 60 24.914 8.778 -7.103 1.00 23.23 O ATOM 2525 HA ASP B 60 22.921 11.255 -8.866 1.00 0.00 H ATOM 2526 HB2 ASP B 60 23.609 8.374 -9.657 1.00 0.00 H ATOM 2527 HB3 ASP B 60 24.862 9.633 -9.550 1.00 0.00 H ATOM 2528 H ASP B 60 21.337 8.879 -9.864 1.00 0.00 H ATOM 2529 N GLN B 61 24.008 11.899 -10.950 1.00 13.53 N ATOM 2530 CA GLN B 61 24.326 12.539 -12.217 1.00 13.51 C ATOM 2531 C GLN B 61 23.171 13.006 -13.086 1.00 13.41 C ATOM 2532 O GLN B 61 23.202 12.834 -14.322 1.00 14.38 O ATOM 2533 CB GLN B 61 25.220 11.530 -12.983 1.00 13.96 C ATOM 2534 CG GLN B 61 26.413 12.260 -13.575 1.00 17.38 C ATOM 2535 CD GLN B 61 27.489 11.391 -14.135 1.00 17.51 C ATOM 2536 OE1 GLN B 61 27.727 10.299 -13.634 1.00 21.01 O ATOM 2537 NE2 GLN B 61 28.194 11.829 -15.169 1.00 18.61 N ATOM 2538 HA GLN B 61 24.812 13.486 -11.981 1.00 0.00 H ATOM 2539 HB2 GLN B 61 25.569 10.759 -12.296 1.00 0.00 H ATOM 2540 HB3 GLN B 61 24.643 11.067 -13.783 1.00 0.00 H ATOM 2541 HG2 GLN B 61 26.049 12.902 -14.377 1.00 0.00 H ATOM 2542 HG3 GLN B 61 26.853 12.875 -12.790 1.00 0.00 H ATOM 2543 HE22 GLN B 61 27.983 12.758 -15.586 1.00 0.00 H ATOM 2544 HE21 GLN B 61 28.958 11.244 -15.563 1.00 0.00 H ATOM 2545 H GLN B 61 24.560 12.135 -10.100 1.00 0.00 H ATOM 2546 N ILE B 62 22.181 13.649 -12.497 1.00 12.17 N ATOM 2547 CA ILE B 62 21.028 14.291 -13.073 1.00 10.35 C ATOM 2548 C ILE B 62 21.342 15.740 -13.450 1.00 10.82 C ATOM 2549 O ILE B 62 21.865 16.556 -12.655 1.00 11.29 O ATOM 2550 CB ILE B 62 19.844 14.374 -12.071 1.00 9.51 C ATOM 2551 CG1 ILE B 62 19.325 12.985 -11.733 1.00 7.88 C ATOM 2552 CG2 ILE B 62 18.746 15.259 -12.661 1.00 8.78 C ATOM 2553 CD1 ILE B 62 19.176 12.056 -12.897 1.00 5.30 C ATOM 2554 HA ILE B 62 20.763 13.688 -13.941 1.00 0.00 H ATOM 2555 HB ILE B 62 20.187 14.821 -11.138 1.00 0.00 H ATOM 2556 HG12 ILE B 62 20.018 12.530 -11.025 1.00 0.00 H ATOM 2557 HG13 ILE B 62 18.348 13.096 -11.263 1.00 0.00 H ATOM 2558 HD11 ILE B 62 18.474 12.483 -13.613 1.00 0.00 H ATOM 2559 HD12 ILE B 62 20.145 11.916 -13.375 1.00 0.00 H ATOM 2560 HD13 ILE B 62 18.800 11.095 -12.547 1.00 0.00 H ATOM 2561 HG21 ILE B 62 19.144 16.258 -12.841 1.00 0.00 H ATOM 2562 HG22 ILE B 62 18.401 14.829 -13.601 1.00 0.00 H ATOM 2563 HG23 ILE B 62 17.914 15.319 -11.960 1.00 0.00 H ATOM 2564 H ILE B 62 22.243 13.700 -11.460 1.00 0.00 H ATOM 2565 N LEU B 63 20.974 16.061 -14.684 1.00 10.86 N ATOM 2566 CA LEU B 63 21.234 17.396 -15.217 1.00 10.57 C ATOM 2567 C LEU B 63 20.102 18.375 -15.017 1.00 11.00 C ATOM 2568 O LEU B 63 18.961 18.203 -15.472 1.00 12.83 O ATOM 2569 CB LEU B 63 21.615 17.275 -16.692 1.00 9.50 C ATOM 2570 CG LEU B 63 21.771 18.649 -17.382 1.00 11.03 C ATOM 2571 CD1 LEU B 63 22.916 19.442 -16.800 1.00 9.34 C ATOM 2572 CD2 LEU B 63 21.953 18.469 -18.880 1.00 11.94 C ATOM 2573 HA LEU B 63 22.062 17.817 -14.646 1.00 0.00 H ATOM 2574 HB2 LEU B 63 22.561 16.738 -16.765 1.00 0.00 H ATOM 2575 HB3 LEU B 63 20.838 16.711 -17.208 1.00 0.00 H ATOM 2576 HG LEU B 63 20.858 19.216 -17.201 1.00 0.00 H ATOM 2577 HD21 LEU B 63 22.846 17.873 -19.067 1.00 0.00 H ATOM 2578 HD22 LEU B 63 21.082 17.960 -19.292 1.00 0.00 H ATOM 2579 HD23 LEU B 63 22.061 19.446 -19.351 1.00 0.00 H ATOM 2580 HD11 LEU B 63 22.737 19.610 -15.738 1.00 0.00 H ATOM 2581 HD12 LEU B 63 23.844 18.886 -16.930 1.00 0.00 H ATOM 2582 HD13 LEU B 63 22.990 20.401 -17.313 1.00 0.00 H ATOM 2583 H LEU B 63 20.495 15.354 -15.278 1.00 0.00 H ATOM 2584 N ILE B 64 20.381 19.484 -14.354 1.00 10.77 N ATOM 2585 CA ILE B 64 19.291 20.461 -14.190 1.00 11.32 C ATOM 2586 C ILE B 64 19.726 21.855 -14.509 1.00 12.67 C ATOM 2587 O ILE B 64 20.798 22.335 -14.073 1.00 14.67 O ATOM 2588 CB ILE B 64 18.586 20.242 -12.877 1.00 10.86 C ATOM 2589 CG1 ILE B 64 18.146 21.561 -12.233 1.00 9.35 C ATOM 2590 CG2 ILE B 64 19.314 19.354 -11.879 1.00 10.28 C ATOM 2591 CD1 ILE B 64 17.563 21.222 -10.870 1.00 10.77 C ATOM 2592 HA ILE B 64 18.519 20.291 -14.940 1.00 0.00 H ATOM 2593 HB ILE B 64 17.698 19.673 -13.153 1.00 0.00 H ATOM 2594 HG12 ILE B 64 19.003 22.225 -12.119 1.00 0.00 H ATOM 2595 HG13 ILE B 64 17.392 22.046 -12.852 1.00 0.00 H ATOM 2596 HD11 ILE B 64 16.712 20.553 -10.997 1.00 0.00 H ATOM 2597 HD12 ILE B 64 18.324 20.733 -10.262 1.00 0.00 H ATOM 2598 HD13 ILE B 64 17.237 22.138 -10.378 1.00 0.00 H ATOM 2599 HG21 ILE B 64 19.464 18.366 -12.315 1.00 0.00 H ATOM 2600 HG22 ILE B 64 20.280 19.797 -11.638 1.00 0.00 H ATOM 2601 HG23 ILE B 64 18.717 19.265 -10.971 1.00 0.00 H ATOM 2602 H ILE B 64 21.329 19.659 -13.965 1.00 0.00 H ATOM 2603 N GLU B 65 18.920 22.538 -15.309 1.00 12.98 N ATOM 2604 CA GLU B 65 19.359 23.920 -15.653 1.00 14.90 C ATOM 2605 C GLU B 65 18.570 24.914 -14.832 1.00 15.29 C ATOM 2606 O GLU B 65 17.327 24.972 -14.844 1.00 15.93 O ATOM 2607 CB GLU B 65 19.343 24.144 -17.145 1.00 15.89 C ATOM 2608 CG GLU B 65 19.602 25.573 -17.515 1.00 19.48 C ATOM 2609 CD GLU B 65 19.464 25.853 -18.993 1.00 22.33 C ATOM 2610 OE1 GLU B 65 19.918 24.997 -19.782 1.00 23.76 O ATOM 2611 OE2 GLU B 65 18.892 26.920 -19.329 1.00 23.87 O ATOM 2612 HA GLU B 65 20.404 24.073 -15.382 1.00 0.00 H ATOM 2613 HB2 GLU B 65 20.112 23.520 -17.600 1.00 0.00 H ATOM 2614 HB3 GLU B 65 18.366 23.854 -17.532 1.00 0.00 H ATOM 2615 HG2 GLU B 65 18.892 26.202 -16.978 1.00 0.00 H ATOM 2616 HG3 GLU B 65 20.616 25.829 -17.209 1.00 0.00 H ATOM 2617 H GLU B 65 18.034 22.134 -15.675 1.00 0.00 H ATOM 2618 N ILE B 66 19.358 25.682 -14.095 1.00 15.57 N ATOM 2619 CA ILE B 66 18.823 26.705 -13.170 1.00 15.60 C ATOM 2620 C ILE B 66 19.114 28.088 -13.681 1.00 16.41 C ATOM 2621 O ILE B 66 20.252 28.555 -13.673 1.00 17.46 O ATOM 2622 CB ILE B 66 19.411 26.411 -11.775 1.00 15.11 C ATOM 2623 CG1 ILE B 66 19.582 24.882 -11.651 1.00 14.17 C ATOM 2624 CG2 ILE B 66 18.519 26.972 -10.677 1.00 13.95 C ATOM 2625 CD1 ILE B 66 20.102 24.350 -10.345 1.00 11.94 C ATOM 2626 HA ILE B 66 17.736 26.661 -13.100 1.00 0.00 H ATOM 2627 HB ILE B 66 20.379 26.898 -11.659 1.00 0.00 H ATOM 2628 HG12 ILE B 66 18.606 24.428 -11.825 1.00 0.00 H ATOM 2629 HG13 ILE B 66 20.273 24.565 -12.432 1.00 0.00 H ATOM 2630 HD11 ILE B 66 21.089 24.770 -10.150 1.00 0.00 H ATOM 2631 HD12 ILE B 66 19.421 24.632 -9.542 1.00 0.00 H ATOM 2632 HD13 ILE B 66 20.172 23.264 -10.399 1.00 0.00 H ATOM 2633 HG21 ILE B 66 18.430 28.052 -10.799 1.00 0.00 H ATOM 2634 HG22 ILE B 66 17.532 26.515 -10.744 1.00 0.00 H ATOM 2635 HG23 ILE B 66 18.958 26.750 -9.705 1.00 0.00 H ATOM 2636 H ILE B 66 20.388 25.562 -14.169 1.00 0.00 H ATOM 2637 N CYS B 67 18.081 28.767 -14.219 1.00 16.98 N ATOM 2638 CA CYS B 67 18.350 30.135 -14.743 1.00 16.69 C ATOM 2639 C CYS B 67 19.475 30.088 -15.746 1.00 16.31 C ATOM 2640 O CYS B 67 20.512 30.730 -15.658 1.00 16.38 O ATOM 2641 CB CYS B 67 18.715 31.015 -13.531 1.00 16.60 C ATOM 2642 SG CYS B 67 17.210 31.479 -12.643 1.00 19.88 S ATOM 2643 HA CYS B 67 17.480 30.546 -15.256 1.00 0.00 H ATOM 2644 HB2 CYS B 67 19.225 31.914 -13.876 1.00 0.00 H ATOM 2645 HB3 CYS B 67 19.373 30.459 -12.864 1.00 0.00 H ATOM 2646 HG CYS B 67 17.542 32.266 -11.559 1.00 0.00 H ATOM 2647 H CYS B 67 17.129 28.350 -14.266 1.00 0.00 H ATOM 2648 N GLY B 68 19.266 29.250 -16.757 1.00 16.90 N ATOM 2649 CA GLY B 68 20.313 29.092 -17.765 1.00 16.78 C ATOM 2650 C GLY B 68 21.653 28.783 -17.110 1.00 16.38 C ATOM 2651 O GLY B 68 22.653 29.321 -17.594 1.00 17.08 O ATOM 2652 HA3 GLY B 68 20.400 30.015 -18.338 1.00 0.00 H ATOM 2653 HA2 GLY B 68 20.045 28.274 -18.434 1.00 0.00 H ATOM 2654 H GLY B 68 18.376 28.718 -16.829 1.00 0.00 H ATOM 2655 N HIS B 69 21.712 27.987 -16.066 1.00 16.05 N ATOM 2656 CA HIS B 69 22.997 27.572 -15.472 1.00 16.29 C ATOM 2657 C HIS B 69 23.012 26.038 -15.356 1.00 16.69 C ATOM 2658 O HIS B 69 22.202 25.526 -14.548 1.00 18.20 O ATOM 2659 CB HIS B 69 23.240 28.156 -14.118 1.00 16.42 C ATOM 2660 CG HIS B 69 23.652 29.583 -14.036 1.00 18.27 C ATOM 2661 ND1 HIS B 69 22.799 30.630 -14.332 1.00 17.63 N ATOM 2662 CD2 HIS B 69 24.825 30.141 -13.623 1.00 18.65 C ATOM 2663 CE1 HIS B 69 23.418 31.766 -14.120 1.00 18.96 C ATOM 2664 NE2 HIS B 69 24.658 31.509 -13.699 1.00 19.74 N ATOM 2665 HA HIS B 69 23.787 27.940 -16.127 1.00 0.00 H ATOM 2666 HB2 HIS B 69 22.316 28.052 -13.549 1.00 0.00 H ATOM 2667 HB3 HIS B 69 24.024 27.564 -13.646 1.00 0.00 H ATOM 2668 HD2 HIS B 69 25.720 29.611 -13.297 1.00 0.00 H ATOM 2669 HE1 HIS B 69 22.990 32.758 -14.264 1.00 0.00 H ATOM 2670 H HIS B 69 20.826 27.639 -15.646 1.00 0.00 H ATOM 2671 N LYS B 70 23.865 25.332 -16.074 1.00 15.30 N ATOM 2672 CA LYS B 70 23.866 23.865 -15.978 1.00 15.19 C ATOM 2673 C LYS B 70 24.504 23.297 -14.744 1.00 14.35 C ATOM 2674 O LYS B 70 25.590 23.737 -14.300 1.00 14.64 O ATOM 2675 CB LYS B 70 24.439 23.303 -17.286 1.00 17.56 C ATOM 2676 CG LYS B 70 23.309 23.269 -18.359 1.00 20.49 C ATOM 2677 CD LYS B 70 23.908 23.126 -19.755 1.00 23.03 C ATOM 2678 CE LYS B 70 22.889 22.588 -20.751 1.00 24.23 C ATOM 2679 NZ LYS B 70 23.569 21.683 -21.759 1.00 26.05 N ATOM 2680 HA LYS B 70 22.834 23.537 -15.855 1.00 0.00 H ATOM 2681 HB2 LYS B 70 25.254 23.939 -17.632 1.00 0.00 H ATOM 2682 HB3 LYS B 70 24.814 22.294 -17.117 1.00 0.00 H ATOM 2683 HG2 LYS B 70 22.651 22.423 -18.162 1.00 0.00 H ATOM 2684 HG3 LYS B 70 22.735 24.194 -18.307 1.00 0.00 H ATOM 2685 HD2 LYS B 70 24.252 24.103 -20.094 1.00 0.00 H ATOM 2686 HD3 LYS B 70 24.754 22.440 -19.709 1.00 0.00 H ATOM 2687 HE2 LYS B 70 22.421 23.422 -21.274 1.00 0.00 H ATOM 2688 HE3 LYS B 70 22.126 22.022 -20.216 1.00 0.00 H ATOM 2689 HZ1 LYS B 70 24.296 22.222 -22.272 1.00 0.00 H ATOM 2690 HZ2 LYS B 70 24.014 20.885 -21.262 1.00 0.00 H ATOM 2691 HZ3 LYS B 70 22.862 21.323 -22.432 1.00 0.00 H ATOM 2692 H LYS B 70 24.536 25.813 -16.707 1.00 0.00 H ATOM 2693 N ALA B 71 23.826 22.329 -14.116 1.00 12.63 N ATOM 2694 CA ALA B 71 24.391 21.699 -12.875 1.00 10.98 C ATOM 2695 C ALA B 71 24.110 20.214 -12.992 1.00 9.59 C ATOM 2696 O ALA B 71 23.086 19.906 -13.612 1.00 10.31 O ATOM 2697 CB ALA B 71 23.802 22.288 -11.626 1.00 7.71 C ATOM 2698 HA ALA B 71 25.462 21.887 -12.795 1.00 0.00 H ATOM 2699 HB1 ALA B 71 24.016 23.356 -11.594 1.00 0.00 H ATOM 2700 HB2 ALA B 71 22.723 22.132 -11.626 1.00 0.00 H ATOM 2701 HB3 ALA B 71 24.240 21.802 -10.755 1.00 0.00 H ATOM 2702 H ALA B 71 22.907 22.013 -14.487 1.00 0.00 H ATOM 2703 N ILE B 72 24.950 19.380 -12.448 1.00 9.26 N ATOM 2704 CA ILE B 72 24.837 17.912 -12.542 1.00 7.86 C ATOM 2705 C ILE B 72 25.225 17.266 -11.224 1.00 7.99 C ATOM 2706 O ILE B 72 26.373 17.429 -10.788 1.00 8.33 O ATOM 2707 CB ILE B 72 25.735 17.331 -13.663 1.00 6.94 C ATOM 2708 CG1 ILE B 72 25.286 17.918 -15.010 1.00 7.28 C ATOM 2709 CG2 ILE B 72 25.595 15.809 -13.770 1.00 8.52 C ATOM 2710 CD1 ILE B 72 26.185 17.865 -16.191 1.00 4.87 C ATOM 2711 HA ILE B 72 23.797 17.690 -12.780 1.00 0.00 H ATOM 2712 HB ILE B 72 26.768 17.584 -13.424 1.00 0.00 H ATOM 2713 HG12 ILE B 72 24.371 17.396 -15.290 1.00 0.00 H ATOM 2714 HG13 ILE B 72 25.063 18.970 -14.834 1.00 0.00 H ATOM 2715 HD11 ILE B 72 27.107 18.402 -15.968 1.00 0.00 H ATOM 2716 HD12 ILE B 72 26.415 16.825 -16.424 1.00 0.00 H ATOM 2717 HD13 ILE B 72 25.690 18.329 -17.044 1.00 0.00 H ATOM 2718 HG21 ILE B 72 25.886 15.351 -12.825 1.00 0.00 H ATOM 2719 HG22 ILE B 72 24.559 15.556 -13.994 1.00 0.00 H ATOM 2720 HG23 ILE B 72 26.241 15.441 -14.567 1.00 0.00 H ATOM 2721 H ILE B 72 25.751 19.774 -11.914 1.00 0.00 H ATOM 2722 N GLY B 73 24.245 16.552 -10.653 1.00 7.10 N ATOM 2723 CA GLY B 73 24.428 15.833 -9.421 1.00 5.81 C ATOM 2724 C GLY B 73 23.221 15.043 -8.968 1.00 6.06 C ATOM 2725 O GLY B 73 22.273 14.807 -9.702 1.00 5.99 O ATOM 2726 HA3 GLY B 73 24.676 16.553 -8.641 1.00 0.00 H ATOM 2727 HA2 GLY B 73 25.259 15.140 -9.552 1.00 0.00 H ATOM 2728 H GLY B 73 23.316 16.517 -11.119 1.00 0.00 H ATOM 2729 N THR B 74 23.312 14.657 -7.698 1.00 6.02 N ATOM 2730 CA THR B 74 22.327 13.924 -6.948 1.00 6.02 C ATOM 2731 C THR B 74 21.094 14.787 -6.730 1.00 6.10 C ATOM 2732 O THR B 74 21.199 15.938 -6.322 1.00 6.73 O ATOM 2733 CB THR B 74 22.850 13.513 -5.553 1.00 5.91 C ATOM 2734 OG1 THR B 74 24.191 13.082 -5.786 1.00 8.69 O ATOM 2735 CG2 THR B 74 22.118 12.306 -4.977 1.00 6.20 C ATOM 2736 HA THR B 74 22.093 13.030 -7.526 1.00 0.00 H ATOM 2737 HB THR B 74 22.728 14.346 -4.861 1.00 0.00 H ATOM 2738 HG1 THR B 74 24.599 12.799 -4.929 1.00 0.00 H ATOM 2739 HG23 THR B 74 21.081 12.574 -4.776 1.00 0.00 H ATOM 2740 HG21 THR B 74 22.151 11.486 -5.695 1.00 0.00 H ATOM 2741 HG22 THR B 74 22.601 11.998 -4.050 1.00 0.00 H ATOM 2742 H THR B 74 24.186 14.912 -7.195 1.00 0.00 H ATOM 2743 N VAL B 75 19.990 14.163 -6.991 1.00 5.72 N ATOM 2744 CA VAL B 75 18.667 14.785 -6.820 1.00 5.87 C ATOM 2745 C VAL B 75 17.912 13.763 -5.969 1.00 6.20 C ATOM 2746 O VAL B 75 18.254 12.567 -6.091 1.00 6.74 O ATOM 2747 CB VAL B 75 18.025 14.968 -8.200 1.00 5.71 C ATOM 2748 CG1 VAL B 75 16.630 15.571 -8.164 1.00 6.44 C ATOM 2749 CG2 VAL B 75 18.936 15.817 -9.071 1.00 4.39 C ATOM 2750 HA VAL B 75 18.681 15.770 -6.354 1.00 0.00 H ATOM 2751 HB VAL B 75 17.905 13.969 -8.619 1.00 0.00 H ATOM 2752 HG11 VAL B 75 15.970 14.923 -7.587 1.00 0.00 H ATOM 2753 HG12 VAL B 75 16.673 16.555 -7.698 1.00 0.00 H ATOM 2754 HG13 VAL B 75 16.250 15.666 -9.181 1.00 0.00 H ATOM 2755 HG21 VAL B 75 19.079 16.791 -8.603 1.00 0.00 H ATOM 2756 HG22 VAL B 75 19.900 15.319 -9.180 1.00 0.00 H ATOM 2757 HG23 VAL B 75 18.480 15.947 -10.052 1.00 0.00 H ATOM 2758 H VAL B 75 20.040 13.183 -7.335 1.00 0.00 H ATOM 2759 N LEU B 76 17.041 14.216 -5.102 1.00 5.08 N ATOM 2760 CA LEU B 76 16.303 13.207 -4.327 1.00 5.64 C ATOM 2761 C LEU B 76 14.858 13.414 -4.802 1.00 6.89 C ATOM 2762 O LEU B 76 14.624 14.576 -5.236 1.00 9.97 O ATOM 2763 CB LEU B 76 16.471 13.434 -2.869 1.00 5.96 C ATOM 2764 CG LEU B 76 17.826 13.646 -2.202 1.00 2.73 C ATOM 2765 CD1 LEU B 76 17.561 14.193 -0.814 1.00 1.77 C ATOM 2766 CD2 LEU B 76 18.600 12.348 -2.153 1.00 1.97 C ATOM 2767 HA LEU B 76 16.646 12.184 -4.480 1.00 0.00 H ATOM 2768 HB2 LEU B 76 15.881 14.320 -2.635 1.00 0.00 H ATOM 2769 HB3 LEU B 76 16.030 12.566 -2.379 1.00 0.00 H ATOM 2770 HG LEU B 76 18.436 14.350 -2.768 1.00 0.00 H ATOM 2771 HD21 LEU B 76 18.035 11.611 -1.583 1.00 0.00 H ATOM 2772 HD22 LEU B 76 18.757 11.982 -3.167 1.00 0.00 H ATOM 2773 HD23 LEU B 76 19.564 12.519 -1.674 1.00 0.00 H ATOM 2774 HD11 LEU B 76 17.020 15.136 -0.894 1.00 0.00 H ATOM 2775 HD12 LEU B 76 16.963 13.477 -0.250 1.00 0.00 H ATOM 2776 HD13 LEU B 76 18.509 14.359 -0.303 1.00 0.00 H ATOM 2777 H LEU B 76 16.880 15.235 -4.969 1.00 0.00 H ATOM 2778 N VAL B 77 14.041 12.420 -4.813 1.00 5.58 N ATOM 2779 CA VAL B 77 12.641 12.538 -5.214 1.00 5.54 C ATOM 2780 C VAL B 77 11.816 12.080 -4.008 1.00 7.25 C ATOM 2781 O VAL B 77 12.179 11.021 -3.421 1.00 8.02 O ATOM 2782 CB VAL B 77 12.353 11.727 -6.469 1.00 5.62 C ATOM 2783 CG1 VAL B 77 10.867 11.496 -6.717 1.00 5.82 C ATOM 2784 CG2 VAL B 77 12.911 12.426 -7.718 1.00 4.48 C ATOM 2785 HA VAL B 77 12.383 13.563 -5.480 1.00 0.00 H ATOM 2786 HB VAL B 77 12.838 10.766 -6.296 1.00 0.00 H ATOM 2787 HG11 VAL B 77 10.439 10.955 -5.873 1.00 0.00 H ATOM 2788 HG12 VAL B 77 10.365 12.457 -6.827 1.00 0.00 H ATOM 2789 HG13 VAL B 77 10.739 10.911 -7.628 1.00 0.00 H ATOM 2790 HG21 VAL B 77 12.447 13.407 -7.822 1.00 0.00 H ATOM 2791 HG22 VAL B 77 13.990 12.542 -7.616 1.00 0.00 H ATOM 2792 HG23 VAL B 77 12.690 11.824 -8.599 1.00 0.00 H ATOM 2793 H VAL B 77 14.395 11.486 -4.522 1.00 0.00 H ATOM 2794 N GLY B 78 10.840 12.863 -3.579 1.00 5.88 N ATOM 2795 CA GLY B 78 9.996 12.473 -2.434 1.00 6.03 C ATOM 2796 C GLY B 78 8.857 13.502 -2.454 1.00 7.83 C ATOM 2797 O GLY B 78 8.915 14.309 -3.368 1.00 6.11 O ATOM 2798 HA3 GLY B 78 10.556 12.531 -1.501 1.00 0.00 H ATOM 2799 HA2 GLY B 78 9.609 11.462 -2.562 1.00 0.00 H ATOM 2800 H GLY B 78 10.665 13.770 -4.057 1.00 0.00 H ATOM 2801 N PRO B 79 7.998 13.456 -1.449 1.00 9.39 N ATOM 2802 CA PRO B 79 6.864 14.343 -1.334 1.00 9.98 C ATOM 2803 C PRO B 79 7.170 15.758 -0.907 1.00 10.43 C ATOM 2804 O PRO B 79 7.619 15.935 0.240 1.00 12.10 O ATOM 2805 CB PRO B 79 5.962 13.645 -0.277 1.00 9.29 C ATOM 2806 CG PRO B 79 6.998 13.039 0.641 1.00 9.55 C ATOM 2807 CD PRO B 79 7.998 12.430 -0.358 1.00 9.66 C ATOM 2808 HA PRO B 79 6.411 14.483 -2.315 1.00 0.00 H ATOM 2809 HD3 PRO B 79 8.988 12.321 0.086 1.00 0.00 H ATOM 2810 HD2 PRO B 79 7.656 11.461 -0.723 1.00 0.00 H ATOM 2811 HG3 PRO B 79 6.560 12.272 1.280 1.00 0.00 H ATOM 2812 HG2 PRO B 79 7.472 13.800 1.261 1.00 0.00 H ATOM 2813 HB2 PRO B 79 5.334 14.364 0.249 1.00 0.00 H ATOM 2814 HB3 PRO B 79 5.334 12.879 -0.731 1.00 0.00 H ATOM 2815 N THR B 80 6.812 16.715 -1.761 1.00 9.59 N ATOM 2816 CA THR B 80 7.072 18.129 -1.418 1.00 9.70 C ATOM 2817 C THR B 80 6.132 19.019 -2.200 1.00 9.82 C ATOM 2818 O THR B 80 5.699 18.600 -3.292 1.00 10.30 O ATOM 2819 CB THR B 80 8.541 18.448 -1.759 1.00 9.63 C ATOM 2820 OG1 THR B 80 8.757 19.840 -1.810 1.00 10.95 O ATOM 2821 CG2 THR B 80 8.899 17.930 -3.155 1.00 9.89 C ATOM 2822 HA THR B 80 6.902 18.305 -0.356 1.00 0.00 H ATOM 2823 HB THR B 80 9.145 17.976 -0.984 1.00 0.00 H ATOM 2824 HG1 THR B 80 9.706 20.018 -2.030 1.00 0.00 H ATOM 2825 HG23 THR B 80 8.754 16.850 -3.189 1.00 0.00 H ATOM 2826 HG21 THR B 80 8.256 18.407 -3.894 1.00 0.00 H ATOM 2827 HG22 THR B 80 9.941 18.165 -3.372 1.00 0.00 H ATOM 2828 H THR B 80 6.353 16.470 -2.662 1.00 0.00 H ATOM 2829 N PRO B 81 5.812 20.195 -1.643 1.00 9.24 N ATOM 2830 CA PRO B 81 4.908 21.104 -2.350 1.00 8.65 C ATOM 2831 C PRO B 81 5.700 21.852 -3.404 1.00 9.35 C ATOM 2832 O PRO B 81 5.047 22.580 -4.159 1.00 11.55 O ATOM 2833 CB PRO B 81 4.396 22.033 -1.266 1.00 7.92 C ATOM 2834 CG PRO B 81 5.472 22.046 -0.222 1.00 7.50 C ATOM 2835 CD PRO B 81 6.256 20.748 -0.361 1.00 7.32 C ATOM 2836 HA PRO B 81 4.086 20.607 -2.865 1.00 0.00 H ATOM 2837 HD3 PRO B 81 7.328 20.943 -0.375 1.00 0.00 H ATOM 2838 HD2 PRO B 81 6.023 20.066 0.456 1.00 0.00 H ATOM 2839 HG3 PRO B 81 5.027 22.109 0.771 1.00 0.00 H ATOM 2840 HG2 PRO B 81 6.132 22.899 -0.378 1.00 0.00 H ATOM 2841 HB2 PRO B 81 4.237 23.035 -1.664 1.00 0.00 H ATOM 2842 HB3 PRO B 81 3.462 21.657 -0.849 1.00 0.00 H ATOM 2843 N VAL B 82 7.007 21.687 -3.436 1.00 9.48 N ATOM 2844 CA VAL B 82 7.877 22.403 -4.376 1.00 9.54 C ATOM 2845 C VAL B 82 9.211 21.697 -4.601 1.00 9.65 C ATOM 2846 O VAL B 82 9.652 21.028 -3.665 1.00 10.72 O ATOM 2847 CB VAL B 82 8.373 23.744 -3.771 1.00 10.33 C ATOM 2848 CG1 VAL B 82 7.545 24.910 -4.227 1.00 12.55 C ATOM 2849 CG2 VAL B 82 8.479 23.664 -2.254 1.00 10.09 C ATOM 2850 HA VAL B 82 7.266 22.491 -5.274 1.00 0.00 H ATOM 2851 HB VAL B 82 9.379 23.919 -4.151 1.00 0.00 H ATOM 2852 HG11 VAL B 82 7.596 24.988 -5.313 1.00 0.00 H ATOM 2853 HG12 VAL B 82 6.510 24.761 -3.920 1.00 0.00 H ATOM 2854 HG13 VAL B 82 7.930 25.825 -3.778 1.00 0.00 H ATOM 2855 HG21 VAL B 82 7.499 23.436 -1.834 1.00 0.00 H ATOM 2856 HG22 VAL B 82 9.184 22.879 -1.981 1.00 0.00 H ATOM 2857 HG23 VAL B 82 8.829 24.620 -1.865 1.00 0.00 H ATOM 2858 H VAL B 82 7.441 21.020 -2.766 1.00 0.00 H ATOM 2859 N ASN B 83 9.810 21.890 -5.764 1.00 9.12 N ATOM 2860 CA ASN B 83 11.151 21.255 -5.947 1.00 8.13 C ATOM 2861 C ASN B 83 12.090 22.162 -5.148 1.00 6.97 C ATOM 2862 O ASN B 83 11.886 23.403 -5.135 1.00 6.23 O ATOM 2863 CB ASN B 83 11.543 21.221 -7.418 1.00 10.55 C ATOM 2864 CG ASN B 83 10.576 20.485 -8.298 1.00 11.69 C ATOM 2865 OD1 ASN B 83 10.373 19.289 -8.131 1.00 13.86 O ATOM 2866 ND2 ASN B 83 9.927 21.139 -9.246 1.00 13.98 N ATOM 2867 HA ASN B 83 11.178 20.218 -5.612 1.00 0.00 H ATOM 2868 HB2 ASN B 83 11.617 22.248 -7.776 1.00 0.00 H ATOM 2869 HB3 ASN B 83 12.516 20.738 -7.501 1.00 0.00 H ATOM 2870 HD22 ASN B 83 10.099 22.155 -9.388 1.00 0.00 H ATOM 2871 HD21 ASN B 83 9.244 20.638 -9.850 1.00 0.00 H ATOM 2872 H ASN B 83 9.369 22.457 -6.516 1.00 0.00 H ATOM 2873 N ILE B 84 13.084 21.543 -4.542 1.00 5.43 N ATOM 2874 CA ILE B 84 14.051 22.291 -3.693 1.00 3.00 C ATOM 2875 C ILE B 84 15.466 22.124 -4.186 1.00 2.07 C ATOM 2876 O ILE B 84 15.903 20.994 -4.370 1.00 1.77 O ATOM 2877 CB ILE B 84 13.892 21.819 -2.250 1.00 1.77 C ATOM 2878 CG1 ILE B 84 12.679 22.507 -1.583 1.00 1.77 C ATOM 2879 CG2 ILE B 84 15.104 22.044 -1.391 1.00 3.99 C ATOM 2880 CD1 ILE B 84 11.952 21.461 -0.720 1.00 3.09 C ATOM 2881 HA ILE B 84 13.837 23.358 -3.748 1.00 0.00 H ATOM 2882 HB ILE B 84 13.742 20.742 -2.319 1.00 0.00 H ATOM 2883 HG12 ILE B 84 13.020 23.331 -0.956 1.00 0.00 H ATOM 2884 HG13 ILE B 84 12.004 22.889 -2.348 1.00 0.00 H ATOM 2885 HD11 ILE B 84 11.617 20.639 -1.353 1.00 0.00 H ATOM 2886 HD12 ILE B 84 12.635 21.081 0.040 1.00 0.00 H ATOM 2887 HD13 ILE B 84 11.091 21.924 -0.238 1.00 0.00 H ATOM 2888 HG21 ILE B 84 15.952 21.505 -1.813 1.00 0.00 H ATOM 2889 HG22 ILE B 84 15.330 23.110 -1.356 1.00 0.00 H ATOM 2890 HG23 ILE B 84 14.906 21.680 -0.383 1.00 0.00 H ATOM 2891 H ILE B 84 13.194 20.516 -4.659 1.00 0.00 H ATOM 2892 N ILE B 85 16.157 23.228 -4.376 1.00 1.77 N ATOM 2893 CA ILE B 85 17.556 23.209 -4.847 1.00 1.97 C ATOM 2894 C ILE B 85 18.434 23.458 -3.653 1.00 3.88 C ATOM 2895 O ILE B 85 18.317 24.587 -3.074 1.00 6.20 O ATOM 2896 CB ILE B 85 17.716 24.311 -5.880 1.00 1.77 C ATOM 2897 CG1 ILE B 85 16.620 24.196 -6.966 1.00 1.93 C ATOM 2898 CG2 ILE B 85 19.091 24.265 -6.504 1.00 1.77 C ATOM 2899 CD1 ILE B 85 16.702 22.931 -7.790 1.00 1.77 C ATOM 2900 HA ILE B 85 17.828 22.257 -5.303 1.00 0.00 H ATOM 2901 HB ILE B 85 17.604 25.271 -5.377 1.00 0.00 H ATOM 2902 HG12 ILE B 85 15.647 24.224 -6.476 1.00 0.00 H ATOM 2903 HG13 ILE B 85 16.712 25.050 -7.638 1.00 0.00 H ATOM 2904 HD11 ILE B 85 17.665 22.892 -8.298 1.00 0.00 H ATOM 2905 HD12 ILE B 85 16.600 22.065 -7.136 1.00 0.00 H ATOM 2906 HD13 ILE B 85 15.900 22.927 -8.528 1.00 0.00 H ATOM 2907 HG21 ILE B 85 19.845 24.397 -5.728 1.00 0.00 H ATOM 2908 HG22 ILE B 85 19.235 23.301 -6.992 1.00 0.00 H ATOM 2909 HG23 ILE B 85 19.181 25.064 -7.240 1.00 0.00 H ATOM 2910 H ILE B 85 15.702 24.144 -4.188 1.00 0.00 H ATOM 2911 N GLY B 86 19.230 22.477 -3.253 1.00 2.78 N ATOM 2912 CA GLY B 86 20.024 22.579 -2.037 1.00 1.77 C ATOM 2913 C GLY B 86 21.437 22.950 -2.301 1.00 1.77 C ATOM 2914 O GLY B 86 21.820 23.143 -3.464 1.00 2.17 O ATOM 2915 HA3 GLY B 86 20.006 21.616 -1.527 1.00 0.00 H ATOM 2916 HA2 GLY B 86 19.579 23.338 -1.393 1.00 0.00 H ATOM 2917 H GLY B 86 19.289 21.610 -3.824 1.00 0.00 H ATOM 2918 N ARG B 87 22.249 23.097 -1.246 1.00 1.77 N ATOM 2919 CA ARG B 87 23.636 23.477 -1.537 1.00 2.15 C ATOM 2920 C ARG B 87 24.339 22.527 -2.463 1.00 2.79 C ATOM 2921 O ARG B 87 25.327 22.996 -3.092 1.00 4.60 O ATOM 2922 CB ARG B 87 24.365 23.783 -0.236 1.00 1.77 C ATOM 2923 CG ARG B 87 23.464 24.665 0.623 1.00 1.77 C ATOM 2924 CD ARG B 87 24.129 24.839 1.971 1.00 1.77 C ATOM 2925 NE ARG B 87 24.568 23.634 2.530 1.00 1.77 N ATOM 2926 CZ ARG B 87 25.510 22.760 2.712 1.00 1.82 C ATOM 2927 NH1 ARG B 87 26.758 22.847 2.303 1.00 1.77 N ATOM 2928 NH2 ARG B 87 25.220 21.660 3.456 1.00 1.77 N ATOM 2929 HA ARG B 87 23.634 24.399 -2.119 1.00 0.00 H ATOM 2930 HB2 ARG B 87 24.583 22.854 0.292 1.00 0.00 H ATOM 2931 HB3 ARG B 87 25.297 24.306 -0.450 1.00 0.00 H ATOM 2932 HG2 ARG B 87 23.333 25.636 0.146 1.00 0.00 H ATOM 2933 HG3 ARG B 87 22.491 24.190 0.749 1.00 0.00 H ATOM 2934 HD2 ARG B 87 23.414 25.297 2.654 1.00 0.00 H ATOM 2935 HD3 ARG B 87 24.988 25.499 1.851 1.00 0.00 H ATOM 2936 HE ARG B 87 23.747 23.260 3.047 1.00 0.00 H ATOM 2937 HH12 ARG B 87 27.428 22.078 2.509 1.00 0.00 H ATOM 2938 HH11 ARG B 87 27.075 23.684 1.774 1.00 0.00 H ATOM 2939 HH22 ARG B 87 25.950 20.938 3.623 1.00 0.00 H ATOM 2940 HH21 ARG B 87 24.268 21.540 3.858 1.00 0.00 H ATOM 2941 H ARG B 87 21.914 22.950 -0.272 1.00 0.00 H ATOM 2942 N ASN B 88 23.958 21.287 -2.654 1.00 3.07 N ATOM 2943 CA ASN B 88 24.715 20.457 -3.610 1.00 5.24 C ATOM 2944 C ASN B 88 24.696 21.004 -5.034 1.00 6.95 C ATOM 2945 O ASN B 88 25.616 20.771 -5.878 1.00 9.25 O ATOM 2946 CB ASN B 88 24.312 18.998 -3.504 1.00 3.43 C ATOM 2947 CG ASN B 88 23.007 18.747 -4.192 1.00 3.30 C ATOM 2948 OD1 ASN B 88 21.998 19.404 -3.950 1.00 5.02 O ATOM 2949 ND2 ASN B 88 22.984 17.799 -5.090 1.00 4.51 N ATOM 2950 HA ASN B 88 25.765 20.511 -3.324 1.00 0.00 H ATOM 2951 HB2 ASN B 88 25.083 18.381 -3.966 1.00 0.00 H ATOM 2952 HB3 ASN B 88 24.217 18.730 -2.452 1.00 0.00 H ATOM 2953 HD22 ASN B 88 23.844 17.249 -5.287 1.00 0.00 H ATOM 2954 HD21 ASN B 88 22.106 17.594 -5.608 1.00 0.00 H ATOM 2955 H ASN B 88 23.140 20.897 -2.143 1.00 0.00 H ATOM 2956 N LEU B 89 23.693 21.765 -5.409 1.00 6.81 N ATOM 2957 CA LEU B 89 23.554 22.346 -6.727 1.00 6.42 C ATOM 2958 C LEU B 89 23.892 23.826 -6.702 1.00 7.93 C ATOM 2959 O LEU B 89 24.532 24.250 -7.700 1.00 10.72 O ATOM 2960 CB LEU B 89 22.141 22.119 -7.299 1.00 4.35 C ATOM 2961 CG LEU B 89 21.887 20.631 -7.609 1.00 4.59 C ATOM 2962 CD1 LEU B 89 20.942 20.457 -8.766 1.00 2.81 C ATOM 2963 CD2 LEU B 89 23.208 19.929 -7.881 1.00 2.65 C ATOM 2964 HA LEU B 89 24.262 21.842 -7.385 1.00 0.00 H ATOM 2965 HB2 LEU B 89 21.405 22.460 -6.570 1.00 0.00 H ATOM 2966 HB3 LEU B 89 22.034 22.695 -8.218 1.00 0.00 H ATOM 2967 HG LEU B 89 21.414 20.178 -6.738 1.00 0.00 H ATOM 2968 HD21 LEU B 89 23.698 20.397 -8.735 1.00 0.00 H ATOM 2969 HD22 LEU B 89 23.849 20.011 -7.003 1.00 0.00 H ATOM 2970 HD23 LEU B 89 23.021 18.878 -8.099 1.00 0.00 H ATOM 2971 HD11 LEU B 89 19.987 20.926 -8.528 1.00 0.00 H ATOM 2972 HD12 LEU B 89 21.367 20.925 -9.654 1.00 0.00 H ATOM 2973 HD13 LEU B 89 20.789 19.394 -8.952 1.00 0.00 H ATOM 2974 H LEU B 89 22.948 21.963 -4.711 1.00 0.00 H ATOM 2975 N LEU B 90 23.437 24.504 -5.638 1.00 5.38 N ATOM 2976 CA LEU B 90 23.704 25.934 -5.499 1.00 2.27 C ATOM 2977 C LEU B 90 25.200 26.157 -5.521 1.00 1.87 C ATOM 2978 O LEU B 90 25.655 27.146 -6.088 1.00 2.06 O ATOM 2979 CB LEU B 90 23.088 26.504 -4.255 1.00 1.77 C ATOM 2980 CG LEU B 90 21.564 26.484 -4.140 1.00 1.77 C ATOM 2981 CD1 LEU B 90 21.169 26.873 -2.712 1.00 1.77 C ATOM 2982 CD2 LEU B 90 20.888 27.344 -5.180 1.00 1.77 C ATOM 2983 HA LEU B 90 23.244 26.459 -6.336 1.00 0.00 H ATOM 2984 HB2 LEU B 90 23.485 25.943 -3.409 1.00 0.00 H ATOM 2985 HB3 LEU B 90 23.406 27.544 -4.182 1.00 0.00 H ATOM 2986 HG LEU B 90 21.212 25.473 -4.343 1.00 0.00 H ATOM 2987 HD21 LEU B 90 21.218 28.377 -5.066 1.00 0.00 H ATOM 2988 HD22 LEU B 90 21.152 26.985 -6.175 1.00 0.00 H ATOM 2989 HD23 LEU B 90 19.807 27.290 -5.048 1.00 0.00 H ATOM 2990 HD11 LEU B 90 21.601 26.160 -2.010 1.00 0.00 H ATOM 2991 HD12 LEU B 90 21.543 27.873 -2.493 1.00 0.00 H ATOM 2992 HD13 LEU B 90 20.083 26.861 -2.621 1.00 0.00 H ATOM 2993 H LEU B 90 22.890 24.008 -4.906 1.00 0.00 H ATOM 2994 N THR B 91 25.978 25.250 -4.954 1.00 2.05 N ATOM 2995 CA THR B 91 27.426 25.491 -5.019 1.00 4.08 C ATOM 2996 C THR B 91 27.839 25.589 -6.495 1.00 4.76 C ATOM 2997 O THR B 91 28.489 26.522 -6.943 1.00 3.94 O ATOM 2998 CB THR B 91 28.254 24.435 -4.275 1.00 4.87 C ATOM 2999 OG1 THR B 91 27.711 23.106 -4.445 1.00 6.69 O ATOM 3000 CG2 THR B 91 28.246 24.743 -2.794 1.00 6.34 C ATOM 3001 HA THR B 91 27.636 26.429 -4.505 1.00 0.00 H ATOM 3002 HB THR B 91 29.262 24.465 -4.688 1.00 0.00 H ATOM 3003 HG1 THR B 91 26.786 23.081 -4.092 1.00 0.00 H ATOM 3004 HG23 THR B 91 28.651 25.742 -2.630 1.00 0.00 H ATOM 3005 HG21 THR B 91 27.223 24.698 -2.420 1.00 0.00 H ATOM 3006 HG22 THR B 91 28.859 24.010 -2.269 1.00 0.00 H ATOM 3007 H THR B 91 25.585 24.409 -4.486 1.00 0.00 H ATOM 3008 N GLN B 92 27.421 24.576 -7.268 1.00 5.92 N ATOM 3009 CA GLN B 92 27.769 24.483 -8.680 1.00 6.11 C ATOM 3010 C GLN B 92 27.482 25.684 -9.542 1.00 7.35 C ATOM 3011 O GLN B 92 28.321 26.080 -10.389 1.00 7.28 O ATOM 3012 CB GLN B 92 26.985 23.287 -9.223 1.00 5.35 C ATOM 3013 CG GLN B 92 27.443 22.019 -8.546 1.00 4.89 C ATOM 3014 CD GLN B 92 27.173 20.814 -9.451 1.00 5.64 C ATOM 3015 OE1 GLN B 92 26.877 20.986 -10.626 1.00 2.67 O ATOM 3016 NE2 GLN B 92 27.274 19.652 -8.771 1.00 7.24 N ATOM 3017 HA GLN B 92 28.854 24.391 -8.728 1.00 0.00 H ATOM 3018 HB2 GLN B 92 25.922 23.435 -9.032 1.00 0.00 H ATOM 3019 HB3 GLN B 92 27.151 23.203 -10.297 1.00 0.00 H ATOM 3020 HG2 GLN B 92 28.512 22.085 -8.341 1.00 0.00 H ATOM 3021 HG3 GLN B 92 26.902 21.895 -7.608 1.00 0.00 H ATOM 3022 HE22 GLN B 92 27.538 19.659 -7.765 1.00 0.00 H ATOM 3023 HE21 GLN B 92 27.088 18.749 -9.253 1.00 0.00 H ATOM 3024 H GLN B 92 26.829 23.832 -6.846 1.00 0.00 H ATOM 3025 N ILE B 93 26.251 26.212 -9.370 1.00 7.15 N ATOM 3026 CA ILE B 93 25.886 27.401 -10.153 1.00 6.32 C ATOM 3027 C ILE B 93 26.628 28.583 -9.526 1.00 6.63 C ATOM 3028 O ILE B 93 26.527 29.688 -10.108 1.00 9.12 O ATOM 3029 CB ILE B 93 24.406 27.764 -10.239 1.00 4.70 C ATOM 3030 CG1 ILE B 93 23.800 27.766 -8.822 1.00 4.73 C ATOM 3031 CG2 ILE B 93 23.598 26.887 -11.160 1.00 2.62 C ATOM 3032 CD1 ILE B 93 22.376 28.295 -8.842 1.00 5.82 C ATOM 3033 HA ILE B 93 26.160 27.167 -11.182 1.00 0.00 H ATOM 3034 HB ILE B 93 24.357 28.759 -10.682 1.00 0.00 H ATOM 3035 HG12 ILE B 93 23.797 26.748 -8.433 1.00 0.00 H ATOM 3036 HG13 ILE B 93 24.407 28.399 -8.175 1.00 0.00 H ATOM 3037 HD11 ILE B 93 22.374 29.315 -9.226 1.00 0.00 H ATOM 3038 HD12 ILE B 93 21.764 27.662 -9.485 1.00 0.00 H ATOM 3039 HD13 ILE B 93 21.972 28.286 -7.830 1.00 0.00 H ATOM 3040 HG21 ILE B 93 24.000 26.956 -12.171 1.00 0.00 H ATOM 3041 HG22 ILE B 93 23.651 25.854 -10.816 1.00 0.00 H ATOM 3042 HG23 ILE B 93 22.560 27.219 -11.158 1.00 0.00 H ATOM 3043 H ILE B 93 25.578 25.788 -8.700 1.00 0.00 H ATOM 3044 N GLY B 94 27.298 28.389 -8.403 1.00 5.81 N ATOM 3045 CA GLY B 94 28.002 29.490 -7.766 1.00 6.10 C ATOM 3046 C GLY B 94 27.243 30.516 -6.963 1.00 7.61 C ATOM 3047 O GLY B 94 27.649 31.698 -6.864 1.00 8.02 O ATOM 3048 HA3 GLY B 94 28.519 30.032 -8.558 1.00 0.00 H ATOM 3049 HA2 GLY B 94 28.736 29.046 -7.093 1.00 0.00 H ATOM 3050 H GLY B 94 27.322 27.443 -7.972 1.00 0.00 H ATOM 3051 N CYS B 95 26.203 30.158 -6.242 1.00 8.53 N ATOM 3052 CA CYS B 95 25.407 31.057 -5.396 1.00 10.64 C ATOM 3053 C CYS B 95 26.043 31.220 -4.022 1.00 10.67 C ATOM 3054 O CYS B 95 26.636 30.304 -3.435 1.00 11.60 O ATOM 3055 CB CYS B 95 23.996 30.494 -5.307 1.00 12.36 C ATOM 3056 SG CYS B 95 22.661 31.371 -4.488 1.00 16.58 S ATOM 3057 HA CYS B 95 25.370 32.054 -5.835 1.00 0.00 H ATOM 3058 HB2 CYS B 95 24.084 29.533 -4.800 1.00 0.00 H ATOM 3059 HB3 CYS B 95 23.668 30.333 -6.334 1.00 0.00 H ATOM 3060 HG CYS B 95 21.505 30.621 -4.565 1.00 0.00 H ATOM 3061 H CYS B 95 25.921 29.157 -6.273 1.00 0.00 H ATOM 3062 N THR B 96 25.948 32.428 -3.507 1.00 10.55 N ATOM 3063 CA THR B 96 26.412 32.845 -2.198 1.00 9.47 C ATOM 3064 C THR B 96 25.340 33.793 -1.612 1.00 8.89 C ATOM 3065 O THR B 96 24.596 34.335 -2.434 1.00 8.96 O ATOM 3066 CB THR B 96 27.686 33.703 -2.218 1.00 9.24 C ATOM 3067 OG1 THR B 96 27.311 34.875 -2.970 1.00 10.37 O ATOM 3068 CG2 THR B 96 28.888 32.989 -2.741 1.00 7.41 C ATOM 3069 HA THR B 96 26.603 31.928 -1.641 1.00 0.00 H ATOM 3070 HB THR B 96 28.018 33.965 -1.214 1.00 0.00 H ATOM 3071 HG1 THR B 96 28.086 35.488 -3.031 1.00 0.00 H ATOM 3072 HG23 THR B 96 29.095 32.122 -2.114 1.00 0.00 H ATOM 3073 HG21 THR B 96 28.699 32.663 -3.764 1.00 0.00 H ATOM 3074 HG22 THR B 96 29.745 33.663 -2.726 1.00 0.00 H ATOM 3075 H THR B 96 25.495 33.155 -4.097 1.00 0.00 H ATOM 3076 N LEU B 97 25.326 33.910 -0.321 1.00 8.54 N ATOM 3077 CA LEU B 97 24.401 34.779 0.418 1.00 9.20 C ATOM 3078 C LEU B 97 25.127 36.084 0.783 1.00 10.51 C ATOM 3079 O LEU B 97 26.154 35.996 1.470 1.00 10.79 O ATOM 3080 CB LEU B 97 24.041 34.156 1.751 1.00 7.77 C ATOM 3081 CG LEU B 97 22.760 33.367 1.844 1.00 8.61 C ATOM 3082 CD1 LEU B 97 22.756 32.631 3.177 1.00 8.89 C ATOM 3083 CD2 LEU B 97 21.538 34.276 1.754 1.00 7.87 C ATOM 3084 HA LEU B 97 23.522 34.936 -0.207 1.00 0.00 H ATOM 3085 HB2 LEU B 97 24.855 33.485 2.025 1.00 0.00 H ATOM 3086 HB3 LEU B 97 23.977 34.964 2.479 1.00 0.00 H ATOM 3087 HG LEU B 97 22.709 32.665 1.011 1.00 0.00 H ATOM 3088 HD21 LEU B 97 21.561 34.996 2.572 1.00 0.00 H ATOM 3089 HD22 LEU B 97 21.550 34.806 0.801 1.00 0.00 H ATOM 3090 HD23 LEU B 97 20.632 33.673 1.825 1.00 0.00 H ATOM 3091 HD11 LEU B 97 23.615 31.962 3.224 1.00 0.00 H ATOM 3092 HD12 LEU B 97 22.813 33.355 3.990 1.00 0.00 H ATOM 3093 HD13 LEU B 97 21.837 32.052 3.268 1.00 0.00 H ATOM 3094 H LEU B 97 26.013 33.353 0.226 1.00 0.00 H ATOM 3095 N ASN B 98 24.590 37.232 0.372 1.00 11.99 N ATOM 3096 CA ASN B 98 25.303 38.452 0.759 1.00 14.01 C ATOM 3097 C ASN B 98 24.491 39.369 1.639 1.00 15.65 C ATOM 3098 O ASN B 98 23.292 39.663 1.483 1.00 16.15 O ATOM 3099 CB ASN B 98 25.901 39.099 -0.487 1.00 13.38 C ATOM 3100 CG ASN B 98 26.591 38.075 -1.380 1.00 13.39 C ATOM 3101 OD1 ASN B 98 27.795 37.885 -1.325 1.00 11.63 O ATOM 3102 ND2 ASN B 98 25.808 37.431 -2.250 1.00 14.23 N ATOM 3103 HA ASN B 98 26.135 38.190 1.412 1.00 0.00 H ATOM 3104 HB2 ASN B 98 25.103 39.580 -1.053 1.00 0.00 H ATOM 3105 HB3 ASN B 98 26.630 39.849 -0.180 1.00 0.00 H ATOM 3106 HD22 ASN B 98 24.785 37.619 -2.267 1.00 0.00 H ATOM 3107 HD21 ASN B 98 26.221 36.741 -2.910 1.00 0.00 H ATOM 3108 H ASN B 98 23.716 37.260 -0.191 1.00 0.00 H ATOM 3109 N PHE B 99 25.188 39.846 2.675 1.00 16.78 N ATOM 3110 CA PHE B 99 24.515 40.844 3.556 1.00 19.06 C ATOM 3111 C PHE B 99 25.657 41.631 4.187 1.00 19.56 C ATOM 3112 O PHE B 99 25.398 42.517 4.988 1.00 21.08 O ATOM 3113 CB PHE B 99 23.501 40.291 4.509 1.00 18.39 C ATOM 3114 CG PHE B 99 24.177 39.460 5.552 1.00 20.47 C ATOM 3115 CD1 PHE B 99 24.587 38.177 5.238 1.00 20.10 C ATOM 3116 CD2 PHE B 99 24.439 40.016 6.802 1.00 21.49 C ATOM 3117 CE1 PHE B 99 25.252 37.435 6.209 1.00 22.35 C ATOM 3118 CE2 PHE B 99 25.102 39.248 7.770 1.00 21.95 C ATOM 3119 CZ PHE B 99 25.503 37.963 7.475 1.00 21.98 C ATOM 3120 HA PHE B 99 23.860 41.497 2.980 1.00 0.00 H ATOM 3121 OXT PHE B 99 26.775 41.311 3.755 1.00 23.43 O ATOM 3122 HB2 PHE B 99 22.971 41.113 4.990 1.00 0.00 H ATOM 3123 HB3 PHE B 99 22.789 39.674 3.961 1.00 0.00 H ATOM 3124 HD2 PHE B 99 24.132 41.038 7.025 1.00 0.00 H ATOM 3125 HE2 PHE B 99 25.300 39.668 8.756 1.00 0.00 H ATOM 3126 HZ PHE B 99 26.014 37.362 8.228 1.00 0.00 H ATOM 3127 HE1 PHE B 99 25.583 36.423 5.976 1.00 0.00 H ATOM 3128 HD1 PHE B 99 24.393 37.756 4.251 1.00 0.00 H ATOM 3129 H PHE B 99 26.162 39.533 2.860 1.00 0.00 H TER 3130 PHE B 99 HETATM 3131 O HOH 1 9.223 28.514 2.355 1.00 7.90 O HETATM 3132 O HOH 2 16.546 40.545 0.598 1.00 12.64 O HETATM 3133 O HOH 3 14.508 45.440 12.209 1.00 14.15 O HETATM 3134 O HOH 4 33.825 27.242 3.930 1.00 15.76 O HETATM 3135 O HOH 5 15.001 48.086 12.552 1.00 20.11 O HETATM 3136 O HOH 6 22.315 42.316 -0.153 1.00 22.94 O HETATM 3137 O HOH 7 7.960 38.985 11.105 1.00 23.25 O HETATM 3138 O HOH 8 7.959 15.144 4.518 1.00 23.41 O HETATM 3139 O HOH 9 10.952 30.555 1.544 1.00 23.61 O HETATM 3140 O HOH 10 28.861 27.747 14.272 1.00 23.18 O HETATM 3141 O HOH 11 16.560 42.270 1.990 1.00 23.77 O HETATM 3142 O HOH 12 31.443 27.666 2.882 1.00 25.62 O HETATM 3143 O HOH 13 19.743 50.013 2.308 1.00 25.17 O HETATM 3144 O HOH 14 5.145 20.322 19.163 1.00 25.67 O HETATM 3145 O HOH 15 -4.408 34.794 28.125 1.00 26.17 O HETATM 3146 O HOH 16 -2.206 34.514 23.997 1.00 25.40 O HETATM 3147 O HOH 17 -0.262 27.282 11.332 1.00 27.25 O HETATM 3148 O HOH 18 19.988 26.973 20.950 1.00 25.99 O HETATM 3149 O HOH 19 -5.715 29.495 17.619 1.00 27.37 O HETATM 3150 O HOH 20 -4.294 31.922 16.579 1.00 27.63 O HETATM 3151 O HOH 21 20.320 47.396 6.217 1.00 28.35 O HETATM 3152 O HOH 22 19.714 47.164 3.093 1.00 26.76 O HETATM 3153 O HOH 23 25.347 37.809 -9.044 1.00 27.68 O HETATM 3154 O HOH 24 4.419 18.150 18.214 1.00 28.85 O HETATM 3155 O HOH 25 27.973 29.196 16.244 1.00 29.51 O HETATM 3156 O HOH 26 18.366 48.741 0.616 1.00 27.60 O HETATM 3157 O HOH 27 7.121 32.395 30.134 1.00 28.23 O HETATM 3158 O HOH 28 8.888 40.429 5.132 1.00 28.77 O HETATM 3159 O HOH 29 -3.134 40.246 25.160 1.00 29.66 O HETATM 3160 O HOH 30 32.566 34.565 -2.769 1.00 29.86 O HETATM 3161 O HOH 31 -2.274 36.991 22.393 1.00 28.95 O HETATM 3162 O HOH 32 26.161 39.821 20.225 1.00 31.18 O HETATM 3163 O HOH 33 1.796 41.499 17.665 1.00 31.63 O HETATM 3164 O HOH 34 16.597 46.968 15.014 1.00 30.98 O HETATM 3165 O HOH 35 29.467 26.623 8.925 1.00 30.10 O HETATM 3166 O HOH 36 32.126 28.034 5.845 1.00 31.44 O HETATM 3167 O HOH 37 0.046 33.892 26.205 1.00 29.59 O HETATM 3168 O HOH 38 -1.590 40.700 23.220 1.00 30.15 O HETATM 3169 O HOH 39 7.351 35.874 6.351 1.00 32.02 O HETATM 3170 O HOH 40 29.269 28.487 4.831 1.00 31.57 O HETATM 3171 O HOH 41 5.558 13.386 4.154 1.00 33.17 O HETATM 3172 O HOH 42 6.599 38.849 7.269 1.00 33.34 O HETATM 3173 O HOH 43 16.826 46.096 11.010 1.00 32.84 O HETATM 3174 O HOH 44 28.711 38.907 16.235 1.00 33.09 O HETATM 3175 O HOH 45 28.034 19.896 0.620 1.00 32.59 O HETATM 3176 O HOH 46 24.368 40.520 -8.147 1.00 33.92 O HETATM 3177 O HOH 47 21.241 25.509 16.129 1.00 33.14 O HETATM 3178 O HOH 48 -1.555 31.340 23.103 1.00 34.03 O HETATM 3179 O HOH 49 5.134 33.289 7.857 1.00 34.82 O HETATM 3180 O HOH 50 9.658 37.608 4.078 1.00 34.35 O HETATM 3181 O HOH 51 7.369 47.036 13.423 1.00 35.62 O HETATM 3182 O HOH 52 29.634 36.794 18.502 1.00 36.27 O HETATM 3183 O HOH 53 4.413 32.680 5.041 1.00 36.00 O HETATM 3184 O HOH 54 12.073 42.422 22.105 1.00 35.54 O HETATM 3185 O HOH 55 28.854 30.072 7.870 1.00 34.77 O HETATM 3186 O HOH 56 1.755 17.805 15.547 1.00 35.35 O HETATM 3187 O HOH 57 5.103 35.678 10.977 1.00 35.77 O HETATM 3188 O HOH 58 5.645 38.929 22.272 1.00 36.99 O HETATM 3189 O HOH 59 21.055 23.104 18.987 1.00 35.50 O HETATM 3190 O HOH 60 15.576 34.200 28.618 1.00 38.11 O HETATM 3191 O HOH 61 0.557 36.569 20.621 1.00 37.43 O HETATM 3192 O HOH 62 30.737 19.578 2.152 1.00 38.48 O HETATM 3193 O HOH 63 29.615 30.568 14.516 1.00 37.30 O HETATM 3194 O HOH 64 22.698 26.842 20.703 1.00 37.89 O HETATM 3195 O HOH 65 -0.859 28.479 8.827 1.00 37.70 O HETATM 3196 O HOH 66 30.685 28.842 11.206 1.00 39.09 O HETATM 3197 O HOH 67 28.402 22.102 7.172 1.00 38.34 O HETATM 3198 O HOH 68 -1.955 39.170 28.535 1.00 41.43 O HETATM 3199 O HOH 69 -3.201 39.311 21.117 1.00 40.41 O HETATM 3200 O HOH 70 27.850 44.322 7.811 1.00 39.58 O HETATM 3201 O HOH 71 26.667 38.036 17.908 1.00 41.63 O HETATM 3202 O HOH 72 5.492 38.480 9.731 1.00 40.62 O HETATM 3203 O HOH 73 6.918 40.441 14.638 1.00 42.43 O HETATM 3204 O HOH 74 6.246 31.744 27.839 1.00 41.81 O HETATM 3205 O HOH 75 5.696 28.484 27.804 1.00 42.36 O HETATM 3206 O HOH 76 16.832 27.482 26.032 1.00 43.30 O HETATM 3207 O HOH 77 17.009 49.577 15.852 1.00 44.86 O HETATM 3208 O HOH 78 7.484 41.154 22.293 1.00 44.15 O HETATM 3209 O HOH 79 20.247 45.066 9.914 1.00 44.81 O HETATM 3210 O HOH 80 27.560 30.286 20.582 1.00 48.87 O HETATM 3211 O HOH 81 11.843 20.867 6.916 1.00 11.50 O HETATM 3212 O HOH 82 18.737 16.386 2.028 1.00 21.02 O HETATM 3213 O HOH 83 28.743 28.899 -3.090 1.00 13.04 O HETATM 3214 O HOH 84 12.776 35.946 -3.786 1.00 18.22 O HETATM 3215 O HOH 85 19.504 21.898 -19.738 1.00 19.34 O HETATM 3216 O HOH 86 21.013 22.574 5.709 1.00 20.50 O HETATM 3217 O HOH 87 11.165 35.799 -5.887 1.00 23.14 O HETATM 3218 O HOH 88 25.714 16.308 -5.881 1.00 24.02 O HETATM 3219 O HOH 89 28.054 33.798 -6.241 1.00 23.59 O HETATM 3220 O HOH 90 5.138 20.445 -13.903 1.00 25.55 O HETATM 3221 O HOH 91 28.060 26.250 -13.460 1.00 24.54 O HETATM 3222 O HOH 92 17.986 20.132 -18.761 1.00 24.82 O HETATM 3223 O HOH 93 6.842 22.734 -11.246 1.00 25.25 O HETATM 3224 O HOH 94 10.902 14.236 -15.684 1.00 26.41 O HETATM 3225 O HOH 95 16.310 0.970 2.960 1.00 25.81 O HETATM 3226 O HOH 96 8.132 28.759 -13.161 1.00 26.44 O HETATM 3227 O HOH 97 27.771 17.896 -6.156 1.00 26.46 O HETATM 3228 O HOH 98 20.765 15.455 -3.221 1.00 26.65 O HETATM 3229 O HOH 99 5.674 33.355 -3.370 1.00 27.90 O HETATM 3230 O HOH 100 6.336 36.058 -2.014 1.00 27.85 O HETATM 3231 O HOH 101 28.914 35.943 -4.566 1.00 27.26 O HETATM 3232 O HOH 102 10.770 17.998 14.668 1.00 28.56 O HETATM 3233 O HOH 103 4.603 36.287 -4.091 1.00 28.07 O HETATM 3234 O HOH 104 11.540 1.560 0.140 1.00 30.41 O HETATM 3235 O HOH 105 16.552 27.502 -17.286 1.00 30.37 O HETATM 3236 O HOH 106 21.576 6.492 -0.090 1.00 29.89 O HETATM 3237 O HOH 107 7.740 29.580 -16.190 1.00 32.19 O HETATM 3238 O HOH 108 21.902 6.070 -7.969 1.00 31.68 O HETATM 3239 O HOH 109 24.854 15.789 -0.790 1.00 31.22 O HETATM 3240 O HOH 110 23.908 39.434 -10.925 1.00 32.71 O HETATM 3241 O HOH 111 24.100 0.180 -10.820 1.00 33.26 O HETATM 3242 O HOH 112 8.266 9.440 0.740 1.00 32.36 O HETATM 3243 O HOH 113 6.966 27.252 -15.246 1.00 34.44 O HETATM 3244 O HOH 114 31.342 29.222 -4.938 1.00 34.18 O HETATM 3245 O HOH 115 5.745 22.886 -7.773 1.00 35.83 O HETATM 3246 O HOH 116 5.858 22.165 -17.218 1.00 36.46 O HETATM 3247 O HOH 117 22.486 -2.580 -10.993 1.00 34.52 O HETATM 3248 O HOH 118 10.540 0.870 2.780 1.00 34.81 O HETATM 3249 O HOH 119 3.878 31.257 -3.318 1.00 34.77 O HETATM 3250 O HOH 120 18.530 -0.360 3.980 1.00 36.14 O HETATM 3251 O HOH 121 7.190 37.046 2.537 1.00 36.15 O HETATM 3252 O HOH 122 9.245 10.945 -16.652 1.00 35.81 O HETATM 3253 O HOH 123 5.879 37.726 0.422 1.00 37.67 O HETATM 3254 O HOH 124 16.620 5.080 -17.810 1.00 37.85 O HETATM 3255 O HOH 125 23.617 12.433 -1.375 1.00 37.92 O HETATM 3256 O HOH 126 1.568 29.066 1.072 1.00 37.48 O HETATM 3257 O HOH 127 16.650 20.160 -21.750 1.00 40.13 O HETATM 3258 O HOH 128 4.080 39.463 -1.681 1.00 39.85 O HETATM 3259 O HOH 129 23.870 2.970 -10.120 1.00 39.90 O HETATM 3260 O HOH 130 20.600 6.885 -11.530 1.00 41.34 O HETATM 3261 O HOH 131 5.170 14.190 -5.250 1.00 39.80 O HETATM 3262 O HOH 132 10.133 7.512 -17.402 1.00 41.51 O HETATM 3263 O HOH 133 6.255 8.350 -4.439 1.00 44.61 O HETATM 3264 C1 BAY A 134 4.572 29.419 7.558 1.00 -0.04 C HETATM 3265 C4 BAY A 134 3.859 28.214 7.049 1.00 0.08 C HETATM 3266 C2 BAY A 134 3.322 28.655 5.729 1.00 -0.04 C HETATM 3267 H4 BAY A 134 2.793 29.612 5.850 1.00 0.03 H HETATM 3268 H5 BAY A 134 2.625 27.896 5.345 1.00 0.03 H HETATM 3269 H6 BAY A 134 4.153 28.782 5.019 1.00 0.03 H HETATM 3270 C3 BAY A 134 2.650 28.042 7.901 1.00 -0.04 C HETATM 3271 H7 BAY A 134 2.158 29.016 8.040 1.00 0.03 H HETATM 3272 H8 BAY A 134 2.946 27.637 8.880 1.00 0.03 H HETATM 3273 H9 BAY A 134 1.953 27.346 7.412 1.00 0.03 H HETATM 3274 S5 BAY A 134 4.713 26.644 6.783 1.00 -0.02 S HETATM 3275 O6 BAY A 134 5.677 26.840 7.809 1.00 -0.17 O HETATM 3276 O7 BAY A 134 4.000 25.535 6.748 1.00 -0.17 O HETATM 3277 C8 BAY A 134 5.771 27.211 5.411 1.00 0.09 C HETATM 3278 C9 BAY A 134 6.744 26.281 4.703 1.00 0.08 C HETATM 3279 C10 BAY A 134 6.869 26.858 3.247 1.00 0.00 C HETATM 3280 C11 BAY A 134 5.803 26.127 2.369 1.00 -0.03 C HETATM 3281 C12 BAY A 134 4.715 25.535 3.041 1.00 -0.06 C HETATM 3282 C13 BAY A 134 3.739 24.873 2.278 1.00 -0.07 C HETATM 3283 C14 BAY A 134 3.871 24.817 0.871 1.00 -0.06 C HETATM 3284 C15 BAY A 134 4.958 25.409 0.209 1.00 -0.02 C HETATM 3285 C16 BAY A 134 5.084 25.345 -1.202 1.00 -0.06 C HETATM 3286 C17 BAY A 134 6.191 25.949 -1.865 1.00 -0.06 C HETATM 3287 C18 BAY A 134 7.171 26.618 -1.117 1.00 -0.06 C HETATM 3288 C19 BAY A 134 7.068 26.695 0.308 1.00 -0.05 C HETATM 3289 C20 BAY A 134 5.959 26.088 0.967 1.00 -0.01 C HETATM 3290 H21 BAY A 134 7.828 27.212 0.883 1.00 0.06 H HETATM 3291 H20 BAY A 134 8.012 27.080 -1.622 1.00 0.06 H HETATM 3292 H19 BAY A 134 6.276 25.892 -2.944 1.00 0.06 H HETATM 3293 H18 BAY A 134 4.328 24.830 -1.784 1.00 0.06 H HETATM 3294 H17 BAY A 134 3.114 24.304 0.289 1.00 0.05 H HETATM 3295 H16 BAY A 134 2.889 24.408 2.765 1.00 0.06 H HETATM 3296 H15 BAY A 134 4.633 25.589 4.121 1.00 0.05 H HETATM 3297 H13 BAY A 134 7.878 26.668 2.851 1.00 0.05 H HETATM 3298 H14 BAY A 134 6.675 27.941 3.252 1.00 0.05 H HETATM 3299 C21 BAY A 134 8.154 26.389 5.333 1.00 0.18 C HETATM 3300 O22 BAY A 134 8.807 27.434 5.242 1.00 -0.40 O HETATM 3301 N23 BAY A 134 8.625 25.316 5.964 1.00 -0.27 N HETATM 3302 C24 BAY A 134 9.949 25.348 6.570 1.00 0.13 C HETATM 3303 C25 BAY A 134 10.024 25.455 8.094 1.00 -0.01 C HETATM 3304 C26 BAY A 134 9.163 26.476 8.835 1.00 -0.06 C HETATM 3305 H25 BAY A 134 9.355 26.402 9.916 1.00 0.02 H HETATM 3306 H26 BAY A 134 8.100 26.272 8.637 1.00 0.02 H HETATM 3307 H27 BAY A 134 9.414 27.489 8.487 1.00 0.02 H HETATM 3308 C27 BAY A 134 11.502 25.556 8.531 1.00 -0.06 C HETATM 3309 H28 BAY A 134 12.098 24.811 7.983 1.00 0.02 H HETATM 3310 H29 BAY A 134 11.579 25.364 9.611 1.00 0.02 H HETATM 3311 H30 BAY A 134 11.882 26.564 8.310 1.00 0.02 H HETATM 3312 H24 BAY A 134 9.661 24.482 8.456 1.00 0.03 H HETATM 3313 C28 BAY A 134 10.714 24.125 6.007 1.00 0.20 C HETATM 3314 O29 BAY A 134 10.865 23.074 6.623 1.00 -0.39 O HETATM 3315 N30 BAY A 134 11.202 24.304 4.768 1.00 -0.28 N HETATM 3316 C31 BAY A 134 11.973 23.154 4.124 1.00 0.08 C HETATM 3317 C32 BAY A 134 11.334 22.810 2.780 1.00 0.01 C HETATM 3318 C33 BAY A 134 10.085 21.970 2.821 1.00 -0.04 C HETATM 3319 C34 BAY A 134 10.136 20.584 2.644 1.00 -0.06 C HETATM 3320 C35 BAY A 134 8.920 19.819 2.695 1.00 -0.07 C HETATM 3321 C36 BAY A 134 7.682 20.467 2.920 1.00 -0.07 C HETATM 3322 C37 BAY A 134 7.639 21.870 3.098 1.00 -0.07 C HETATM 3323 C38 BAY A 134 8.827 22.611 3.050 1.00 -0.06 C HETATM 3324 H39 BAY A 134 8.792 23.686 3.188 1.00 0.06 H HETATM 3325 H38 BAY A 134 6.692 22.369 3.271 1.00 0.06 H HETATM 3326 H37 BAY A 134 6.766 19.888 2.956 1.00 0.06 H HETATM 3327 H36 BAY A 134 8.951 18.744 2.561 1.00 0.06 H HETATM 3328 H35 BAY A 134 11.085 20.090 2.470 1.00 0.06 H HETATM 3329 H33 BAY A 134 12.082 22.266 2.184 1.00 0.04 H HETATM 3330 H34 BAY A 134 11.083 23.756 2.278 1.00 0.04 H HETATM 3331 C39 BAY A 134 13.374 23.754 3.712 1.00 0.11 C HETATM 3332 O40 BAY A 134 13.026 24.882 2.858 1.00 -0.39 O HETATM 3333 H41 BAY A 134 13.820 25.309 2.560 1.00 0.21 H HETATM 3334 C41 BAY A 134 14.359 24.102 4.865 1.00 0.11 C HETATM 3335 O42 BAY A 134 15.558 24.713 4.423 1.00 -0.39 O HETATM 3336 H43 BAY A 134 15.352 25.523 3.972 1.00 0.21 H HETATM 3337 C43 BAY A 134 14.736 23.095 5.973 1.00 0.08 C HETATM 3338 C44 BAY A 134 15.421 23.736 7.213 1.00 0.01 C HETATM 3339 C45 BAY A 134 15.769 22.760 8.319 1.00 -0.04 C HETATM 3340 C46 BAY A 134 14.875 22.363 9.329 1.00 -0.06 C HETATM 3341 C47 BAY A 134 15.300 21.431 10.324 1.00 -0.07 C HETATM 3342 C48 BAY A 134 16.609 20.922 10.279 1.00 -0.07 C HETATM 3343 C49 BAY A 134 17.509 21.322 9.268 1.00 -0.07 C HETATM 3344 C50 BAY A 134 17.080 22.247 8.280 1.00 -0.06 C HETATM 3345 H51 BAY A 134 17.761 22.558 7.496 1.00 0.06 H HETATM 3346 H50 BAY A 134 18.518 20.927 9.246 1.00 0.06 H HETATM 3347 H49 BAY A 134 16.932 20.212 11.032 1.00 0.06 H HETATM 3348 H48 BAY A 134 14.619 21.119 11.107 1.00 0.06 H HETATM 3349 H47 BAY A 134 13.868 22.763 9.352 1.00 0.06 H HETATM 3350 H45 BAY A 134 14.740 24.494 7.627 1.00 0.04 H HETATM 3351 H46 BAY A 134 16.350 24.221 6.879 1.00 0.04 H HETATM 3352 N51 BAY A 134 15.625 22.059 5.413 1.00 -0.28 N HETATM 3353 C52 BAY A 134 15.216 20.813 5.134 1.00 0.20 C HETATM 3354 O53 BAY A 134 14.098 20.285 5.268 1.00 -0.39 O HETATM 3355 C54 BAY A 134 16.303 19.888 4.555 1.00 0.13 C HETATM 3356 C55 BAY A 134 15.607 18.816 3.644 1.00 -0.01 C HETATM 3357 C56 BAY A 134 14.689 19.499 2.641 1.00 -0.06 C HETATM 3358 H55 BAY A 134 14.207 18.739 2.008 1.00 0.02 H HETATM 3359 H56 BAY A 134 15.278 20.181 2.010 1.00 0.02 H HETATM 3360 H57 BAY A 134 13.918 20.070 3.179 1.00 0.02 H HETATM 3361 C57 BAY A 134 16.483 17.757 2.992 1.00 -0.06 C HETATM 3362 H58 BAY A 134 17.126 17.293 3.754 1.00 0.02 H HETATM 3363 H59 BAY A 134 17.110 18.225 2.219 1.00 0.02 H HETATM 3364 H60 BAY A 134 15.846 16.987 2.532 1.00 0.02 H HETATM 3365 H54 BAY A 134 14.950 18.251 4.322 1.00 0.03 H HETATM 3366 N58 BAY A 134 16.944 19.184 5.711 1.00 -0.27 N HETATM 3367 C59 BAY A 134 18.298 19.012 5.693 1.00 0.18 C HETATM 3368 O60 BAY A 134 19.017 19.426 4.770 1.00 -0.40 O HETATM 3369 C61 BAY A 134 18.846 18.292 6.906 1.00 0.08 C HETATM 3370 C62 BAY A 134 19.442 19.416 7.788 1.00 0.00 C HETATM 3371 C63 BAY A 134 19.760 18.900 9.178 1.00 -0.03 C HETATM 3372 C64 BAY A 134 21.033 19.181 9.749 1.00 -0.06 C HETATM 3373 C65 BAY A 134 21.324 18.703 11.045 1.00 -0.07 C HETATM 3374 C66 BAY A 134 20.380 17.959 11.765 1.00 -0.06 C HETATM 3375 C67 BAY A 134 19.127 17.673 11.218 1.00 -0.02 C HETATM 3376 C68 BAY A 134 18.188 16.922 11.965 1.00 -0.06 C HETATM 3377 C69 BAY A 134 16.927 16.651 11.383 1.00 -0.06 C HETATM 3378 C70 BAY A 134 16.606 17.119 10.091 1.00 -0.06 C HETATM 3379 C71 BAY A 134 17.550 17.878 9.335 1.00 -0.05 C HETATM 3380 C72 BAY A 134 18.817 18.155 9.903 1.00 -0.01 C HETATM 3381 H71 BAY A 134 17.301 18.236 8.343 1.00 0.06 H HETATM 3382 H70 BAY A 134 15.632 16.900 9.668 1.00 0.06 H HETATM 3383 H69 BAY A 134 16.196 16.075 11.938 1.00 0.06 H HETATM 3384 H68 BAY A 134 18.429 16.563 12.959 1.00 0.06 H HETATM 3385 H67 BAY A 134 20.625 17.601 12.758 1.00 0.05 H HETATM 3386 H66 BAY A 134 22.290 18.914 11.489 1.00 0.06 H HETATM 3387 H65 BAY A 134 21.769 19.754 9.197 1.00 0.05 H HETATM 3388 H63 BAY A 134 18.714 20.237 7.866 1.00 0.05 H HETATM 3389 H64 BAY A 134 20.366 19.788 7.322 1.00 0.05 H HETATM 3390 C73 BAY A 134 20.042 17.328 6.647 1.00 0.09 C HETATM 3391 S74 BAY A 134 19.451 15.799 5.843 1.00 -0.02 S HETATM 3392 O75 BAY A 134 17.990 15.281 6.377 1.00 -0.17 O HETATM 3393 O76 BAY A 134 19.263 15.715 4.290 1.00 -0.17 O HETATM 3394 C77 BAY A 134 20.651 14.603 6.396 1.00 0.08 C HETATM 3395 C78 BAY A 134 22.062 15.072 6.575 1.00 -0.04 C HETATM 3396 H74 BAY A 134 22.686 14.233 6.917 1.00 0.03 H HETATM 3397 H75 BAY A 134 22.088 15.878 7.323 1.00 0.03 H HETATM 3398 H76 BAY A 134 22.448 15.449 5.616 1.00 0.03 H HETATM 3399 C79 BAY A 134 20.648 14.037 7.883 1.00 -0.04 C HETATM 3400 H77 BAY A 134 21.471 13.316 8.003 1.00 0.03 H HETATM 3401 H78 BAY A 134 19.689 13.536 8.083 1.00 0.03 H HETATM 3402 H79 BAY A 134 20.782 14.867 8.592 1.00 0.03 H HETATM 3403 C80 BAY A 134 20.382 13.120 5.936 1.00 -0.04 C HETATM 3404 H80 BAY A 134 21.175 12.465 6.327 1.00 0.03 H HETATM 3405 H81 BAY A 134 20.376 13.072 4.837 1.00 0.03 H HETATM 3406 H82 BAY A 134 19.407 12.787 6.323 1.00 0.03 H HETATM 3407 H72 BAY A 134 20.519 17.074 7.605 1.00 0.05 H HETATM 3408 H73 BAY A 134 20.774 17.824 5.993 1.00 0.05 H HETATM 3409 H62 BAY A 134 18.035 17.751 7.415 1.00 0.06 H HETATM 3410 H61 BAY A 134 16.394 18.849 6.476 1.00 0.19 H HETATM 3411 H53 BAY A 134 17.046 20.463 3.982 1.00 0.08 H HETATM 3412 H52 BAY A 134 16.579 22.298 5.233 1.00 0.19 H HETATM 3413 H44 BAY A 134 13.808 22.614 6.316 1.00 0.06 H HETATM 3414 H42 BAY A 134 13.815 24.889 5.408 1.00 0.06 H HETATM 3415 H40 BAY A 134 13.891 23.003 3.097 1.00 0.06 H HETATM 3416 H32 BAY A 134 12.051 22.283 4.791 1.00 0.06 H HETATM 3417 H31 BAY A 134 11.064 25.166 4.281 1.00 0.19 H HETATM 3418 H23 BAY A 134 10.447 26.253 6.191 1.00 0.08 H HETATM 3419 H22 BAY A 134 8.069 24.487 6.022 1.00 0.19 H HETATM 3420 H12 BAY A 134 6.384 25.242 4.711 1.00 0.06 H HETATM 3421 H10 BAY A 134 6.374 28.040 5.810 1.00 0.05 H HETATM 3422 H11 BAY A 134 5.090 27.592 4.635 1.00 0.05 H HETATM 3423 H1 BAY A 134 3.863 30.256 7.643 1.00 0.03 H HETATM 3424 H2 BAY A 134 5.378 29.691 6.860 1.00 0.03 H HETATM 3425 H3 BAY A 134 5.002 29.200 8.547 1.00 0.03 H CONECT 3264 3265 3423 3424 3425 CONECT 3265 3264 3266 3270 3274 CONECT 3266 3265 3267 3268 3269 CONECT 3267 3266 CONECT 3268 3266 CONECT 3269 3266 CONECT 3270 3265 3271 3272 3273 CONECT 3271 3270 CONECT 3272 3270 CONECT 3273 3270 CONECT 3274 3265 3275 3276 3277 CONECT 3275 3274 CONECT 3276 3274 CONECT 3277 3274 3278 3421 3422 CONECT 3278 3277 3279 3299 3420 CONECT 3279 3278 3280 3297 3298 CONECT 3280 3279 3281 3289 CONECT 3281 3280 3282 3296 CONECT 3282 3281 3283 3295 CONECT 3283 3282 3284 3294 CONECT 3284 3283 3285 3289 CONECT 3285 3284 3286 3293 CONECT 3286 3285 3287 3292 CONECT 3287 3286 3288 3291 CONECT 3288 3287 3289 3290 CONECT 3289 3280 3284 3288 CONECT 3290 3288 CONECT 3291 3287 CONECT 3292 3286 CONECT 3293 3285 CONECT 3294 3283 CONECT 3295 3282 CONECT 3296 3281 CONECT 3297 3279 CONECT 3298 3279 CONECT 3299 3278 3300 3301 CONECT 3300 3299 CONECT 3301 3299 3302 3419 CONECT 3302 3301 3303 3313 3418 CONECT 3303 3302 3304 3308 3312 CONECT 3304 3303 3305 3306 3307 CONECT 3305 3304 CONECT 3306 3304 CONECT 3307 3304 CONECT 3308 3303 3309 3310 3311 CONECT 3309 3308 CONECT 3310 3308 CONECT 3311 3308 CONECT 3312 3303 CONECT 3313 3302 3314 3315 CONECT 3314 3313 CONECT 3315 3313 3316 3417 CONECT 3316 3315 3317 3331 3416 CONECT 3317 3316 3318 3329 3330 CONECT 3318 3317 3319 3323 CONECT 3319 3318 3320 3328 CONECT 3320 3319 3321 3327 CONECT 3321 3320 3322 3326 CONECT 3322 3321 3323 3325 CONECT 3323 3318 3322 3324 CONECT 3324 3323 CONECT 3325 3322 CONECT 3326 3321 CONECT 3327 3320 CONECT 3328 3319 CONECT 3329 3317 CONECT 3330 3317 CONECT 3331 3316 3332 3334 3415 CONECT 3332 3331 3333 CONECT 3333 3332 CONECT 3334 3331 3335 3337 3414 CONECT 3335 3334 3336 CONECT 3336 3335 CONECT 3337 3334 3338 3352 3413 CONECT 3338 3337 3339 3350 3351 CONECT 3339 3338 3340 3344 CONECT 3340 3339 3341 3349 CONECT 3341 3340 3342 3348 CONECT 3342 3341 3343 3347 CONECT 3343 3342 3344 3346 CONECT 3344 3339 3343 3345 CONECT 3345 3344 CONECT 3346 3343 CONECT 3347 3342 CONECT 3348 3341 CONECT 3349 3340 CONECT 3350 3338 CONECT 3351 3338 CONECT 3352 3337 3353 3412 CONECT 3353 3352 3354 3355 CONECT 3354 3353 CONECT 3355 3353 3356 3366 3411 CONECT 3356 3355 3357 3361 3365 CONECT 3357 3356 3358 3359 3360 CONECT 3358 3357 CONECT 3359 3357 CONECT 3360 3357 CONECT 3361 3356 3362 3363 3364 CONECT 3362 3361 CONECT 3363 3361 CONECT 3364 3361 CONECT 3365 3356 CONECT 3366 3355 3367 3410 CONECT 3367 3366 3368 3369 CONECT 3368 3367 CONECT 3369 3367 3370 3390 3409 CONECT 3370 3369 3371 3388 3389 CONECT 3371 3370 3372 3380 CONECT 3372 3371 3373 3387 CONECT 3373 3372 3374 3386 CONECT 3374 3373 3375 3385 CONECT 3375 3374 3376 3380 CONECT 3376 3375 3377 3384 CONECT 3377 3376 3378 3383 CONECT 3378 3377 3379 3382 CONECT 3379 3378 3380 3381 CONECT 3380 3371 3375 3379 CONECT 3381 3379 CONECT 3382 3378 CONECT 3383 3377 CONECT 3384 3376 CONECT 3385 3374 CONECT 3386 3373 CONECT 3387 3372 CONECT 3388 3370 CONECT 3389 3370 CONECT 3390 3369 3391 3407 3408 CONECT 3391 3390 3392 3393 3394 CONECT 3392 3391 CONECT 3393 3391 CONECT 3394 3391 3395 3399 3403 CONECT 3395 3394 3396 3397 3398 CONECT 3396 3395 CONECT 3397 3395 CONECT 3398 3395 CONECT 3399 3394 3400 3401 3402 CONECT 3400 3399 CONECT 3401 3399 CONECT 3402 3399 CONECT 3403 3394 3404 3405 3406 CONECT 3404 3403 CONECT 3405 3403 CONECT 3406 3403 CONECT 3407 3390 CONECT 3408 3390 CONECT 3409 3369 CONECT 3410 3366 CONECT 3411 3355 CONECT 3412 3352 CONECT 3413 3337 CONECT 3414 3334 CONECT 3415 3331 CONECT 3416 3316 CONECT 3417 3315 CONECT 3418 3302 CONECT 3419 3301 CONECT 3420 3278 CONECT 3421 3277 CONECT 3422 3277 CONECT 3423 3264 CONECT 3424 3264 CONECT 3425 3264 MASTER 0 0 0 0 0 0 0 0 3423 2 162 16 END
Display Options:
Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
Goto PDB code:
3D presentation of molecule is powered by
3Dmol
, which supports all modern browsers and mobile devices via WebGL.
Hold mouse button:
left to rotate,middle to shift,right to zoom
Related entries of code: 1vik
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
1eby
RCSB PDB
PDBbind
99aa, >1EBY_1|Chains... at 90%
1hxw
RCSB PDB
PDBbind
99aa, >1HXW_1|Chains... at 90%
1izh
RCSB PDB
PDBbind
99aa, >1IZH_1|Chains... at 90%
1k6c
RCSB PDB
PDBbind
99aa, >1K6C_1|Chains... at 91%
1k6p
RCSB PDB
PDBbind
99aa, >1K6P_1|Chains... at 91%
1k6t
RCSB PDB
PDBbind
99aa, >1K6T_1|Chains... at 91%
1k6v
RCSB PDB
PDBbind
99aa, >1K6V_1|Chains... at 91%
1pro
RCSB PDB
PDBbind
99aa, >1PRO_1|Chains... at 90%
1sbg
RCSB PDB
PDBbind
99aa, >1SBG_1|Chains... at 90%
1t7j
RCSB PDB
PDBbind
99aa, >1T7J_1|Chains... at 91%
1vij
RCSB PDB
PDBbind
99aa, >1VIJ_1|Chains... at 90%
1zp8
RCSB PDB
PDBbind
99aa, >1ZP8_1|Chain... at 90%
1zpa
RCSB PDB
PDBbind
99aa, >1ZPA_1|Chain... at 90%
2az8
RCSB PDB
PDBbind
99aa, >2AZ8_1|Chain... at 91%
2az9
RCSB PDB
PDBbind
99aa, >2AZ9_1|Chain... at 90%
2i4d
RCSB PDB
PDBbind
99aa, >2I4D_1|Chains... at 90%
2i4u
RCSB PDB
PDBbind
99aa, >2I4U_1|Chains... at 90%
2i4w
RCSB PDB
PDBbind
99aa, >2I4W_1|Chains... at 90%
2o4k
RCSB PDB
PDBbind
99aa, >2O4K_1|Chains... at 90%
2o4p
RCSB PDB
PDBbind
99aa, >2O4P_1|Chains... at 90%
2o4s
RCSB PDB
PDBbind
99aa, >2O4S_1|Chains... at 90%
2p3b
RCSB PDB
PDBbind
99aa, >2P3B_2|Chain... at 90%
3ekp
RCSB PDB
PDBbind
99aa, >3EKP_1|Chains... at 90%
3ekq
RCSB PDB
PDBbind
99aa, >3EKQ_1|Chains... at 90%
3ekt
RCSB PDB
PDBbind
99aa, >3EKT_1|Chains... at 90%
3ekw
RCSB PDB
PDBbind
99aa, >3EKW_1|Chains... at 90%
3el0
RCSB PDB
PDBbind
99aa, >3EL0_1|Chains... at 90%
3el4
RCSB PDB
PDBbind
99aa, >3EL4_1|Chains... at 92%
3el5
RCSB PDB
PDBbind
99aa, >3EL5_1|Chains... at 91%
3kfn
RCSB PDB
PDBbind
99aa, >3KFN_1|Chains... at 91%
3m9f
RCSB PDB
PDBbind
99aa, >3M9F_1|Chains... at 90%
3tlh
RCSB PDB
PDBbind
99aa, >3TLH_1|Chain... at 90%
4eqj
RCSB PDB
PDBbind
203aa, >4EQJ_1|Chain... *
4ll3
RCSB PDB
PDBbind
99aa, >4LL3_1|Chains... at 90%
4phv
RCSB PDB
PDBbind
99aa, >4PHV_1|Chains... at 90%
5hvp
RCSB PDB
PDBbind
99aa, >5HVP_1|Chains... at 90%
5ivs
RCSB PDB
PDBbind
99aa, >5IVS_1|Chains... at 90%
6dgx
RCSB PDB
PDBbind
99aa, >6DGX_1|Chains... at 91%
6dgy
RCSB PDB
PDBbind
99aa, >6DGY_1|Chains... at 91%
6dgz
RCSB PDB
PDBbind
99aa, >6DGZ_1|Chains... at 91%
6dh0
RCSB PDB
PDBbind
99aa, >6DH0_1|Chains... at 90%
6dh1
RCSB PDB
PDBbind
99aa, >6DH1_1|Chains... at 90%
6dh2
RCSB PDB
PDBbind
99aa, >6DH2_1|Chains... at 90%
6dh3
RCSB PDB
PDBbind
99aa, >6DH3_1|Chains... at 90%
6dh4
RCSB PDB
PDBbind
99aa, >6DH4_1|Chains... at 90%
6dh5
RCSB PDB
PDBbind
99aa, >6DH5_1|Chains... at 90%
6dh6
RCSB PDB
PDBbind
99aa, >6DH6_1|Chains... at 90%
6dh7
RCSB PDB
PDBbind
99aa, >6DH7_1|Chains... at 90%
6dh8
RCSB PDB
PDBbind
99aa, >6DH8_1|Chains... at 90%
9hvp
RCSB PDB
PDBbind
99aa, >9HVP_1|Chains... at 90%
6oy2
RCSB PDB
PDBbind
99aa, >6OY2_1|Chains... at 91%
6oy0
RCSB PDB
PDBbind
99aa, >6OY0_1|Chains... at 91%
6oxz
RCSB PDB
PDBbind
99aa, >6OXZ_1|Chains... at 91%
6oxy
RCSB PDB
PDBbind
99aa, >6OXY_1|Chains... at 91%
6oxx
RCSB PDB
PDBbind
99aa, >6OXX_1|Chains... at 91%
6oxw
RCSB PDB
PDBbind
99aa, >6OXW_1|Chains... at 91%
6oxv
RCSB PDB
PDBbind
99aa, >6OXV_1|Chains... at 91%
6oxu
RCSB PDB
PDBbind
99aa, >6OXU_1|Chains... at 91%
6oxt
RCSB PDB
PDBbind
99aa, >6OXT_1|Chains... at 91%
6oxs
RCSB PDB
PDBbind
99aa, >6OXS_1|Chains... at 91%
6oxr
RCSB PDB
PDBbind
99aa, >6OXR_1|Chains... at 91%
6oxq
RCSB PDB
PDBbind
99aa, >6OXQ_1|Chains... at 91%
6oxp
RCSB PDB
PDBbind
99aa, >6OXP_1|Chains... at 91%
6oou
RCSB PDB
PDBbind
99aa, >6OOU_1|Chains... at 90%
6oos
RCSB PDB
PDBbind
99aa, >6OOS_1|Chains... at 90%
6oy1
RCSB PDB
PDBbind
99aa, >6OY1_1|Chains... at 91%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1vij
RCSB PDB
PDBbind
BAY
Entry Information
PDB ID
1vik
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
hiv-1 protease
Ligand Name
BAY
EC.Number
E.C.3.4.23.16
Resolution
2.4(Å)
Affinity (Kd/Ki/IC50)
IC50=0.3nM
Release Year
1998
Protein/NA Sequence
Check fasta file
Primary Reference
Eur.J.Biochem. v248 pp. 313-22, 1997
Ligand Properties
Formula
C
6
4
H
8
2
N
4
O
1
0
S
2
Molecular Weight
1131.490
Exact Mass
1130.550
No. of atoms
162
No. of bonds
167
Polar Surface Area
241.9
LOGP Value
10.15 (
Computed with XLOGP3
)
11.62 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 6
No. of Hydrogen Bond Acceptors: 10
No. of Rotatable Bonds: 33
No. of Nitrogen and Oxygen Atoms: 14
No. of Rings: 6
Canonical SMILES
O[C@@H]([C@@H]([C@H](Cc1ccccc1)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](CS(=O)(=O)C(C)(C)C)Cc1cccc2c1cccc2)O)[C@H](Cc1ccccc1)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](CS(=O)(=O)C(C)(C)C)Cc1cccc2c1cccc2
InChI String
InChI=1S/C64H82N4O10S2/c1-41(2)55(67-59(71)49(39-79(75,76)63(5,6)7)37-47-31-21-29-45-27-17-19-33-51(45)47)61(73)65-53(35-43-23-13-11-14-24-43)57(69)58(70)54(36-44-25-15-12-16-26-44)66-62(74)56(42(3)4)68-60(72)50(40-80(77,78)64(8,9)10)38-48-32-22-30-46-28-18-20-34-52(46)48/h11-34,41-42,49-50,53-58,69-70H,35-40H2,1-10H3,(H,65,73)(H,66,74)(H,67,71)(H,68,72)/t49-,50-,53+,54+,55+,56+,57-,58-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P12499
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
This site has been visited
times since Nov 2007.
Copyright ©2007-2024 涓婃捣鐩堣禌鎬濅俊鎭鎶鏈夐檺鍏徃 缃戠珯澶囨鍙凤細
娌狪CP澶2021015625鍙-3
娌叕缃戝畨澶囷細
姝e湪鐢宠涓
Technical Support锛堟妧鏈敮鎸侊級:
yingsaisi@foxmail.com