Browse entries in the PDBbind-CN Database
HEADER 1IZH_COMPLEX COMPND 1IZH_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 Q A 50 99 ATOM 1 N PRO A 1 28.721 40.079 5.613 1.00 36.25 N ATOM 2 CA PRO A 1 29.610 38.971 5.185 1.00 35.47 C ATOM 3 C PRO A 1 29.034 38.272 3.988 1.00 33.71 C ATOM 4 O PRO A 1 27.890 38.531 3.647 1.00 27.37 O ATOM 5 CB PRO A 1 29.610 38.012 6.382 1.00 36.82 C ATOM 6 CG PRO A 1 28.502 38.398 7.164 1.00 37.19 C ATOM 7 CD PRO A 1 28.240 39.862 6.980 1.00 37.01 C ATOM 8 HA PRO A 1 30.606 39.320 4.910 1.00 0.00 H ATOM 9 HD3 PRO A 1 27.178 40.090 7.069 1.00 0.00 H ATOM 10 HD2 PRO A 1 28.800 40.460 7.699 1.00 0.00 H ATOM 11 HG3 PRO A 1 28.712 38.196 8.214 1.00 0.00 H ATOM 12 HG2 PRO A 1 27.624 37.831 6.854 1.00 0.00 H ATOM 13 HB2 PRO A 1 29.501 36.981 6.046 1.00 0.00 H ATOM 14 HB3 PRO A 1 30.534 38.111 6.952 1.00 0.00 H ATOM 15 N GLN A 2 29.863 37.472 3.327 1.00 32.91 N ATOM 16 CA GLN A 2 29.424 36.589 2.267 1.00 31.49 C ATOM 17 C GLN A 2 29.600 35.197 2.832 1.00 31.18 C ATOM 18 O GLN A 2 30.691 34.825 3.235 1.00 30.82 O ATOM 19 CB GLN A 2 30.276 36.737 1.025 1.00 32.06 C ATOM 20 CG GLN A 2 29.992 35.663 -0.079 1.00 34.15 C ATOM 21 CD GLN A 2 30.506 36.077 -1.465 1.00 35.37 C ATOM 22 OE1 GLN A 2 31.546 35.597 -1.920 1.00 37.32 O ATOM 23 NE2 GLN A 2 29.739 36.891 -2.157 1.00 32.14 N ATOM 24 HA GLN A 2 28.399 36.811 1.970 1.00 0.00 H ATOM 25 HB2 GLN A 2 30.091 37.723 0.599 1.00 0.00 H ATOM 26 HB3 GLN A 2 31.323 36.659 1.317 1.00 0.00 H ATOM 27 HG2 GLN A 2 30.480 34.732 0.209 1.00 0.00 H ATOM 28 HG3 GLN A 2 28.915 35.504 -0.141 1.00 0.00 H ATOM 29 HE22 GLN A 2 28.870 37.273 -1.733 1.00 0.00 H ATOM 30 HE21 GLN A 2 30.002 37.153 -3.128 1.00 0.00 H ATOM 31 H GLN A 2 30.871 37.480 3.582 1.00 0.00 H ATOM 32 N ILE A 3 28.523 34.421 2.818 1.00 30.06 N ATOM 33 CA ILE A 3 28.553 33.093 3.381 1.00 28.59 C ATOM 34 C ILE A 3 28.316 32.064 2.274 1.00 26.75 C ATOM 35 O ILE A 3 27.321 32.114 1.555 1.00 20.52 O ATOM 36 CB ILE A 3 27.511 32.990 4.472 1.00 29.73 C ATOM 37 CG1 ILE A 3 27.856 33.971 5.626 1.00 30.82 C ATOM 38 CG2 ILE A 3 27.426 31.525 5.041 1.00 28.81 C ATOM 39 CD1 ILE A 3 26.820 33.996 6.745 1.00 30.83 C ATOM 40 HA ILE A 3 29.528 32.890 3.823 1.00 0.00 H ATOM 41 HB ILE A 3 26.545 33.251 4.040 1.00 0.00 H ATOM 42 HG12 ILE A 3 28.815 33.677 6.052 1.00 0.00 H ATOM 43 HG13 ILE A 3 27.937 34.975 5.210 1.00 0.00 H ATOM 44 HD11 ILE A 3 25.856 34.301 6.339 1.00 0.00 H ATOM 45 HD12 ILE A 3 26.734 33.001 7.181 1.00 0.00 H ATOM 46 HD13 ILE A 3 27.133 34.704 7.512 1.00 0.00 H ATOM 47 HG21 ILE A 3 27.158 30.839 4.237 1.00 0.00 H ATOM 48 HG22 ILE A 3 28.393 31.241 5.455 1.00 0.00 H ATOM 49 HG23 ILE A 3 26.668 31.484 5.823 1.00 0.00 H ATOM 50 H ILE A 3 27.642 34.776 2.394 1.00 0.00 H ATOM 51 N THR A 4 29.277 31.155 2.138 1.00 24.96 N ATOM 52 CA THR A 4 29.171 30.095 1.172 1.00 25.54 C ATOM 53 C THR A 4 28.336 28.976 1.712 1.00 22.70 C ATOM 54 O THR A 4 27.930 28.918 2.906 1.00 22.93 O ATOM 55 CB THR A 4 30.604 29.516 0.759 1.00 26.78 C ATOM 56 OG1 THR A 4 31.300 29.146 1.940 1.00 30.28 O ATOM 57 CG2 THR A 4 31.430 30.582 0.047 1.00 28.11 C ATOM 58 HA THR A 4 28.700 30.521 0.286 1.00 0.00 H ATOM 59 HB THR A 4 30.459 28.664 0.095 1.00 0.00 H ATOM 60 HG1 THR A 4 30.783 28.454 2.423 1.00 0.00 H ATOM 61 HG23 THR A 4 30.919 30.886 -0.866 1.00 0.00 H ATOM 62 HG21 THR A 4 31.550 31.445 0.702 1.00 0.00 H ATOM 63 HG22 THR A 4 32.410 30.174 -0.202 1.00 0.00 H ATOM 64 H THR A 4 30.122 31.212 2.742 1.00 0.00 H ATOM 65 N LEU A 5 28.003 28.086 0.801 1.00 22.69 N ATOM 66 CA LEU A 5 27.064 27.050 1.094 1.00 21.95 C ATOM 67 C LEU A 5 27.650 25.677 0.990 1.00 24.50 C ATOM 68 O LEU A 5 26.874 24.697 0.962 1.00 22.08 O ATOM 69 CB LEU A 5 25.827 27.227 0.200 1.00 22.54 C ATOM 70 CG LEU A 5 25.013 28.540 0.403 1.00 23.53 C ATOM 71 CD1 LEU A 5 23.877 28.713 -0.651 1.00 23.35 C ATOM 72 CD2 LEU A 5 24.421 28.654 1.776 1.00 23.97 C ATOM 73 HA LEU A 5 26.767 27.144 2.138 1.00 0.00 H ATOM 74 HB2 LEU A 5 26.160 27.199 -0.838 1.00 0.00 H ATOM 75 HB3 LEU A 5 25.157 26.388 0.389 1.00 0.00 H ATOM 76 HG LEU A 5 25.744 29.338 0.270 1.00 0.00 H ATOM 77 HD21 LEU A 5 23.747 27.815 1.951 1.00 0.00 H ATOM 78 HD22 LEU A 5 25.220 28.640 2.517 1.00 0.00 H ATOM 79 HD23 LEU A 5 23.867 29.589 1.855 1.00 0.00 H ATOM 80 HD11 LEU A 5 24.311 28.740 -1.650 1.00 0.00 H ATOM 81 HD12 LEU A 5 23.184 27.875 -0.577 1.00 0.00 H ATOM 82 HD13 LEU A 5 23.344 29.645 -0.460 1.00 0.00 H ATOM 83 H LEU A 5 28.430 28.138 -0.146 1.00 0.00 H ATOM 84 N TRP A 6 29.004 25.576 1.046 1.00 25.93 N ATOM 85 CA TRP A 6 29.671 24.275 1.122 1.00 27.79 C ATOM 86 C TRP A 6 29.302 23.552 2.370 1.00 26.78 C ATOM 87 O TRP A 6 29.218 22.314 2.393 1.00 30.54 O ATOM 88 CB TRP A 6 31.205 24.393 0.971 1.00 27.03 C ATOM 89 CG TRP A 6 31.605 25.138 -0.207 1.00 27.17 C ATOM 90 CD1 TRP A 6 32.141 26.368 -0.235 1.00 27.17 C ATOM 91 CD2 TRP A 6 31.556 24.681 -1.568 1.00 28.41 C ATOM 92 NE1 TRP A 6 32.380 26.750 -1.531 1.00 30.16 N ATOM 93 CE2 TRP A 6 32.076 25.699 -2.365 1.00 30.10 C ATOM 94 CE3 TRP A 6 31.108 23.514 -2.176 1.00 30.28 C ATOM 95 CZ2 TRP A 6 32.130 25.604 -3.778 1.00 32.15 C ATOM 96 CZ3 TRP A 6 31.203 23.385 -3.546 1.00 31.30 C ATOM 97 CH2 TRP A 6 31.694 24.418 -4.336 1.00 31.13 C ATOM 98 HA TRP A 6 29.316 23.686 0.276 1.00 0.00 H ATOM 99 HB2 TRP A 6 31.603 24.897 1.852 1.00 0.00 H ATOM 100 HB3 TRP A 6 31.626 23.390 0.907 1.00 0.00 H ATOM 101 HE1 TRP A 6 32.733 27.681 -1.833 1.00 0.00 H ATOM 102 HD1 TRP A 6 32.355 26.975 0.644 1.00 0.00 H ATOM 103 HZ2 TRP A 6 32.497 26.425 -4.393 1.00 0.00 H ATOM 104 HH2 TRP A 6 31.736 24.290 -5.418 1.00 0.00 H ATOM 105 HZ3 TRP A 6 30.887 22.455 -4.018 1.00 0.00 H ATOM 106 HE3 TRP A 6 30.686 22.708 -1.576 1.00 0.00 H ATOM 107 H TRP A 6 29.579 26.442 1.035 1.00 0.00 H ATOM 108 N GLN A 7 29.037 24.308 3.445 1.00 28.65 N ATOM 109 CA GLN A 7 28.576 23.739 4.711 1.00 26.65 C ATOM 110 C GLN A 7 27.257 24.435 5.076 1.00 25.83 C ATOM 111 O GLN A 7 26.971 25.455 4.507 1.00 24.13 O ATOM 112 CB GLN A 7 29.634 23.954 5.819 1.00 31.69 C ATOM 113 CG GLN A 7 30.970 23.211 5.503 1.00 34.42 C ATOM 114 CD GLN A 7 31.991 24.024 4.630 1.00 38.88 C ATOM 115 OE1 GLN A 7 32.121 25.294 4.750 1.00 43.04 O ATOM 116 NE2 GLN A 7 32.766 23.285 3.786 1.00 42.09 N ATOM 117 HA GLN A 7 28.423 22.664 4.614 1.00 0.00 H ATOM 118 HB2 GLN A 7 29.837 25.021 5.910 1.00 0.00 H ATOM 119 HB3 GLN A 7 29.237 23.579 6.763 1.00 0.00 H ATOM 120 HG2 GLN A 7 31.453 22.966 6.449 1.00 0.00 H ATOM 121 HG3 GLN A 7 30.728 22.291 4.971 1.00 0.00 H ATOM 122 HE22 GLN A 7 32.627 22.256 3.719 1.00 0.00 H ATOM 123 HE21 GLN A 7 33.496 23.750 3.209 1.00 0.00 H ATOM 124 H GLN A 7 29.164 25.338 3.376 1.00 0.00 H ATOM 125 N ARG A 8 26.495 23.891 6.023 1.00 25.98 N ATOM 126 CA ARG A 8 25.272 24.548 6.471 1.00 25.66 C ATOM 127 C ARG A 8 25.605 25.968 6.945 1.00 25.85 C ATOM 128 O ARG A 8 26.637 26.186 7.703 1.00 25.91 O ATOM 129 CB ARG A 8 24.645 23.801 7.614 1.00 26.68 C ATOM 130 CG ARG A 8 24.018 22.500 7.214 1.00 28.63 C ATOM 131 CD ARG A 8 23.437 21.776 8.337 1.00 30.09 C ATOM 132 NE ARG A 8 22.591 20.660 7.921 1.00 34.10 N ATOM 133 CZ ARG A 8 21.661 20.104 8.714 1.00 36.97 C ATOM 134 NH1 ARG A 8 20.901 19.128 8.254 1.00 39.23 N ATOM 135 NH2 ARG A 8 21.484 20.505 9.975 1.00 37.13 N ATOM 136 HA ARG A 8 24.573 24.572 5.635 1.00 0.00 H ATOM 137 HB2 ARG A 8 25.417 23.597 8.356 1.00 0.00 H ATOM 138 HB3 ARG A 8 23.875 24.433 8.056 1.00 0.00 H ATOM 139 HG2 ARG A 8 23.231 22.703 6.487 1.00 0.00 H ATOM 140 HG3 ARG A 8 24.782 21.873 6.755 1.00 0.00 H ATOM 141 HD2 ARG A 8 22.834 22.470 8.923 1.00 0.00 H ATOM 142 HD3 ARG A 8 24.246 21.387 8.956 1.00 0.00 H ATOM 143 HE ARG A 8 22.715 20.277 6.962 1.00 0.00 H ATOM 144 HH12 ARG A 8 20.180 18.697 8.868 1.00 0.00 H ATOM 145 HH11 ARG A 8 21.023 18.790 7.278 1.00 0.00 H ATOM 146 HH22 ARG A 8 20.756 20.056 10.566 1.00 0.00 H ATOM 147 HH21 ARG A 8 22.074 21.267 10.366 1.00 0.00 H ATOM 148 H ARG A 8 26.776 22.985 6.449 1.00 0.00 H ATOM 149 N PRO A 9 24.783 26.934 6.563 1.00 24.39 N ATOM 150 CA PRO A 9 25.012 28.318 7.027 1.00 24.39 C ATOM 151 C PRO A 9 24.502 28.595 8.417 1.00 25.04 C ATOM 152 O PRO A 9 23.479 29.233 8.625 1.00 22.99 O ATOM 153 CB PRO A 9 24.301 29.149 5.960 1.00 23.20 C ATOM 154 CG PRO A 9 23.108 28.296 5.584 1.00 22.54 C ATOM 155 CD PRO A 9 23.683 26.895 5.569 1.00 23.88 C ATOM 156 HA PRO A 9 26.073 28.549 7.126 1.00 0.00 H ATOM 157 HD3 PRO A 9 22.927 26.165 5.859 1.00 0.00 H ATOM 158 HD2 PRO A 9 24.066 26.646 4.579 1.00 0.00 H ATOM 159 HG3 PRO A 9 22.722 28.572 4.603 1.00 0.00 H ATOM 160 HG2 PRO A 9 22.313 28.386 6.324 1.00 0.00 H ATOM 161 HB2 PRO A 9 23.982 30.110 6.363 1.00 0.00 H ATOM 162 HB3 PRO A 9 24.949 29.315 5.099 1.00 0.00 H ATOM 163 N LEU A 10 25.285 28.129 9.389 1.00 26.06 N ATOM 164 CA LEU A 10 25.017 28.290 10.809 1.00 26.95 C ATOM 165 C LEU A 10 25.692 29.564 11.328 1.00 27.42 C ATOM 166 O LEU A 10 26.842 29.878 10.947 1.00 30.45 O ATOM 167 CB LEU A 10 25.580 27.068 11.577 1.00 30.79 C ATOM 168 CG LEU A 10 24.802 25.785 11.325 1.00 32.14 C ATOM 169 CD1 LEU A 10 25.504 24.578 11.906 1.00 34.35 C ATOM 170 CD2 LEU A 10 23.450 25.929 11.934 1.00 32.36 C ATOM 171 HA LEU A 10 23.941 28.364 10.964 1.00 0.00 H ATOM 172 HB2 LEU A 10 26.614 26.912 11.268 1.00 0.00 H ATOM 173 HB3 LEU A 10 25.550 27.287 12.644 1.00 0.00 H ATOM 174 HG LEU A 10 24.726 25.626 10.249 1.00 0.00 H ATOM 175 HD21 LEU A 10 23.552 26.100 13.006 1.00 0.00 H ATOM 176 HD22 LEU A 10 22.935 26.774 11.477 1.00 0.00 H ATOM 177 HD23 LEU A 10 22.877 25.018 11.763 1.00 0.00 H ATOM 178 HD11 LEU A 10 26.488 24.477 11.449 1.00 0.00 H ATOM 179 HD12 LEU A 10 25.613 24.706 12.983 1.00 0.00 H ATOM 180 HD13 LEU A 10 24.914 23.684 11.703 1.00 0.00 H ATOM 181 H LEU A 10 26.146 27.615 9.113 1.00 0.00 H ATOM 182 N VAL A 11 24.968 30.298 12.142 1.00 27.69 N ATOM 183 CA VAL A 11 25.414 31.548 12.737 1.00 27.05 C ATOM 184 C VAL A 11 24.968 31.639 14.187 1.00 27.16 C ATOM 185 O VAL A 11 24.075 30.909 14.659 1.00 28.05 O ATOM 186 CB VAL A 11 24.856 32.807 11.987 1.00 27.93 C ATOM 187 CG1 VAL A 11 25.323 32.810 10.521 1.00 30.47 C ATOM 188 CG2 VAL A 11 23.311 32.908 12.102 1.00 28.99 C ATOM 189 HA VAL A 11 26.501 31.544 12.661 1.00 0.00 H ATOM 190 HB VAL A 11 25.261 33.696 12.471 1.00 0.00 H ATOM 191 HG11 VAL A 11 26.412 32.831 10.488 1.00 0.00 H ATOM 192 HG12 VAL A 11 24.960 31.910 10.024 1.00 0.00 H ATOM 193 HG13 VAL A 11 24.926 33.691 10.016 1.00 0.00 H ATOM 194 HG21 VAL A 11 22.857 32.019 11.665 1.00 0.00 H ATOM 195 HG22 VAL A 11 23.030 32.982 13.153 1.00 0.00 H ATOM 196 HG23 VAL A 11 22.965 33.794 11.569 1.00 0.00 H ATOM 197 H VAL A 11 24.012 29.963 12.377 1.00 0.00 H ATOM 198 N THR A 12 25.565 32.579 14.898 1.00 26.71 N ATOM 199 CA THR A 12 25.226 32.815 16.303 1.00 26.38 C ATOM 200 C THR A 12 24.137 33.836 16.378 1.00 25.94 C ATOM 201 O THR A 12 24.214 34.857 15.768 1.00 28.13 O ATOM 202 CB THR A 12 26.482 33.273 17.070 1.00 29.14 C ATOM 203 OG1 THR A 12 27.368 32.154 17.209 1.00 31.60 O ATOM 204 CG2 THR A 12 26.196 33.650 18.516 1.00 30.29 C ATOM 205 HA THR A 12 24.869 31.895 16.765 1.00 0.00 H ATOM 206 HB THR A 12 26.875 34.120 16.509 1.00 0.00 H ATOM 207 HG1 THR A 12 26.911 31.433 17.710 1.00 0.00 H ATOM 208 HG23 THR A 12 25.520 34.505 18.540 1.00 0.00 H ATOM 209 HG21 THR A 12 25.733 32.805 19.026 1.00 0.00 H ATOM 210 HG22 THR A 12 27.130 33.909 19.014 1.00 0.00 H ATOM 211 H THR A 12 26.295 33.167 14.448 1.00 0.00 H ATOM 212 N ILE A 13 23.073 33.557 17.097 1.00 25.70 N ATOM 213 CA ILE A 13 22.058 34.595 17.307 1.00 27.18 C ATOM 214 C ILE A 13 22.075 34.910 18.793 1.00 28.03 C ATOM 215 O ILE A 13 22.655 34.160 19.574 1.00 31.32 O ATOM 216 CB ILE A 13 20.681 34.136 16.848 1.00 27.08 C ATOM 217 CG1 ILE A 13 20.227 32.961 17.738 1.00 27.58 C ATOM 218 CG2 ILE A 13 20.755 33.770 15.329 1.00 28.43 C ATOM 219 CD1 ILE A 13 18.902 32.492 17.526 1.00 27.75 C ATOM 220 HA ILE A 13 22.281 35.483 16.716 1.00 0.00 H ATOM 221 HB ILE A 13 19.935 34.924 16.953 1.00 0.00 H ATOM 222 HG12 ILE A 13 20.908 32.128 17.563 1.00 0.00 H ATOM 223 HG13 ILE A 13 20.305 33.280 18.777 1.00 0.00 H ATOM 224 HD11 ILE A 13 18.197 33.302 17.712 1.00 0.00 H ATOM 225 HD12 ILE A 13 18.800 32.149 16.497 1.00 0.00 H ATOM 226 HD13 ILE A 13 18.697 31.667 18.208 1.00 0.00 H ATOM 227 HG21 ILE A 13 21.062 34.647 14.760 1.00 0.00 H ATOM 228 HG22 ILE A 13 21.480 32.969 15.184 1.00 0.00 H ATOM 229 HG23 ILE A 13 19.774 33.439 14.988 1.00 0.00 H ATOM 230 H ILE A 13 22.952 32.611 17.512 1.00 0.00 H ATOM 231 N LYS A 14 21.519 36.055 19.149 1.00 28.27 N ATOM 232 CA LYS A 14 21.319 36.438 20.529 1.00 28.73 C ATOM 233 C LYS A 14 19.870 36.735 20.737 1.00 26.95 C ATOM 234 O LYS A 14 19.265 37.540 19.993 1.00 28.26 O ATOM 235 CB LYS A 14 22.163 37.657 20.871 1.00 31.28 C ATOM 236 CG LYS A 14 22.108 38.009 22.362 1.00 35.54 C ATOM 237 CD LYS A 14 23.062 39.219 22.658 1.00 38.48 C ATOM 238 CE LYS A 14 23.054 39.670 24.109 1.00 40.37 C ATOM 239 NZ LYS A 14 23.181 38.518 25.069 1.00 43.82 N ATOM 240 HA LYS A 14 21.626 35.623 21.184 1.00 0.00 H ATOM 241 HB2 LYS A 14 23.198 37.454 20.597 1.00 0.00 H ATOM 242 HB3 LYS A 14 21.797 38.508 20.297 1.00 0.00 H ATOM 243 HG2 LYS A 14 21.087 38.278 22.633 1.00 0.00 H ATOM 244 HG3 LYS A 14 22.424 37.147 22.950 1.00 0.00 H ATOM 245 HD2 LYS A 14 24.079 38.927 22.395 1.00 0.00 H ATOM 246 HD3 LYS A 14 22.754 40.059 22.036 1.00 0.00 H ATOM 247 HE2 LYS A 14 22.118 40.191 24.309 1.00 0.00 H ATOM 248 HE3 LYS A 14 23.889 40.352 24.268 1.00 0.00 H ATOM 249 HZ1 LYS A 14 22.384 37.864 24.931 1.00 0.00 H ATOM 250 HZ2 LYS A 14 24.076 38.018 24.892 1.00 0.00 H ATOM 251 HZ3 LYS A 14 23.170 38.878 26.044 1.00 0.00 H ATOM 252 H LYS A 14 21.211 36.710 18.403 1.00 0.00 H ATOM 253 N ILE A 15 19.278 36.065 21.723 1.00 26.12 N ATOM 254 CA ILE A 15 17.830 36.201 21.991 1.00 27.90 C ATOM 255 C ILE A 15 17.473 35.853 23.412 1.00 29.90 C ATOM 256 O ILE A 15 17.908 34.836 23.937 1.00 30.24 O ATOM 257 CB ILE A 15 16.973 35.341 20.995 1.00 26.95 C ATOM 258 CG1 ILE A 15 15.481 35.584 21.215 1.00 27.04 C ATOM 259 CG2 ILE A 15 17.348 33.911 21.061 1.00 28.41 C ATOM 260 CD1 ILE A 15 14.580 34.718 20.376 1.00 27.00 C ATOM 261 HA ILE A 15 17.593 37.254 21.836 1.00 0.00 H ATOM 262 HB ILE A 15 17.193 35.662 19.977 1.00 0.00 H ATOM 263 HG12 ILE A 15 15.256 35.395 22.265 1.00 0.00 H ATOM 264 HG13 ILE A 15 15.267 36.627 20.981 1.00 0.00 H ATOM 265 HD11 ILE A 15 14.781 34.902 19.321 1.00 0.00 H ATOM 266 HD12 ILE A 15 14.769 33.669 20.605 1.00 0.00 H ATOM 267 HD13 ILE A 15 13.540 34.957 20.597 1.00 0.00 H ATOM 268 HG21 ILE A 15 18.400 33.800 20.799 1.00 0.00 H ATOM 269 HG22 ILE A 15 17.183 33.540 22.072 1.00 0.00 H ATOM 270 HG23 ILE A 15 16.736 33.344 20.360 1.00 0.00 H ATOM 271 H ILE A 15 19.847 35.431 22.319 1.00 0.00 H ATOM 272 N GLY A 16 16.692 36.733 24.039 1.00 32.72 N ATOM 273 CA GLY A 16 16.282 36.564 25.424 1.00 35.55 C ATOM 274 C GLY A 16 17.484 36.424 26.332 1.00 37.15 C ATOM 275 O GLY A 16 17.440 35.692 27.319 1.00 39.97 O ATOM 276 HA3 GLY A 16 15.666 35.669 25.507 1.00 0.00 H ATOM 277 HA2 GLY A 16 15.701 37.433 25.733 1.00 0.00 H ATOM 278 H GLY A 16 16.364 37.571 23.518 1.00 0.00 H ATOM 279 N GLY A 17 18.561 37.113 25.991 1.00 37.56 N ATOM 280 CA GLY A 17 19.749 37.107 26.832 1.00 38.69 C ATOM 281 C GLY A 17 20.586 35.852 26.632 1.00 39.20 C ATOM 282 O GLY A 17 21.709 35.773 27.164 1.00 40.86 O ATOM 283 HA3 GLY A 17 19.441 37.162 27.876 1.00 0.00 H ATOM 284 HA2 GLY A 17 20.357 37.978 26.588 1.00 0.00 H ATOM 285 H GLY A 17 18.559 37.666 25.110 1.00 0.00 H ATOM 286 N GLN A 18 20.080 34.894 25.835 1.00 37.95 N ATOM 287 CA GLN A 18 20.794 33.638 25.551 1.00 37.00 C ATOM 288 C GLN A 18 21.549 33.730 24.200 1.00 35.43 C ATOM 289 O GLN A 18 21.161 34.462 23.318 1.00 33.13 O ATOM 290 CB GLN A 18 19.794 32.440 25.547 1.00 39.00 C ATOM 291 CG GLN A 18 18.886 32.264 26.830 1.00 40.38 C ATOM 292 CD GLN A 18 17.783 31.141 26.715 1.00 43.08 C ATOM 293 OE1 GLN A 18 18.062 29.989 26.296 1.00 43.30 O ATOM 294 NE2 GLN A 18 16.533 31.482 27.119 1.00 44.55 N ATOM 295 HA GLN A 18 21.531 33.471 26.337 1.00 0.00 H ATOM 296 HB2 GLN A 18 19.133 32.565 24.689 1.00 0.00 H ATOM 297 HB3 GLN A 18 20.375 31.526 25.426 1.00 0.00 H ATOM 298 HG2 GLN A 18 19.533 32.018 27.672 1.00 0.00 H ATOM 299 HG3 GLN A 18 18.385 33.213 27.023 1.00 0.00 H ATOM 300 HE22 GLN A 18 16.341 32.446 27.460 1.00 0.00 H ATOM 301 HE21 GLN A 18 15.767 30.779 27.088 1.00 0.00 H ATOM 302 H GLN A 18 19.147 35.047 25.402 1.00 0.00 H ATOM 303 N LEU A 19 22.622 32.972 24.028 1.00 36.03 N ATOM 304 CA LEU A 19 23.254 32.805 22.713 1.00 35.85 C ATOM 305 C LEU A 19 22.995 31.422 22.177 1.00 34.94 C ATOM 306 O LEU A 19 23.028 30.453 22.931 1.00 35.48 O ATOM 307 CB LEU A 19 24.758 32.989 22.792 1.00 37.09 C ATOM 308 CG LEU A 19 25.278 34.354 23.231 1.00 37.15 C ATOM 309 CD1 LEU A 19 26.730 34.142 23.657 1.00 38.97 C ATOM 310 CD2 LEU A 19 25.237 35.340 22.098 1.00 36.02 C ATOM 311 HA LEU A 19 22.823 33.562 22.058 1.00 0.00 H ATOM 312 HB2 LEU A 19 25.141 32.251 23.497 1.00 0.00 H ATOM 313 HB3 LEU A 19 25.164 32.788 21.801 1.00 0.00 H ATOM 314 HG LEU A 19 24.663 34.753 24.038 1.00 0.00 H ATOM 315 HD21 LEU A 19 25.858 34.977 21.279 1.00 0.00 H ATOM 316 HD22 LEU A 19 24.209 35.453 21.753 1.00 0.00 H ATOM 317 HD23 LEU A 19 25.614 36.303 22.442 1.00 0.00 H ATOM 318 HD11 LEU A 19 26.766 33.426 24.478 1.00 0.00 H ATOM 319 HD12 LEU A 19 27.302 33.757 22.813 1.00 0.00 H ATOM 320 HD13 LEU A 19 27.154 35.092 23.983 1.00 0.00 H ATOM 321 H LEU A 19 23.029 32.480 24.849 1.00 0.00 H ATOM 322 N LYS A 20 22.731 31.322 20.864 1.00 34.32 N ATOM 323 CA LYS A 20 22.330 30.052 20.260 1.00 32.42 C ATOM 324 C LYS A 20 22.835 29.974 18.850 1.00 30.90 C ATOM 325 O LYS A 20 23.029 30.994 18.205 1.00 29.10 O ATOM 326 CB LYS A 20 20.808 29.859 20.248 1.00 32.13 C ATOM 327 CG LYS A 20 20.150 29.858 21.631 1.00 34.55 C ATOM 328 CD LYS A 20 18.728 29.379 21.651 1.00 34.52 C ATOM 329 CE LYS A 20 18.216 29.163 23.127 1.00 37.65 C ATOM 330 NZ LYS A 20 19.304 28.839 24.214 1.00 38.00 N ATOM 331 HA LYS A 20 22.766 29.262 20.872 1.00 0.00 H ATOM 332 HB2 LYS A 20 20.368 30.667 19.663 1.00 0.00 H ATOM 333 HB3 LYS A 20 20.591 28.905 19.768 1.00 0.00 H ATOM 334 HG2 LYS A 20 20.735 29.211 22.285 1.00 0.00 H ATOM 335 HG3 LYS A 20 20.170 30.877 22.017 1.00 0.00 H ATOM 336 HD2 LYS A 20 18.097 30.120 21.161 1.00 0.00 H ATOM 337 HD3 LYS A 20 18.664 28.434 21.111 1.00 0.00 H ATOM 338 HE2 LYS A 20 17.507 28.335 23.113 1.00 0.00 H ATOM 339 HE3 LYS A 20 17.703 30.074 23.435 1.00 0.00 H ATOM 340 HZ1 LYS A 20 19.800 27.962 23.956 1.00 0.00 H ATOM 341 HZ2 LYS A 20 19.986 29.622 24.264 1.00 0.00 H ATOM 342 HZ3 LYS A 20 18.843 28.719 25.139 1.00 0.00 H ATOM 343 H LYS A 20 22.814 32.167 20.263 1.00 0.00 H ATOM 344 N GLU A 21 23.030 28.748 18.360 1.00 30.00 N ATOM 345 CA GLU A 21 23.378 28.539 16.953 1.00 28.83 C ATOM 346 C GLU A 21 22.089 28.275 16.133 1.00 25.55 C ATOM 347 O GLU A 21 21.209 27.534 16.552 1.00 23.99 O ATOM 348 CB GLU A 21 24.275 27.331 16.816 1.00 32.19 C ATOM 349 CG GLU A 21 25.602 27.427 17.519 1.00 36.31 C ATOM 350 CD GLU A 21 26.369 28.680 17.139 1.00 39.68 C ATOM 351 OE1 GLU A 21 26.876 28.742 15.988 1.00 43.06 O ATOM 352 OE2 GLU A 21 26.445 29.612 17.999 1.00 42.32 O ATOM 353 HA GLU A 21 23.889 29.429 16.586 1.00 0.00 H ATOM 354 HB2 GLU A 21 23.743 26.469 17.219 1.00 0.00 H ATOM 355 HB3 GLU A 21 24.467 27.174 15.755 1.00 0.00 H ATOM 356 HG2 GLU A 21 25.429 27.435 18.595 1.00 0.00 H ATOM 357 HG3 GLU A 21 26.202 26.556 17.256 1.00 0.00 H ATOM 358 H GLU A 21 22.933 27.926 18.989 1.00 0.00 H ATOM 359 N ALA A 22 21.967 28.938 15.006 1.00 24.82 N ATOM 360 CA ALA A 22 20.802 28.798 14.148 1.00 22.74 C ATOM 361 C ALA A 22 21.202 28.817 12.680 1.00 21.47 C ATOM 362 O ALA A 22 22.240 29.380 12.279 1.00 25.15 O ATOM 363 CB ALA A 22 19.829 29.899 14.427 1.00 24.75 C ATOM 364 HA ALA A 22 20.332 27.838 14.362 1.00 0.00 H ATOM 365 HB1 ALA A 22 19.516 29.850 15.470 1.00 0.00 H ATOM 366 HB2 ALA A 22 20.305 30.860 14.234 1.00 0.00 H ATOM 367 HB3 ALA A 22 18.959 29.786 13.780 1.00 0.00 H ATOM 368 H ALA A 22 22.729 29.585 14.718 1.00 0.00 H ATOM 369 N LEU A 23 20.334 28.233 11.856 1.00 21.00 N ATOM 370 CA LEU A 23 20.580 27.998 10.455 1.00 21.35 C ATOM 371 C LEU A 23 19.946 29.130 9.662 1.00 21.14 C ATOM 372 O LEU A 23 18.775 29.404 9.887 1.00 23.94 O ATOM 373 CB LEU A 23 19.918 26.640 10.087 1.00 23.27 C ATOM 374 CG LEU A 23 20.015 26.173 8.657 1.00 25.94 C ATOM 375 CD1 LEU A 23 21.473 25.987 8.206 1.00 25.69 C ATOM 376 CD2 LEU A 23 19.173 24.830 8.470 1.00 26.77 C ATOM 377 HA LEU A 23 21.646 27.962 10.230 1.00 0.00 H ATOM 378 HB2 LEU A 23 20.379 25.874 10.711 1.00 0.00 H ATOM 379 HB3 LEU A 23 18.859 26.718 10.332 1.00 0.00 H ATOM 380 HG LEU A 23 19.592 26.948 8.018 1.00 0.00 H ATOM 381 HD21 LEU A 23 19.570 24.059 9.130 1.00 0.00 H ATOM 382 HD22 LEU A 23 18.129 25.020 8.718 1.00 0.00 H ATOM 383 HD23 LEU A 23 19.247 24.497 7.435 1.00 0.00 H ATOM 384 HD11 LEU A 23 22.002 26.936 8.290 1.00 0.00 H ATOM 385 HD12 LEU A 23 21.956 25.243 8.840 1.00 0.00 H ATOM 386 HD13 LEU A 23 21.491 25.650 7.170 1.00 0.00 H ATOM 387 H LEU A 23 19.421 27.927 12.248 1.00 0.00 H ATOM 388 N LEU A 24 20.696 29.846 8.807 1.00 21.23 N ATOM 389 CA LEU A 24 20.100 30.872 7.919 1.00 21.47 C ATOM 390 C LEU A 24 19.357 30.122 6.808 1.00 20.85 C ATOM 391 O LEU A 24 19.973 29.483 5.954 1.00 21.86 O ATOM 392 CB LEU A 24 21.175 31.781 7.249 1.00 22.21 C ATOM 393 CG LEU A 24 22.046 32.559 8.248 1.00 24.01 C ATOM 394 CD1 LEU A 24 23.104 33.365 7.573 1.00 25.52 C ATOM 395 CD2 LEU A 24 21.162 33.462 9.152 1.00 23.25 C ATOM 396 HA LEU A 24 19.450 31.513 8.514 1.00 0.00 H ATOM 397 HB2 LEU A 24 21.827 31.152 6.643 1.00 0.00 H ATOM 398 HB3 LEU A 24 20.665 32.499 6.607 1.00 0.00 H ATOM 399 HG LEU A 24 22.556 31.823 8.870 1.00 0.00 H ATOM 400 HD21 LEU A 24 20.615 34.171 8.531 1.00 0.00 H ATOM 401 HD22 LEU A 24 20.457 32.841 9.705 1.00 0.00 H ATOM 402 HD23 LEU A 24 21.797 34.005 9.853 1.00 0.00 H ATOM 403 HD11 LEU A 24 23.755 32.703 7.003 1.00 0.00 H ATOM 404 HD12 LEU A 24 22.637 34.085 6.901 1.00 0.00 H ATOM 405 HD13 LEU A 24 23.690 33.894 8.324 1.00 0.00 H ATOM 406 H LEU A 24 21.721 29.676 8.767 1.00 0.00 H ATOM 407 N ASP A 25 18.036 30.248 6.784 1.00 21.30 N ATOM 408 CA ASP A 25 17.238 29.346 5.979 1.00 20.60 C ATOM 409 C ASP A 25 16.223 30.054 5.065 1.00 21.55 C ATOM 410 O ASP A 25 15.100 30.378 5.443 1.00 20.06 O ATOM 411 CB ASP A 25 16.557 28.345 6.877 1.00 20.64 C ATOM 412 CG ASP A 25 15.795 27.259 6.061 1.00 20.49 C ATOM 413 OD1 ASP A 25 15.318 26.354 6.710 1.00 24.57 O ATOM 414 OD2 ASP A 25 15.708 27.246 4.814 1.00 24.87 O ATOM 415 HA ASP A 25 17.921 28.836 5.300 1.00 0.00 H ATOM 416 HB2 ASP A 25 17.310 27.858 7.497 1.00 0.00 H ATOM 417 HB3 ASP A 25 15.847 28.870 7.516 1.00 0.00 H ATOM 418 H ASP A 25 17.574 30.994 7.343 1.00 0.00 H ATOM 419 N THR A 26 16.647 30.238 3.809 1.00 20.06 N ATOM 420 CA THR A 26 15.833 30.868 2.833 1.00 19.81 C ATOM 421 C THR A 26 14.575 30.081 2.446 1.00 19.32 C ATOM 422 O THR A 26 13.660 30.671 1.841 1.00 20.52 O ATOM 423 CB THR A 26 16.631 31.156 1.558 1.00 18.36 C ATOM 424 OG1 THR A 26 17.150 29.929 0.974 1.00 20.11 O ATOM 425 CG2 THR A 26 17.778 32.102 1.844 1.00 21.20 C ATOM 426 HA THR A 26 15.503 31.791 3.309 1.00 0.00 H ATOM 427 HB THR A 26 15.950 31.623 0.846 1.00 0.00 H ATOM 428 HG1 THR A 26 16.396 29.329 0.747 1.00 0.00 H ATOM 429 HG23 THR A 26 17.389 33.021 2.282 1.00 0.00 H ATOM 430 HG21 THR A 26 18.471 31.631 2.542 1.00 0.00 H ATOM 431 HG22 THR A 26 18.298 32.332 0.914 1.00 0.00 H ATOM 432 H THR A 26 17.597 29.911 3.542 1.00 0.00 H ATOM 433 N GLY A 27 14.554 28.801 2.741 1.00 19.28 N ATOM 434 CA GLY A 27 13.378 27.971 2.490 1.00 20.08 C ATOM 435 C GLY A 27 12.345 27.986 3.592 1.00 20.17 C ATOM 436 O GLY A 27 11.325 27.263 3.520 1.00 18.88 O ATOM 437 HA3 GLY A 27 13.712 26.943 2.352 1.00 0.00 H ATOM 438 HA2 GLY A 27 12.903 28.324 1.575 1.00 0.00 H ATOM 439 H GLY A 27 15.398 28.366 3.165 1.00 0.00 H ATOM 440 N ALA A 28 12.654 28.715 4.664 1.00 20.58 N ATOM 441 CA ALA A 28 11.759 28.876 5.814 1.00 22.78 C ATOM 442 C ALA A 28 11.063 30.216 5.819 1.00 22.28 C ATOM 443 O ALA A 28 11.715 31.284 5.781 1.00 19.25 O ATOM 444 CB ALA A 28 12.541 28.686 7.109 1.00 22.45 C ATOM 445 HA ALA A 28 10.985 28.113 5.734 1.00 0.00 H ATOM 446 HB1 ALA A 28 12.975 27.686 7.127 1.00 0.00 H ATOM 447 HB2 ALA A 28 13.336 29.429 7.164 1.00 0.00 H ATOM 448 HB3 ALA A 28 11.869 28.807 7.959 1.00 0.00 H ATOM 449 H ALA A 28 13.577 29.194 4.686 1.00 0.00 H ATOM 450 N ASP A 29 9.725 30.185 5.785 1.00 19.67 N ATOM 451 CA ASP A 29 8.975 31.435 5.888 1.00 20.72 C ATOM 452 C ASP A 29 9.218 32.129 7.234 1.00 22.31 C ATOM 453 O ASP A 29 9.254 33.370 7.328 1.00 18.87 O ATOM 454 CB ASP A 29 7.462 31.157 5.786 1.00 21.49 C ATOM 455 CG ASP A 29 7.035 30.697 4.406 1.00 20.36 C ATOM 456 OD1 ASP A 29 5.938 30.093 4.338 1.00 21.10 O ATOM 457 OD2 ASP A 29 7.757 30.802 3.392 1.00 18.88 O ATOM 458 HA ASP A 29 9.315 32.075 5.074 1.00 0.00 H ATOM 459 HB2 ASP A 29 7.202 30.382 6.507 1.00 0.00 H ATOM 460 HB3 ASP A 29 6.923 32.073 6.029 1.00 0.00 H ATOM 461 H ASP A 29 9.224 29.279 5.686 1.00 0.00 H ATOM 462 N ASP A 30 9.340 31.311 8.292 1.00 20.92 N ATOM 463 CA ASP A 30 9.356 31.768 9.669 1.00 20.94 C ATOM 464 C ASP A 30 10.638 31.354 10.385 1.00 21.62 C ATOM 465 O ASP A 30 11.375 30.505 9.938 1.00 22.97 O ATOM 466 CB ASP A 30 8.200 31.118 10.406 1.00 22.04 C ATOM 467 CG ASP A 30 6.886 31.354 9.714 1.00 21.65 C ATOM 468 OD1 ASP A 30 6.558 32.479 9.361 1.00 24.89 O ATOM 469 OD2 ASP A 30 6.112 30.438 9.485 1.00 25.79 O ATOM 470 HA ASP A 30 9.284 32.856 9.663 1.00 0.00 H ATOM 471 HB2 ASP A 30 8.379 30.044 10.465 1.00 0.00 H ATOM 472 HB3 ASP A 30 8.147 31.532 11.413 1.00 0.00 H ATOM 473 H ASP A 30 9.428 30.290 8.114 1.00 0.00 H ATOM 474 N THR A 31 10.819 31.954 11.527 1.00 21.82 N ATOM 475 CA THR A 31 11.926 31.662 12.440 1.00 21.46 C ATOM 476 C THR A 31 11.415 30.754 13.516 1.00 21.85 C ATOM 477 O THR A 31 10.413 31.036 14.158 1.00 21.49 O ATOM 478 CB THR A 31 12.397 32.956 13.005 1.00 19.81 C ATOM 479 OG1 THR A 31 13.031 33.702 11.965 1.00 21.13 O ATOM 480 CG2 THR A 31 13.486 32.779 14.021 1.00 19.75 C ATOM 481 HA THR A 31 12.757 31.170 11.935 1.00 0.00 H ATOM 482 HB THR A 31 11.522 33.433 13.446 1.00 0.00 H ATOM 483 HG1 THR A 31 12.382 33.868 11.236 1.00 0.00 H ATOM 484 HG23 THR A 31 13.101 32.213 14.869 1.00 0.00 H ATOM 485 HG21 THR A 31 14.318 32.239 13.570 1.00 0.00 H ATOM 486 HG22 THR A 31 13.828 33.757 14.360 1.00 0.00 H ATOM 487 H THR A 31 10.135 32.686 11.808 1.00 0.00 H ATOM 488 N VAL A 32 12.087 29.635 13.711 1.00 20.71 N ATOM 489 CA VAL A 32 11.645 28.652 14.662 1.00 21.58 C ATOM 490 C VAL A 32 12.794 28.199 15.510 1.00 19.54 C ATOM 491 O VAL A 32 13.802 27.752 14.957 1.00 21.06 O ATOM 492 CB VAL A 32 11.106 27.373 13.986 1.00 24.94 C ATOM 493 CG1 VAL A 32 10.260 26.614 15.047 1.00 25.67 C ATOM 494 CG2 VAL A 32 10.278 27.723 12.800 1.00 29.14 C ATOM 495 HA VAL A 32 10.859 29.137 15.240 1.00 0.00 H ATOM 496 HB VAL A 32 11.925 26.746 13.634 1.00 0.00 H ATOM 497 HG11 VAL A 32 10.890 26.361 15.900 1.00 0.00 H ATOM 498 HG12 VAL A 32 9.438 27.250 15.377 1.00 0.00 H ATOM 499 HG13 VAL A 32 9.860 25.701 14.606 1.00 0.00 H ATOM 500 HG21 VAL A 32 9.437 28.340 13.115 1.00 0.00 H ATOM 501 HG22 VAL A 32 10.887 28.275 12.083 1.00 0.00 H ATOM 502 HG23 VAL A 32 9.906 26.810 12.336 1.00 0.00 H ATOM 503 H VAL A 32 12.955 29.461 13.165 1.00 0.00 H ATOM 504 N LEU A 33 12.620 28.277 16.839 1.00 21.93 N ATOM 505 CA LEU A 33 13.657 27.890 17.788 1.00 22.35 C ATOM 506 C LEU A 33 13.223 26.768 18.665 1.00 22.18 C ATOM 507 O LEU A 33 12.061 26.625 18.941 1.00 22.30 O ATOM 508 CB LEU A 33 14.104 29.050 18.650 1.00 22.60 C ATOM 509 CG LEU A 33 14.589 30.294 17.861 1.00 23.75 C ATOM 510 CD1 LEU A 33 14.937 31.437 18.792 1.00 24.11 C ATOM 511 CD2 LEU A 33 15.763 29.961 16.995 1.00 23.27 C ATOM 512 HA LEU A 33 14.500 27.558 17.182 1.00 0.00 H ATOM 513 HB2 LEU A 33 13.265 29.351 19.277 1.00 0.00 H ATOM 514 HB3 LEU A 33 14.923 28.708 19.282 1.00 0.00 H ATOM 515 HG LEU A 33 13.765 30.611 17.222 1.00 0.00 H ATOM 516 HD21 LEU A 33 16.582 29.602 17.618 1.00 0.00 H ATOM 517 HD22 LEU A 33 15.480 29.186 16.283 1.00 0.00 H ATOM 518 HD23 LEU A 33 16.079 30.853 16.455 1.00 0.00 H ATOM 519 HD11 LEU A 33 14.055 31.715 19.370 1.00 0.00 H ATOM 520 HD12 LEU A 33 15.732 31.124 19.468 1.00 0.00 H ATOM 521 HD13 LEU A 33 15.273 32.292 18.206 1.00 0.00 H ATOM 522 H LEU A 33 11.712 28.627 17.205 1.00 0.00 H ATOM 523 N GLU A 34 14.199 25.990 19.121 1.00 23.07 N ATOM 524 CA GLU A 34 13.943 24.947 20.076 1.00 25.52 C ATOM 525 C GLU A 34 13.276 25.533 21.341 1.00 25.54 C ATOM 526 O GLU A 34 13.334 26.744 21.623 1.00 22.37 O ATOM 527 CB GLU A 34 15.268 24.314 20.493 1.00 30.44 C ATOM 528 CG GLU A 34 16.111 23.734 19.383 1.00 33.73 C ATOM 529 CD GLU A 34 17.262 22.931 19.997 1.00 37.04 C ATOM 530 OE1 GLU A 34 18.207 23.594 20.497 1.00 33.79 O ATOM 531 OE2 GLU A 34 17.105 21.654 20.080 1.00 39.71 O ATOM 532 HA GLU A 34 13.285 24.208 19.619 1.00 0.00 H ATOM 533 HB2 GLU A 34 15.859 25.080 20.994 1.00 0.00 H ATOM 534 HB3 GLU A 34 15.046 23.511 21.196 1.00 0.00 H ATOM 535 HG2 GLU A 34 15.499 23.079 18.763 1.00 0.00 H ATOM 536 HG3 GLU A 34 16.514 24.540 18.770 1.00 0.00 H ATOM 537 H GLU A 34 15.170 26.139 18.779 1.00 0.00 H ATOM 538 N GLU A 35 12.690 24.659 22.140 1.00 25.82 N ATOM 539 CA GLU A 35 11.993 25.094 23.373 1.00 26.76 C ATOM 540 C GLU A 35 12.809 25.983 24.243 1.00 26.55 C ATOM 541 O GLU A 35 13.983 25.716 24.580 1.00 25.31 O ATOM 542 CB GLU A 35 11.517 23.911 24.238 1.00 28.28 C ATOM 543 CG GLU A 35 10.260 23.259 23.776 1.00 30.47 C ATOM 544 CD GLU A 35 9.033 24.132 23.899 1.00 31.14 C ATOM 545 OE1 GLU A 35 9.073 25.118 24.635 1.00 30.18 O ATOM 546 OE2 GLU A 35 8.042 23.802 23.217 1.00 31.28 O ATOM 547 HA GLU A 35 11.137 25.653 22.995 1.00 0.00 H ATOM 548 HB2 GLU A 35 12.306 23.158 24.246 1.00 0.00 H ATOM 549 HB3 GLU A 35 11.356 24.277 25.252 1.00 0.00 H ATOM 550 HG2 GLU A 35 10.381 22.984 22.728 1.00 0.00 H ATOM 551 HG3 GLU A 35 10.102 22.359 24.371 1.00 0.00 H ATOM 552 H GLU A 35 12.718 23.648 21.899 1.00 0.00 H ATOM 553 N MET A 36 12.184 27.088 24.597 1.00 27.38 N ATOM 554 CA MET A 36 12.840 28.087 25.410 1.00 28.41 C ATOM 555 C MET A 36 11.764 29.005 25.960 1.00 28.41 C ATOM 556 O MET A 36 10.645 29.070 25.437 1.00 28.99 O ATOM 557 CB MET A 36 13.841 28.902 24.593 1.00 29.30 C ATOM 558 CG MET A 36 13.221 29.812 23.557 1.00 28.38 C ATOM 559 SD MET A 36 14.484 30.813 22.649 1.00 30.46 S ATOM 560 CE MET A 36 15.039 31.952 23.892 1.00 31.10 C ATOM 561 HA MET A 36 13.394 27.599 26.212 1.00 0.00 H ATOM 562 HB2 MET A 36 14.421 29.517 25.282 1.00 0.00 H ATOM 563 HB3 MET A 36 14.506 28.207 24.080 1.00 0.00 H ATOM 564 HG2 MET A 36 12.529 30.491 24.056 1.00 0.00 H ATOM 565 HG3 MET A 36 12.674 29.202 22.838 1.00 0.00 H ATOM 566 HE1 MET A 36 14.195 32.549 24.239 1.00 0.00 H ATOM 567 HE2 MET A 36 15.461 31.397 24.729 1.00 0.00 H ATOM 568 HE3 MET A 36 15.800 32.608 23.469 1.00 0.00 H ATOM 569 H MET A 36 11.204 27.244 24.287 1.00 0.00 H ATOM 570 N ASN A 37 12.107 29.743 26.987 1.00 30.98 N ATOM 571 CA ASN A 37 11.205 30.762 27.512 1.00 33.37 C ATOM 572 C ASN A 37 11.358 32.102 26.795 1.00 30.50 C ATOM 573 O ASN A 37 12.479 32.575 26.601 1.00 30.89 O ATOM 574 CB ASN A 37 11.431 30.986 29.015 1.00 38.26 C ATOM 575 CG ASN A 37 10.266 31.716 29.648 1.00 43.36 C ATOM 576 OD1 ASN A 37 10.125 32.944 29.435 1.00 49.91 O ATOM 577 ND2 ASN A 37 9.370 30.975 30.395 1.00 45.86 N ATOM 578 HA ASN A 37 10.197 30.384 27.339 1.00 0.00 H ATOM 579 HB2 ASN A 37 11.551 30.019 29.503 1.00 0.00 H ATOM 580 HB3 ASN A 37 12.337 31.576 29.153 1.00 0.00 H ATOM 581 HD22 ASN A 37 9.532 29.958 30.543 1.00 0.00 H ATOM 582 HD21 ASN A 37 8.534 31.434 30.809 1.00 0.00 H ATOM 583 H ASN A 37 13.035 29.600 27.434 1.00 0.00 H ATOM 584 N LEU A 38 10.238 32.727 26.452 1.00 27.64 N ATOM 585 CA LEU A 38 10.259 34.106 25.956 1.00 26.83 C ATOM 586 C LEU A 38 9.160 34.842 26.710 1.00 29.35 C ATOM 587 O LEU A 38 8.174 34.237 27.103 1.00 29.04 O ATOM 588 CB LEU A 38 9.982 34.152 24.449 1.00 27.19 C ATOM 589 CG LEU A 38 11.085 33.634 23.507 1.00 26.62 C ATOM 590 CD1 LEU A 38 10.630 33.625 22.008 1.00 28.31 C ATOM 591 CD2 LEU A 38 12.313 34.446 23.674 1.00 26.36 C ATOM 592 HA LEU A 38 11.236 34.562 26.115 1.00 0.00 H ATOM 593 HB2 LEU A 38 9.088 33.557 24.263 1.00 0.00 H ATOM 594 HB3 LEU A 38 9.788 35.191 24.184 1.00 0.00 H ATOM 595 HG LEU A 38 11.294 32.600 23.781 1.00 0.00 H ATOM 596 HD21 LEU A 38 12.094 35.487 23.435 1.00 0.00 H ATOM 597 HD22 LEU A 38 12.657 34.374 24.706 1.00 0.00 H ATOM 598 HD23 LEU A 38 13.088 34.073 23.004 1.00 0.00 H ATOM 599 HD11 LEU A 38 9.760 32.978 21.898 1.00 0.00 H ATOM 600 HD12 LEU A 38 10.372 34.639 21.702 1.00 0.00 H ATOM 601 HD13 LEU A 38 11.443 33.252 21.385 1.00 0.00 H ATOM 602 H LEU A 38 9.329 32.229 26.537 1.00 0.00 H ATOM 603 N PRO A 39 9.290 36.147 26.824 1.00 32.22 N ATOM 604 CA PRO A 39 8.289 36.974 27.492 1.00 33.55 C ATOM 605 C PRO A 39 7.076 37.283 26.605 1.00 33.18 C ATOM 606 O PRO A 39 7.181 37.384 25.359 1.00 33.22 O ATOM 607 CB PRO A 39 9.062 38.261 27.734 1.00 34.12 C ATOM 608 CG PRO A 39 9.863 38.384 26.604 1.00 35.46 C ATOM 609 CD PRO A 39 10.344 36.973 26.230 1.00 32.70 C ATOM 610 HA PRO A 39 7.881 36.487 28.378 1.00 0.00 H ATOM 611 HD3 PRO A 39 10.394 36.841 25.149 1.00 0.00 H ATOM 612 HD2 PRO A 39 11.318 36.754 26.667 1.00 0.00 H ATOM 613 HG3 PRO A 39 10.718 39.025 26.820 1.00 0.00 H ATOM 614 HG2 PRO A 39 9.288 38.812 25.783 1.00 0.00 H ATOM 615 HB2 PRO A 39 8.385 39.110 27.825 1.00 0.00 H ATOM 616 HB3 PRO A 39 9.670 38.185 28.635 1.00 0.00 H ATOM 617 N GLY A 40 5.933 37.505 27.263 1.00 32.82 N ATOM 618 CA GLY A 40 4.772 38.053 26.609 1.00 33.08 C ATOM 619 C GLY A 40 3.743 36.987 26.327 1.00 32.11 C ATOM 620 O GLY A 40 3.898 35.826 26.700 1.00 33.01 O ATOM 621 HA3 GLY A 40 5.078 38.509 25.667 1.00 0.00 H ATOM 622 HA2 GLY A 40 4.328 38.813 27.252 1.00 0.00 H ATOM 623 H GLY A 40 5.881 37.275 28.276 1.00 0.00 H ATOM 624 N ARG A 41 2.702 37.380 25.619 1.00 32.46 N ATOM 625 CA ARG A 41 1.651 36.449 25.229 1.00 31.82 C ATOM 626 C ARG A 41 2.061 35.692 23.979 1.00 29.28 C ATOM 627 O ARG A 41 2.984 36.077 23.252 1.00 26.85 O ATOM 628 CB ARG A 41 0.401 37.218 24.917 1.00 34.26 C ATOM 629 CG ARG A 41 0.548 38.059 23.645 1.00 36.65 C ATOM 630 CD ARG A 41 -0.771 38.729 23.173 1.00 38.74 C ATOM 631 NE ARG A 41 -1.594 39.122 24.314 1.00 42.02 N ATOM 632 CZ ARG A 41 -2.533 40.073 24.265 1.00 43.55 C ATOM 633 NH1 ARG A 41 -2.779 40.748 23.128 1.00 43.21 N ATOM 634 NH2 ARG A 41 -3.220 40.361 25.381 1.00 45.25 N ATOM 635 HA ARG A 41 1.481 35.750 26.048 1.00 0.00 H ATOM 636 HB2 ARG A 41 -0.421 36.515 24.781 1.00 0.00 H ATOM 637 HB3 ARG A 41 0.177 37.880 25.753 1.00 0.00 H ATOM 638 HG2 ARG A 41 1.282 38.843 23.835 1.00 0.00 H ATOM 639 HG3 ARG A 41 0.909 37.411 22.846 1.00 0.00 H ATOM 640 HD2 ARG A 41 -1.329 38.024 22.556 1.00 0.00 H ATOM 641 HD3 ARG A 41 -0.531 39.614 22.584 1.00 0.00 H ATOM 642 HE ARG A 41 -1.441 38.633 25.219 1.00 0.00 H ATOM 643 HH12 ARG A 41 -3.513 41.484 23.109 1.00 0.00 H ATOM 644 HH11 ARG A 41 -2.235 40.534 22.268 1.00 0.00 H ATOM 645 HH22 ARG A 41 -3.954 41.097 25.364 1.00 0.00 H ATOM 646 HH21 ARG A 41 -3.018 39.848 26.263 1.00 0.00 H ATOM 647 H ARG A 41 2.630 38.377 25.332 1.00 0.00 H ATOM 648 N TRP A 42 1.362 34.596 23.731 1.00 29.36 N ATOM 649 CA TRP A 42 1.649 33.767 22.584 1.00 28.93 C ATOM 650 C TRP A 42 0.352 33.040 22.191 1.00 31.28 C ATOM 651 O TRP A 42 -0.643 32.978 22.976 1.00 30.29 O ATOM 652 CB TRP A 42 2.754 32.788 22.922 1.00 28.78 C ATOM 653 CG TRP A 42 2.427 31.921 24.082 1.00 29.54 C ATOM 654 CD1 TRP A 42 2.713 32.175 25.399 1.00 28.98 C ATOM 655 CD2 TRP A 42 1.696 30.704 24.057 1.00 29.54 C ATOM 656 NE1 TRP A 42 2.224 31.167 26.190 1.00 30.65 N ATOM 657 CE2 TRP A 42 1.584 30.251 25.395 1.00 30.99 C ATOM 658 CE3 TRP A 42 1.099 29.944 23.043 1.00 29.68 C ATOM 659 CZ2 TRP A 42 0.920 29.068 25.729 1.00 30.67 C ATOM 660 CZ3 TRP A 42 0.475 28.752 23.370 1.00 31.02 C ATOM 661 CH2 TRP A 42 0.382 28.330 24.692 1.00 30.94 C ATOM 662 HA TRP A 42 1.994 34.369 21.743 1.00 0.00 H ATOM 663 HB2 TRP A 42 2.934 32.154 22.054 1.00 0.00 H ATOM 664 HB3 TRP A 42 3.658 33.351 23.153 1.00 0.00 H ATOM 665 HE1 TRP A 42 2.322 31.107 27.224 1.00 0.00 H ATOM 666 HD1 TRP A 42 3.251 33.050 25.764 1.00 0.00 H ATOM 667 HZ2 TRP A 42 0.830 28.741 26.765 1.00 0.00 H ATOM 668 HH2 TRP A 42 -0.128 27.393 24.916 1.00 0.00 H ATOM 669 HZ3 TRP A 42 0.050 28.135 22.579 1.00 0.00 H ATOM 670 HE3 TRP A 42 1.125 30.287 22.009 1.00 0.00 H ATOM 671 H TRP A 42 0.591 34.326 24.375 1.00 0.00 H ATOM 672 N LYS A 43 0.328 32.568 20.951 1.00 29.37 N ATOM 673 CA LYS A 43 -0.805 31.806 20.472 1.00 30.12 C ATOM 674 C LYS A 43 -0.240 30.577 19.767 1.00 28.41 C ATOM 675 O LYS A 43 0.842 30.608 19.285 1.00 24.44 O ATOM 676 CB LYS A 43 -1.700 32.643 19.564 1.00 32.73 C ATOM 677 CG LYS A 43 -1.032 33.217 18.325 1.00 35.63 C ATOM 678 CD LYS A 43 -1.901 34.381 17.759 1.00 38.25 C ATOM 679 CE LYS A 43 -1.395 34.892 16.397 1.00 39.43 C ATOM 680 NZ LYS A 43 -1.959 36.256 16.013 1.00 39.57 N ATOM 681 HA LYS A 43 -1.448 31.500 21.297 1.00 0.00 H ATOM 682 HB2 LYS A 43 -2.528 32.014 19.237 1.00 0.00 H ATOM 683 HB3 LYS A 43 -2.088 33.475 20.151 1.00 0.00 H ATOM 684 HG2 LYS A 43 -0.044 33.595 18.587 1.00 0.00 H ATOM 685 HG3 LYS A 43 -0.933 32.437 17.570 1.00 0.00 H ATOM 686 HD2 LYS A 43 -2.925 34.026 17.640 1.00 0.00 H ATOM 687 HD3 LYS A 43 -1.884 35.207 18.470 1.00 0.00 H ATOM 688 HE2 LYS A 43 -1.680 34.172 15.630 1.00 0.00 H ATOM 689 HE3 LYS A 43 -0.308 34.966 16.438 1.00 0.00 H ATOM 690 HZ1 LYS A 43 -2.996 36.198 15.960 1.00 0.00 H ATOM 691 HZ2 LYS A 43 -1.686 36.957 16.731 1.00 0.00 H ATOM 692 HZ3 LYS A 43 -1.578 36.539 15.088 1.00 0.00 H ATOM 693 H LYS A 43 1.132 32.748 20.317 1.00 0.00 H ATOM 694 N PRO A 44 -0.972 29.489 19.783 1.00 27.55 N ATOM 695 CA PRO A 44 -0.524 28.276 19.104 1.00 26.41 C ATOM 696 C PRO A 44 -0.598 28.380 17.585 1.00 25.87 C ATOM 697 O PRO A 44 -1.361 29.168 16.997 1.00 27.43 O ATOM 698 CB PRO A 44 -1.474 27.219 19.628 1.00 26.83 C ATOM 699 CG PRO A 44 -2.686 27.961 19.943 1.00 29.20 C ATOM 700 CD PRO A 44 -2.258 29.302 20.484 1.00 28.35 C ATOM 701 HA PRO A 44 0.526 28.061 19.302 1.00 0.00 H ATOM 702 HD3 PRO A 44 -2.972 30.084 20.227 1.00 0.00 H ATOM 703 HD2 PRO A 44 -2.125 29.274 21.565 1.00 0.00 H ATOM 704 HG3 PRO A 44 -3.269 27.425 20.691 1.00 0.00 H ATOM 705 HG2 PRO A 44 -3.287 28.095 19.044 1.00 0.00 H ATOM 706 HB2 PRO A 44 -1.669 26.462 18.869 1.00 0.00 H ATOM 707 HB3 PRO A 44 -1.069 26.741 20.520 1.00 0.00 H ATOM 708 N LYS A 45 0.194 27.528 16.945 1.00 24.95 N ATOM 709 CA LYS A 45 0.364 27.537 15.494 1.00 22.99 C ATOM 710 C LYS A 45 0.882 26.176 15.025 1.00 24.67 C ATOM 711 O LYS A 45 1.688 25.560 15.706 1.00 24.23 O ATOM 712 CB LYS A 45 1.354 28.668 15.095 1.00 26.82 C ATOM 713 CG LYS A 45 1.452 28.893 13.636 1.00 28.80 C ATOM 714 CD LYS A 45 2.109 30.207 13.337 1.00 32.38 C ATOM 715 CE LYS A 45 1.728 30.705 11.895 1.00 35.01 C ATOM 716 NZ LYS A 45 2.091 32.169 11.645 1.00 38.45 N ATOM 717 HA LYS A 45 -0.596 27.725 15.013 1.00 0.00 H ATOM 718 HB2 LYS A 45 1.023 29.595 15.564 1.00 0.00 H ATOM 719 HB3 LYS A 45 2.344 28.406 15.469 1.00 0.00 H ATOM 720 HG2 LYS A 45 2.040 28.091 13.190 1.00 0.00 H ATOM 721 HG3 LYS A 45 0.450 28.889 13.207 1.00 0.00 H ATOM 722 HD2 LYS A 45 1.782 30.946 14.069 1.00 0.00 H ATOM 723 HD3 LYS A 45 3.191 30.089 13.401 1.00 0.00 H ATOM 724 HE2 LYS A 45 0.653 30.587 11.761 1.00 0.00 H ATOM 725 HE3 LYS A 45 2.254 30.089 11.166 1.00 0.00 H ATOM 726 HZ1 LYS A 45 1.588 32.771 12.328 1.00 0.00 H ATOM 727 HZ2 LYS A 45 3.117 32.295 11.760 1.00 0.00 H ATOM 728 HZ3 LYS A 45 1.814 32.433 10.678 1.00 0.00 H ATOM 729 H LYS A 45 0.717 26.822 17.502 1.00 0.00 H ATOM 730 N MET A 46 0.449 25.716 13.840 1.00 25.91 N ATOM 731 CA MET A 46 1.027 24.524 13.246 1.00 26.11 C ATOM 732 C MET A 46 1.891 24.962 12.057 1.00 25.92 C ATOM 733 O MET A 46 1.490 25.806 11.198 1.00 24.34 O ATOM 734 CB MET A 46 -0.063 23.542 12.803 1.00 27.67 C ATOM 735 CG MET A 46 -0.977 23.093 13.962 1.00 30.66 C ATOM 736 SD MET A 46 -0.091 21.973 15.041 1.00 33.93 S ATOM 737 CE MET A 46 0.657 21.084 14.006 1.00 32.84 C ATOM 738 HA MET A 46 1.639 24.001 13.981 1.00 0.00 H ATOM 739 HB2 MET A 46 -0.677 24.024 12.043 1.00 0.00 H ATOM 740 HB3 MET A 46 0.416 22.661 12.376 1.00 0.00 H ATOM 741 HG2 MET A 46 -1.853 22.587 13.556 1.00 0.00 H ATOM 742 HG3 MET A 46 -1.295 23.967 14.531 1.00 0.00 H ATOM 743 HE1 MET A 46 -0.070 20.585 13.365 1.00 0.00 H ATOM 744 HE2 MET A 46 1.311 21.709 13.398 1.00 0.00 H ATOM 745 HE3 MET A 46 1.252 20.338 14.533 1.00 0.00 H ATOM 746 H MET A 46 -0.311 26.221 13.341 1.00 0.00 H ATOM 747 N ILE A 47 3.095 24.412 12.030 1.00 24.13 N ATOM 748 CA ILE A 47 4.009 24.674 10.912 1.00 23.37 C ATOM 749 C ILE A 47 4.433 23.371 10.337 1.00 20.87 C ATOM 750 O ILE A 47 4.539 22.378 11.057 1.00 23.47 O ATOM 751 CB ILE A 47 5.209 25.496 11.328 1.00 21.97 C ATOM 752 CG1 ILE A 47 6.010 24.746 12.386 1.00 24.18 C ATOM 753 CG2 ILE A 47 4.746 26.912 11.791 1.00 22.26 C ATOM 754 CD1 ILE A 47 7.383 25.397 12.731 1.00 24.91 C ATOM 755 HA ILE A 47 3.483 25.265 10.162 1.00 0.00 H ATOM 756 HB ILE A 47 5.877 25.647 10.480 1.00 0.00 H ATOM 757 HG12 ILE A 47 5.414 24.701 13.298 1.00 0.00 H ATOM 758 HG13 ILE A 47 6.193 23.735 12.023 1.00 0.00 H ATOM 759 HD11 ILE A 47 8.000 25.439 11.833 1.00 0.00 H ATOM 760 HD12 ILE A 47 7.220 26.406 13.109 1.00 0.00 H ATOM 761 HD13 ILE A 47 7.886 24.800 13.491 1.00 0.00 H ATOM 762 HG21 ILE A 47 4.234 27.412 10.969 1.00 0.00 H ATOM 763 HG22 ILE A 47 4.066 26.812 12.637 1.00 0.00 H ATOM 764 HG23 ILE A 47 5.616 27.498 12.089 1.00 0.00 H ATOM 765 H ILE A 47 3.395 23.789 12.807 1.00 0.00 H ATOM 766 N GLY A 48 4.608 23.368 9.024 1.00 24.64 N ATOM 767 CA GLY A 48 4.849 22.157 8.259 1.00 25.87 C ATOM 768 C GLY A 48 6.083 22.285 7.366 1.00 27.51 C ATOM 769 O GLY A 48 6.504 23.360 6.994 1.00 29.50 O ATOM 770 HA3 GLY A 48 3.980 21.956 7.633 1.00 0.00 H ATOM 771 HA2 GLY A 48 4.998 21.327 8.950 1.00 0.00 H ATOM 772 H GLY A 48 4.571 24.275 8.517 1.00 0.00 H ATOM 773 N GLY A 49 6.670 21.157 7.053 1.00 24.94 N ATOM 774 CA GLY A 49 7.833 21.112 6.218 1.00 25.32 C ATOM 775 C GLY A 49 7.956 19.710 5.687 1.00 25.00 C ATOM 776 O GLY A 49 6.977 19.005 5.612 1.00 23.08 O ATOM 777 HA3 GLY A 49 8.719 21.369 6.799 1.00 0.00 H ATOM 778 HA2 GLY A 49 7.726 21.815 5.392 1.00 0.00 H ATOM 779 H GLY A 49 6.280 20.266 7.422 1.00 0.00 H ATOM 780 N ILE A 50 9.158 19.295 5.313 1.00 25.63 N ATOM 781 CA ILE A 50 9.366 17.883 5.021 1.00 29.17 C ATOM 782 C ILE A 50 9.005 17.055 6.265 1.00 28.98 C ATOM 783 O ILE A 50 9.463 17.356 7.367 1.00 29.52 O ATOM 784 CB ILE A 50 10.842 17.623 4.722 1.00 30.30 C ATOM 785 CG1 ILE A 50 11.294 18.440 3.526 1.00 33.52 C ATOM 786 CG2 ILE A 50 11.079 16.094 4.505 1.00 31.57 C ATOM 787 CD1 ILE A 50 10.751 17.975 2.317 1.00 34.06 C ATOM 788 HA ILE A 50 8.748 17.609 4.166 1.00 0.00 H ATOM 789 HB ILE A 50 11.444 17.938 5.575 1.00 0.00 H ATOM 790 HG12 ILE A 50 10.984 19.475 3.673 1.00 0.00 H ATOM 791 HG13 ILE A 50 12.381 18.393 3.462 1.00 0.00 H ATOM 792 HD11 ILE A 50 11.061 16.943 2.154 1.00 0.00 H ATOM 793 HD12 ILE A 50 9.663 18.026 2.365 1.00 0.00 H ATOM 794 HD13 ILE A 50 11.109 18.597 1.496 1.00 0.00 H ATOM 795 HG21 ILE A 50 10.793 15.552 5.406 1.00 0.00 H ATOM 796 HG22 ILE A 50 10.475 15.750 3.665 1.00 0.00 H ATOM 797 HG23 ILE A 50 12.133 15.918 4.292 1.00 0.00 H ATOM 798 H ILE A 50 9.944 19.970 5.229 1.00 0.00 H ATOM 799 N GLY A 51 8.267 15.984 6.093 1.00 30.70 N ATOM 800 CA GLY A 51 7.932 15.161 7.258 1.00 30.55 C ATOM 801 C GLY A 51 6.565 15.486 7.847 1.00 31.23 C ATOM 802 O GLY A 51 6.035 14.652 8.537 1.00 30.49 O ATOM 803 HA3 GLY A 51 8.688 15.323 8.026 1.00 0.00 H ATOM 804 HA2 GLY A 51 7.940 14.113 6.957 1.00 0.00 H ATOM 805 H GLY A 51 7.926 15.724 5.146 1.00 0.00 H ATOM 806 N GLY A 52 5.980 16.646 7.538 1.00 29.50 N ATOM 807 CA GLY A 52 4.655 17.008 8.080 1.00 30.39 C ATOM 808 C GLY A 52 4.725 18.221 8.997 1.00 30.32 C ATOM 809 O GLY A 52 5.610 19.077 8.827 1.00 28.04 O ATOM 810 HA3 GLY A 52 4.262 16.162 8.644 1.00 0.00 H ATOM 811 HA2 GLY A 52 3.985 17.232 7.250 1.00 0.00 H ATOM 812 H GLY A 52 6.468 17.309 6.902 1.00 0.00 H ATOM 813 N PHE A 53 3.862 18.237 10.019 1.00 29.06 N ATOM 814 CA PHE A 53 3.658 19.429 10.842 1.00 28.13 C ATOM 815 C PHE A 53 4.066 19.218 12.286 1.00 26.58 C ATOM 816 O PHE A 53 3.997 18.095 12.806 1.00 25.20 O ATOM 817 CB PHE A 53 2.210 19.820 10.803 1.00 27.30 C ATOM 818 CG PHE A 53 1.734 20.258 9.460 1.00 27.11 C ATOM 819 CD1 PHE A 53 1.440 21.580 9.209 1.00 27.84 C ATOM 820 CD2 PHE A 53 1.521 19.317 8.451 1.00 28.31 C ATOM 821 CE1 PHE A 53 0.983 21.994 7.963 1.00 28.33 C ATOM 822 CE2 PHE A 53 1.051 19.732 7.218 1.00 30.94 C ATOM 823 CZ PHE A 53 0.753 21.093 6.995 1.00 30.01 C ATOM 824 HA PHE A 53 4.289 20.216 10.429 1.00 0.00 H ATOM 825 HB2 PHE A 53 1.615 18.962 11.114 1.00 0.00 H ATOM 826 HB3 PHE A 53 2.057 20.640 11.505 1.00 0.00 H ATOM 827 HD2 PHE A 53 1.724 18.262 8.634 1.00 0.00 H ATOM 828 HE2 PHE A 53 0.911 19.006 6.417 1.00 0.00 H ATOM 829 HZ PHE A 53 0.337 21.412 6.039 1.00 0.00 H ATOM 830 HE1 PHE A 53 0.811 23.053 7.772 1.00 0.00 H ATOM 831 HD1 PHE A 53 1.568 22.316 10.003 1.00 0.00 H ATOM 832 H PHE A 53 3.320 17.376 10.235 1.00 0.00 H ATOM 833 N ILE A 54 4.488 20.300 12.933 1.00 25.64 N ATOM 834 CA ILE A 54 4.654 20.347 14.359 1.00 25.94 C ATOM 835 C ILE A 54 3.907 21.547 14.973 1.00 25.43 C ATOM 836 O ILE A 54 3.620 22.541 14.321 1.00 22.03 O ATOM 837 CB ILE A 54 6.138 20.389 14.771 1.00 27.03 C ATOM 838 CG1 ILE A 54 6.817 21.623 14.201 1.00 26.64 C ATOM 839 CG2 ILE A 54 6.827 19.067 14.421 1.00 28.54 C ATOM 840 CD1 ILE A 54 8.279 21.928 14.827 1.00 27.58 C ATOM 841 HA ILE A 54 4.221 19.425 14.749 1.00 0.00 H ATOM 842 HB ILE A 54 6.220 20.486 15.853 1.00 0.00 H ATOM 843 HG12 ILE A 54 6.928 21.486 13.125 1.00 0.00 H ATOM 844 HG13 ILE A 54 6.177 22.484 14.392 1.00 0.00 H ATOM 845 HD11 ILE A 54 8.188 22.081 15.902 1.00 0.00 H ATOM 846 HD12 ILE A 54 8.939 21.082 14.634 1.00 0.00 H ATOM 847 HD13 ILE A 54 8.691 22.825 14.364 1.00 0.00 H ATOM 848 HG21 ILE A 54 6.334 18.251 14.949 1.00 0.00 H ATOM 849 HG22 ILE A 54 6.761 18.898 13.346 1.00 0.00 H ATOM 850 HG23 ILE A 54 7.874 19.115 14.719 1.00 0.00 H ATOM 851 H ILE A 54 4.708 21.153 12.380 1.00 0.00 H ATOM 852 N LYS A 55 3.611 21.441 16.263 1.00 26.14 N ATOM 853 CA LYS A 55 2.891 22.516 16.977 1.00 24.77 C ATOM 854 C LYS A 55 3.940 23.384 17.672 1.00 23.61 C ATOM 855 O LYS A 55 4.875 22.876 18.266 1.00 23.02 O ATOM 856 CB LYS A 55 1.907 21.956 17.984 1.00 26.20 C ATOM 857 CG LYS A 55 1.105 23.000 18.741 1.00 28.76 C ATOM 858 CD LYS A 55 -0.087 22.314 19.482 1.00 32.60 C ATOM 859 CE LYS A 55 -0.801 23.284 20.361 1.00 36.21 C ATOM 860 NZ LYS A 55 -1.897 22.645 21.134 1.00 39.79 N ATOM 861 HA LYS A 55 2.308 23.105 16.269 1.00 0.00 H ATOM 862 HB2 LYS A 55 1.208 21.311 17.452 1.00 0.00 H ATOM 863 HB3 LYS A 55 2.465 21.364 18.710 1.00 0.00 H ATOM 864 HG2 LYS A 55 1.749 23.494 19.469 1.00 0.00 H ATOM 865 HG3 LYS A 55 0.719 23.739 18.039 1.00 0.00 H ATOM 866 HD2 LYS A 55 -0.786 21.920 18.744 1.00 0.00 H ATOM 867 HD3 LYS A 55 0.296 21.495 20.092 1.00 0.00 H ATOM 868 HE2 LYS A 55 -1.224 24.074 19.740 1.00 0.00 H ATOM 869 HE3 LYS A 55 -0.085 23.717 21.060 1.00 0.00 H ATOM 870 HZ1 LYS A 55 -2.590 22.235 20.476 1.00 0.00 H ATOM 871 HZ2 LYS A 55 -1.503 21.894 21.736 1.00 0.00 H ATOM 872 HZ3 LYS A 55 -2.362 23.360 21.729 1.00 0.00 H ATOM 873 H LYS A 55 3.892 20.584 16.781 1.00 0.00 H ATOM 874 N VAL A 56 3.783 24.693 17.533 1.00 23.02 N ATOM 875 CA VAL A 56 4.705 25.684 18.089 1.00 22.61 C ATOM 876 C VAL A 56 3.919 26.772 18.805 1.00 23.60 C ATOM 877 O VAL A 56 2.715 26.933 18.589 1.00 21.50 O ATOM 878 CB VAL A 56 5.621 26.350 16.991 1.00 23.06 C ATOM 879 CG1 VAL A 56 6.549 25.313 16.374 1.00 24.04 C ATOM 880 CG2 VAL A 56 4.777 26.985 15.905 1.00 22.75 C ATOM 881 HA VAL A 56 5.356 25.155 18.785 1.00 0.00 H ATOM 882 HB VAL A 56 6.218 27.124 17.473 1.00 0.00 H ATOM 883 HG11 VAL A 56 7.181 24.884 17.152 1.00 0.00 H ATOM 884 HG12 VAL A 56 5.955 24.525 15.911 1.00 0.00 H ATOM 885 HG13 VAL A 56 7.174 25.790 15.619 1.00 0.00 H ATOM 886 HG21 VAL A 56 4.159 26.221 15.434 1.00 0.00 H ATOM 887 HG22 VAL A 56 4.138 27.751 16.344 1.00 0.00 H ATOM 888 HG23 VAL A 56 5.429 27.438 15.158 1.00 0.00 H ATOM 889 H VAL A 56 2.959 25.035 16.999 1.00 0.00 H ATOM 890 N ARG A 57 4.632 27.558 19.629 1.00 22.89 N ATOM 891 CA ARG A 57 4.072 28.752 20.230 1.00 23.90 C ATOM 892 C ARG A 57 4.606 29.978 19.499 1.00 21.83 C ATOM 893 O ARG A 57 5.813 30.106 19.315 1.00 22.86 O ATOM 894 CB ARG A 57 4.476 28.870 21.702 1.00 26.33 C ATOM 895 CG ARG A 57 3.964 27.728 22.562 1.00 28.37 C ATOM 896 CD ARG A 57 4.026 28.054 24.076 1.00 31.19 C ATOM 897 NE ARG A 57 5.392 28.379 24.487 1.00 33.30 N ATOM 898 CZ ARG A 57 6.360 27.468 24.475 1.00 35.40 C ATOM 899 NH1 ARG A 57 6.079 26.241 24.153 1.00 37.13 N ATOM 900 NH2 ARG A 57 7.581 27.780 24.829 1.00 36.53 N ATOM 901 HA ARG A 57 2.986 28.689 20.157 1.00 0.00 H ATOM 902 HB2 ARG A 57 5.564 28.887 21.762 1.00 0.00 H ATOM 903 HB3 ARG A 57 4.078 29.805 22.096 1.00 0.00 H ATOM 904 HG2 ARG A 57 2.929 27.522 22.290 1.00 0.00 H ATOM 905 HG3 ARG A 57 4.572 26.844 22.369 1.00 0.00 H ATOM 906 HD2 ARG A 57 3.680 27.189 24.642 1.00 0.00 H ATOM 907 HD3 ARG A 57 3.379 28.906 24.284 1.00 0.00 H ATOM 908 HE ARG A 57 5.611 29.347 24.796 1.00 0.00 H ATOM 909 HH12 ARG A 57 6.830 25.522 24.141 1.00 0.00 H ATOM 910 HH11 ARG A 57 5.103 25.978 23.907 1.00 0.00 H ATOM 911 HH22 ARG A 57 8.328 27.056 24.814 1.00 0.00 H ATOM 912 HH21 ARG A 57 7.804 28.752 25.125 1.00 0.00 H ATOM 913 H ARG A 57 5.617 27.301 19.842 1.00 0.00 H ATOM 914 N GLN A 58 3.714 30.887 19.122 1.00 22.34 N ATOM 915 CA GLN A 58 4.091 32.120 18.421 1.00 21.77 C ATOM 916 C GLN A 58 4.167 33.333 19.348 1.00 22.45 C ATOM 917 O GLN A 58 3.137 33.752 19.870 1.00 23.54 O ATOM 918 CB GLN A 58 3.078 32.410 17.296 1.00 21.76 C ATOM 919 CG GLN A 58 3.267 33.674 16.552 1.00 21.80 C ATOM 920 CD GLN A 58 2.108 34.040 15.599 1.00 26.38 C ATOM 921 OE1 GLN A 58 1.335 33.167 15.156 1.00 29.56 O ATOM 922 NE2 GLN A 58 2.002 35.334 15.277 1.00 26.71 N ATOM 923 HA GLN A 58 5.088 31.957 18.012 1.00 0.00 H ATOM 924 HB2 GLN A 58 3.134 31.591 16.579 1.00 0.00 H ATOM 925 HB3 GLN A 58 2.084 32.433 17.742 1.00 0.00 H ATOM 926 HG2 GLN A 58 3.380 34.481 17.276 1.00 0.00 H ATOM 927 HG3 GLN A 58 4.179 33.588 15.961 1.00 0.00 H ATOM 928 HE22 GLN A 58 2.671 36.025 15.673 1.00 0.00 H ATOM 929 HE21 GLN A 58 1.250 35.649 14.631 1.00 0.00 H ATOM 930 H GLN A 58 2.709 30.718 19.332 1.00 0.00 H ATOM 931 N TYR A 59 5.376 33.921 19.432 1.00 21.93 N ATOM 932 CA TYR A 59 5.670 35.125 20.153 1.00 22.39 C ATOM 933 C TYR A 59 5.985 36.210 19.158 1.00 22.79 C ATOM 934 O TYR A 59 6.854 36.029 18.250 1.00 21.74 O ATOM 935 CB TYR A 59 6.881 34.964 21.056 1.00 23.74 C ATOM 936 CG TYR A 59 6.678 33.971 22.150 1.00 25.14 C ATOM 937 CD1 TYR A 59 6.832 32.602 21.891 1.00 25.44 C ATOM 938 CD2 TYR A 59 6.285 34.378 23.449 1.00 27.19 C ATOM 939 CE1 TYR A 59 6.662 31.663 22.887 1.00 26.52 C ATOM 940 CE2 TYR A 59 6.071 33.402 24.469 1.00 27.41 C ATOM 941 CZ TYR A 59 6.282 32.075 24.165 1.00 28.10 C ATOM 942 OH TYR A 59 6.107 31.137 25.118 1.00 30.17 O ATOM 943 HA TYR A 59 4.804 35.368 20.768 1.00 0.00 H ATOM 944 HB3 TYR A 59 7.108 35.931 21.505 1.00 0.00 H ATOM 945 HB2 TYR A 59 7.725 34.640 20.447 1.00 0.00 H ATOM 946 HD2 TYR A 59 6.146 35.436 23.670 1.00 0.00 H ATOM 947 HE2 TYR A 59 5.748 33.700 25.466 1.00 0.00 H ATOM 948 HE1 TYR A 59 6.823 30.606 22.677 1.00 0.00 H ATOM 949 HD1 TYR A 59 7.091 32.274 20.884 1.00 0.00 H ATOM 950 HH TYR A 59 6.724 31.315 25.872 1.00 0.00 H ATOM 951 H TYR A 59 6.164 33.462 18.931 1.00 0.00 H ATOM 952 N ASP A 60 5.280 37.331 19.322 1.00 23.21 N ATOM 953 CA ASP A 60 5.428 38.464 18.404 1.00 25.18 C ATOM 954 C ASP A 60 6.349 39.552 18.945 1.00 26.20 C ATOM 955 O ASP A 60 6.588 39.655 20.172 1.00 25.51 O ATOM 956 CB ASP A 60 4.032 39.048 18.050 1.00 27.03 C ATOM 957 CG ASP A 60 3.137 38.045 17.335 1.00 29.63 C ATOM 958 OD1 ASP A 60 3.674 37.320 16.457 1.00 26.93 O ATOM 959 OD2 ASP A 60 1.903 37.861 17.646 1.00 28.06 O ATOM 960 HA ASP A 60 5.903 38.084 17.499 1.00 0.00 H ATOM 961 HB2 ASP A 60 3.540 39.359 18.972 1.00 0.00 H ATOM 962 HB3 ASP A 60 4.170 39.915 17.403 1.00 0.00 H ATOM 963 H ASP A 60 4.613 37.402 20.116 1.00 0.00 H ATOM 964 N GLN A 61 6.912 40.351 18.036 1.00 26.19 N ATOM 965 CA GLN A 61 7.722 41.518 18.427 1.00 27.64 C ATOM 966 C GLN A 61 8.834 41.153 19.402 1.00 26.93 C ATOM 967 O GLN A 61 8.945 41.736 20.469 1.00 28.49 O ATOM 968 CB GLN A 61 6.812 42.588 19.085 1.00 28.90 C ATOM 969 CG GLN A 61 5.626 43.021 18.225 1.00 32.56 C ATOM 970 CD GLN A 61 4.834 44.218 18.794 1.00 35.92 C ATOM 971 OE1 GLN A 61 4.794 45.291 18.171 1.00 39.16 O ATOM 972 NE2 GLN A 61 4.205 44.031 19.940 1.00 36.61 N ATOM 973 HA GLN A 61 8.184 41.906 17.519 1.00 0.00 H ATOM 974 HB2 GLN A 61 6.426 42.180 20.019 1.00 0.00 H ATOM 975 HB3 GLN A 61 7.419 43.468 19.298 1.00 0.00 H ATOM 976 HG2 GLN A 61 6.001 43.297 17.239 1.00 0.00 H ATOM 977 HG3 GLN A 61 4.945 42.175 18.130 1.00 0.00 H ATOM 978 HE22 GLN A 61 4.269 43.113 20.425 1.00 0.00 H ATOM 979 HE21 GLN A 61 3.646 44.802 20.358 1.00 0.00 H ATOM 980 H GLN A 61 6.775 40.145 17.026 1.00 0.00 H ATOM 981 N ILE A 62 9.632 40.172 19.046 1.00 23.86 N ATOM 982 CA ILE A 62 10.758 39.728 19.851 1.00 25.06 C ATOM 983 C ILE A 62 12.035 40.291 19.250 1.00 25.76 C ATOM 984 O ILE A 62 12.267 40.197 18.034 1.00 26.48 O ATOM 985 CB ILE A 62 10.830 38.178 19.843 1.00 25.34 C ATOM 986 CG1 ILE A 62 9.547 37.576 20.428 1.00 24.96 C ATOM 987 CG2 ILE A 62 12.090 37.684 20.480 1.00 24.82 C ATOM 988 CD1 ILE A 62 9.294 37.848 21.925 1.00 27.73 C ATOM 989 HA ILE A 62 10.637 40.075 20.877 1.00 0.00 H ATOM 990 HB ILE A 62 10.882 37.828 18.812 1.00 0.00 H ATOM 991 HG12 ILE A 62 8.703 37.980 19.868 1.00 0.00 H ATOM 992 HG13 ILE A 62 9.591 36.496 20.288 1.00 0.00 H ATOM 993 HD11 ILE A 62 10.116 37.438 22.511 1.00 0.00 H ATOM 994 HD12 ILE A 62 9.228 38.923 22.092 1.00 0.00 H ATOM 995 HD13 ILE A 62 8.360 37.374 22.226 1.00 0.00 H ATOM 996 HG21 ILE A 62 12.949 38.073 19.933 1.00 0.00 H ATOM 997 HG22 ILE A 62 12.131 38.026 21.514 1.00 0.00 H ATOM 998 HG23 ILE A 62 12.105 36.594 20.456 1.00 0.00 H ATOM 999 H ILE A 62 9.449 39.689 18.143 1.00 0.00 H ATOM 1000 N LEU A 63 12.870 40.886 20.104 1.00 25.10 N ATOM 1001 CA LEU A 63 14.161 41.407 19.675 1.00 27.46 C ATOM 1002 C LEU A 63 15.142 40.251 19.528 1.00 28.01 C ATOM 1003 O LEU A 63 15.178 39.340 20.365 1.00 25.41 O ATOM 1004 CB LEU A 63 14.703 42.441 20.687 1.00 30.07 C ATOM 1005 CG LEU A 63 13.754 43.590 21.039 1.00 33.40 C ATOM 1006 CD1 LEU A 63 14.083 44.413 22.340 1.00 34.85 C ATOM 1007 CD2 LEU A 63 13.730 44.540 19.874 1.00 35.36 C ATOM 1008 HA LEU A 63 14.039 41.910 18.716 1.00 0.00 H ATOM 1009 HB2 LEU A 63 14.945 41.912 21.609 1.00 0.00 H ATOM 1010 HB3 LEU A 63 15.612 42.874 20.269 1.00 0.00 H ATOM 1011 HG LEU A 63 12.796 43.114 21.249 1.00 0.00 H ATOM 1012 HD21 LEU A 63 14.736 44.921 19.696 1.00 0.00 H ATOM 1013 HD22 LEU A 63 13.377 44.015 18.986 1.00 0.00 H ATOM 1014 HD23 LEU A 63 13.060 45.370 20.098 1.00 0.00 H ATOM 1015 HD11 LEU A 63 14.071 43.747 23.203 1.00 0.00 H ATOM 1016 HD12 LEU A 63 15.070 44.866 22.242 1.00 0.00 H ATOM 1017 HD13 LEU A 63 13.335 45.195 22.473 1.00 0.00 H ATOM 1018 H LEU A 63 12.592 40.980 21.102 1.00 0.00 H ATOM 1019 N ILE A 64 15.913 40.284 18.450 1.00 26.92 N ATOM 1020 CA ILE A 64 16.905 39.284 18.150 1.00 27.35 C ATOM 1021 C ILE A 64 18.124 39.950 17.479 1.00 28.72 C ATOM 1022 O ILE A 64 18.016 41.018 16.833 1.00 29.99 O ATOM 1023 CB ILE A 64 16.261 38.220 17.231 1.00 30.02 C ATOM 1024 CG1 ILE A 64 17.228 37.027 16.988 1.00 30.63 C ATOM 1025 CG2 ILE A 64 15.861 38.854 15.880 1.00 29.29 C ATOM 1026 CD1 ILE A 64 16.485 35.671 16.597 1.00 33.07 C ATOM 1027 HA ILE A 64 17.255 38.798 19.061 1.00 0.00 H ATOM 1028 HB ILE A 64 15.369 37.841 17.730 1.00 0.00 H ATOM 1029 HG12 ILE A 64 17.908 37.293 16.179 1.00 0.00 H ATOM 1030 HG13 ILE A 64 17.800 36.856 17.900 1.00 0.00 H ATOM 1031 HD11 ILE A 64 15.809 35.383 17.402 1.00 0.00 H ATOM 1032 HD12 ILE A 64 15.916 35.821 15.679 1.00 0.00 H ATOM 1033 HD13 ILE A 64 17.224 34.885 16.443 1.00 0.00 H ATOM 1034 HG21 ILE A 64 15.144 39.656 16.055 1.00 0.00 H ATOM 1035 HG22 ILE A 64 16.749 39.257 15.393 1.00 0.00 H ATOM 1036 HG23 ILE A 64 15.409 38.094 15.243 1.00 0.00 H ATOM 1037 H ILE A 64 15.795 41.075 17.785 1.00 0.00 H ATOM 1038 N GLU A 65 19.291 39.347 17.637 1.00 28.38 N ATOM 1039 CA GLU A 65 20.501 39.797 16.959 1.00 32.24 C ATOM 1040 C GLU A 65 21.105 38.688 16.172 1.00 31.86 C ATOM 1041 O GLU A 65 21.303 37.618 16.721 1.00 31.65 O ATOM 1042 CB GLU A 65 21.562 40.171 17.986 1.00 35.79 C ATOM 1043 CG GLU A 65 21.511 41.589 18.384 1.00 39.13 C ATOM 1044 CD GLU A 65 22.705 41.961 19.286 1.00 43.01 C ATOM 1045 OE1 GLU A 65 23.896 41.667 18.931 1.00 45.46 O ATOM 1046 OE2 GLU A 65 22.400 42.526 20.351 1.00 45.06 O ATOM 1047 HA GLU A 65 20.218 40.637 16.325 1.00 0.00 H ATOM 1048 HB2 GLU A 65 21.417 39.556 18.874 1.00 0.00 H ATOM 1049 HB3 GLU A 65 22.544 39.966 17.560 1.00 0.00 H ATOM 1050 HG2 GLU A 65 21.535 42.210 17.489 1.00 0.00 H ATOM 1051 HG3 GLU A 65 20.584 41.772 18.928 1.00 0.00 H ATOM 1052 H GLU A 65 19.347 38.522 18.268 1.00 0.00 H ATOM 1053 N ILE A 66 21.393 38.910 14.894 1.00 31.19 N ATOM 1054 CA ILE A 66 21.904 37.816 14.030 1.00 33.55 C ATOM 1055 C ILE A 66 23.237 38.299 13.474 1.00 34.18 C ATOM 1056 O ILE A 66 23.257 39.261 12.718 1.00 34.56 O ATOM 1057 CB ILE A 66 20.922 37.489 12.891 1.00 33.18 C ATOM 1058 CG1 ILE A 66 19.580 37.023 13.452 1.00 33.98 C ATOM 1059 CG2 ILE A 66 21.547 36.498 11.903 1.00 33.68 C ATOM 1060 CD1 ILE A 66 18.406 37.152 12.542 1.00 34.42 C ATOM 1061 HA ILE A 66 22.021 36.896 14.602 1.00 0.00 H ATOM 1062 HB ILE A 66 20.717 38.396 12.323 1.00 0.00 H ATOM 1063 HG12 ILE A 66 19.679 35.971 13.721 1.00 0.00 H ATOM 1064 HG13 ILE A 66 19.373 37.608 14.348 1.00 0.00 H ATOM 1065 HD11 ILE A 66 18.272 38.199 12.270 1.00 0.00 H ATOM 1066 HD12 ILE A 66 18.578 36.561 11.643 1.00 0.00 H ATOM 1067 HD13 ILE A 66 17.512 36.790 13.050 1.00 0.00 H ATOM 1068 HG21 ILE A 66 22.450 36.934 11.476 1.00 0.00 H ATOM 1069 HG22 ILE A 66 21.800 35.576 12.426 1.00 0.00 H ATOM 1070 HG23 ILE A 66 20.834 36.282 11.107 1.00 0.00 H ATOM 1071 H ILE A 66 21.259 39.861 14.494 1.00 0.00 H ATOM 1072 N CYS A 67 24.346 37.704 13.916 1.00 37.99 N ATOM 1073 CA CYS A 67 25.707 38.209 13.567 1.00 40.40 C ATOM 1074 C CYS A 67 25.912 39.667 13.819 1.00 40.07 C ATOM 1075 O CYS A 67 26.467 40.367 12.997 1.00 43.32 O ATOM 1076 CB CYS A 67 25.997 38.054 12.081 1.00 42.82 C ATOM 1077 SG CYS A 67 26.423 36.417 11.612 1.00 47.27 S ATOM 1078 HA CYS A 67 26.357 37.612 14.206 1.00 0.00 H ATOM 1079 HB2 CYS A 67 26.825 38.713 11.821 1.00 0.00 H ATOM 1080 HB3 CYS A 67 25.109 38.352 11.524 1.00 0.00 H ATOM 1081 HG CYS A 67 27.556 36.024 12.296 1.00 0.00 H ATOM 1082 H CYS A 67 24.260 36.863 14.522 1.00 0.00 H ATOM 1083 N GLY A 68 25.442 40.175 14.924 1.00 39.22 N ATOM 1084 CA GLY A 68 25.614 41.583 15.140 1.00 38.43 C ATOM 1085 C GLY A 68 24.512 42.467 14.581 1.00 38.07 C ATOM 1086 O GLY A 68 24.446 43.625 14.943 1.00 40.34 O ATOM 1087 HA3 GLY A 68 26.554 41.882 14.676 1.00 0.00 H ATOM 1088 HA2 GLY A 68 25.670 41.754 16.215 1.00 0.00 H ATOM 1089 H GLY A 68 24.958 39.579 15.626 1.00 0.00 H ATOM 1090 N HIS A 69 23.649 41.938 13.705 1.00 35.32 N ATOM 1091 CA HIS A 69 22.583 42.753 13.114 1.00 33.67 C ATOM 1092 C HIS A 69 21.336 42.637 13.998 1.00 33.59 C ATOM 1093 O HIS A 69 20.808 41.538 14.201 1.00 30.88 O ATOM 1094 CB HIS A 69 22.289 42.306 11.666 1.00 32.99 C ATOM 1095 CG HIS A 69 23.398 42.649 10.702 1.00 33.01 C ATOM 1096 ND1 HIS A 69 23.317 43.700 9.820 1.00 33.89 N ATOM 1097 CD2 HIS A 69 24.626 42.116 10.538 1.00 32.92 C ATOM 1098 CE1 HIS A 69 24.447 43.786 9.136 1.00 35.65 C ATOM 1099 NE2 HIS A 69 25.265 42.846 9.570 1.00 33.75 N ATOM 1100 HA HIS A 69 22.897 43.796 13.067 1.00 0.00 H ATOM 1101 HB2 HIS A 69 22.145 41.226 11.659 1.00 0.00 H ATOM 1102 HB3 HIS A 69 21.374 42.795 11.331 1.00 0.00 H ATOM 1103 HD2 HIS A 69 25.035 41.261 11.077 1.00 0.00 H ATOM 1104 HE1 HIS A 69 24.664 44.509 8.350 1.00 0.00 H ATOM 1105 H HIS A 69 23.736 40.936 13.440 1.00 0.00 H ATOM 1106 N LYS A 70 20.845 43.774 14.490 1.00 32.03 N ATOM 1107 CA LYS A 70 19.629 43.801 15.264 1.00 33.47 C ATOM 1108 C LYS A 70 18.362 43.773 14.420 1.00 33.06 C ATOM 1109 O LYS A 70 18.279 44.375 13.315 1.00 33.63 O ATOM 1110 CB LYS A 70 19.595 45.048 16.158 1.00 35.43 C ATOM 1111 CG LYS A 70 20.648 44.977 17.256 1.00 38.26 C ATOM 1112 CD LYS A 70 20.890 46.296 17.945 1.00 41.02 C ATOM 1113 CE LYS A 70 20.781 46.120 19.454 1.00 43.25 C ATOM 1114 NZ LYS A 70 21.428 44.839 19.963 1.00 43.49 N ATOM 1115 HA LYS A 70 19.642 42.890 15.862 1.00 0.00 H ATOM 1116 HB2 LYS A 70 19.782 45.929 15.544 1.00 0.00 H ATOM 1117 HB3 LYS A 70 18.610 45.128 16.617 1.00 0.00 H ATOM 1118 HG2 LYS A 70 20.320 44.253 18.002 1.00 0.00 H ATOM 1119 HG3 LYS A 70 21.586 44.642 16.813 1.00 0.00 H ATOM 1120 HD2 LYS A 70 21.887 46.658 17.694 1.00 0.00 H ATOM 1121 HD3 LYS A 70 20.147 47.020 17.611 1.00 0.00 H ATOM 1122 HE2 LYS A 70 19.725 46.105 19.725 1.00 0.00 H ATOM 1123 HE3 LYS A 70 21.267 46.968 19.937 1.00 0.00 H ATOM 1124 HZ1 LYS A 70 20.967 44.019 19.519 1.00 0.00 H ATOM 1125 HZ2 LYS A 70 22.439 44.843 19.721 1.00 0.00 H ATOM 1126 HZ3 LYS A 70 21.317 44.783 20.996 1.00 0.00 H ATOM 1127 H LYS A 70 21.352 44.664 14.311 1.00 0.00 H ATOM 1128 N ALA A 71 17.357 43.079 14.941 1.00 30.07 N ATOM 1129 CA ALA A 71 16.069 42.980 14.265 1.00 28.54 C ATOM 1130 C ALA A 71 14.979 42.693 15.275 1.00 28.77 C ATOM 1131 O ALA A 71 15.269 42.343 16.446 1.00 28.36 O ATOM 1132 CB ALA A 71 16.107 41.922 13.242 1.00 28.17 C ATOM 1133 HA ALA A 71 15.856 43.929 13.773 1.00 0.00 H ATOM 1134 HB1 ALA A 71 16.877 42.156 12.507 1.00 0.00 H ATOM 1135 HB2 ALA A 71 16.334 40.967 13.717 1.00 0.00 H ATOM 1136 HB3 ALA A 71 15.138 41.862 12.747 1.00 0.00 H ATOM 1137 H ALA A 71 17.492 42.595 15.852 1.00 0.00 H ATOM 1138 N ILE A 72 13.738 42.860 14.811 1.00 25.70 N ATOM 1139 CA ILE A 72 12.603 42.464 15.583 1.00 25.87 C ATOM 1140 C ILE A 72 11.617 41.655 14.716 1.00 25.55 C ATOM 1141 O ILE A 72 11.442 41.943 13.526 1.00 23.61 O ATOM 1142 CB ILE A 72 11.948 43.694 16.201 1.00 27.93 C ATOM 1143 CG1 ILE A 72 10.859 43.274 17.177 1.00 27.96 C ATOM 1144 CG2 ILE A 72 11.352 44.540 15.152 1.00 28.65 C ATOM 1145 CD1 ILE A 72 10.340 44.407 18.107 1.00 30.47 C ATOM 1146 HA ILE A 72 12.923 41.812 16.396 1.00 0.00 H ATOM 1147 HB ILE A 72 12.715 44.259 16.730 1.00 0.00 H ATOM 1148 HG12 ILE A 72 10.015 42.896 16.600 1.00 0.00 H ATOM 1149 HG13 ILE A 72 11.256 42.476 17.804 1.00 0.00 H ATOM 1150 HD11 ILE A 72 11.166 44.791 18.705 1.00 0.00 H ATOM 1151 HD12 ILE A 72 9.924 45.211 17.500 1.00 0.00 H ATOM 1152 HD13 ILE A 72 9.567 44.010 18.765 1.00 0.00 H ATOM 1153 HG21 ILE A 72 12.131 44.861 14.460 1.00 0.00 H ATOM 1154 HG22 ILE A 72 10.597 43.969 14.612 1.00 0.00 H ATOM 1155 HG23 ILE A 72 10.889 45.413 15.611 1.00 0.00 H ATOM 1156 H ILE A 72 13.595 43.285 13.873 1.00 0.00 H ATOM 1157 N GLY A 73 10.982 40.648 15.322 1.00 23.12 N ATOM 1158 CA GLY A 73 10.022 39.847 14.591 1.00 23.57 C ATOM 1159 C GLY A 73 9.374 38.782 15.421 1.00 22.92 C ATOM 1160 O GLY A 73 9.631 38.677 16.627 1.00 24.65 O ATOM 1161 HA3 GLY A 73 10.536 39.369 13.757 1.00 0.00 H ATOM 1162 HA2 GLY A 73 9.244 40.507 14.207 1.00 0.00 H ATOM 1163 H GLY A 73 11.178 40.439 16.322 1.00 0.00 H ATOM 1164 N THR A 74 8.495 38.033 14.753 1.00 23.03 N ATOM 1165 CA THR A 74 7.787 36.906 15.327 1.00 22.27 C ATOM 1166 C THR A 74 8.798 35.757 15.415 1.00 20.87 C ATOM 1167 O THR A 74 9.616 35.557 14.517 1.00 22.49 O ATOM 1168 CB THR A 74 6.552 36.570 14.452 1.00 23.29 C ATOM 1169 OG1 THR A 74 5.519 37.564 14.640 1.00 22.43 O ATOM 1170 CG2 THR A 74 5.898 35.287 14.854 1.00 23.83 C ATOM 1171 HA THR A 74 7.399 37.114 16.324 1.00 0.00 H ATOM 1172 HB THR A 74 6.929 36.521 13.430 1.00 0.00 H ATOM 1173 HG1 THR A 74 5.247 37.580 15.592 1.00 0.00 H ATOM 1174 HG23 THR A 74 6.609 34.468 14.744 1.00 0.00 H ATOM 1175 HG21 THR A 74 5.577 35.354 15.893 1.00 0.00 H ATOM 1176 HG22 THR A 74 5.033 35.106 14.216 1.00 0.00 H ATOM 1177 H THR A 74 8.306 38.273 13.759 1.00 0.00 H ATOM 1178 N VAL A 75 8.779 35.062 16.540 1.00 21.10 N ATOM 1179 CA VAL A 75 9.607 33.927 16.766 1.00 20.36 C ATOM 1180 C VAL A 75 8.708 32.826 17.256 1.00 20.66 C ATOM 1181 O VAL A 75 7.956 33.022 18.205 1.00 19.79 O ATOM 1182 CB VAL A 75 10.687 34.226 17.791 1.00 21.83 C ATOM 1183 CG1 VAL A 75 11.479 32.931 18.111 1.00 22.95 C ATOM 1184 CG2 VAL A 75 11.602 35.299 17.218 1.00 22.82 C ATOM 1185 HA VAL A 75 10.119 33.641 15.847 1.00 0.00 H ATOM 1186 HB VAL A 75 10.246 34.585 18.721 1.00 0.00 H ATOM 1187 HG11 VAL A 75 10.798 32.180 18.512 1.00 0.00 H ATOM 1188 HG12 VAL A 75 11.941 32.554 17.198 1.00 0.00 H ATOM 1189 HG13 VAL A 75 12.252 33.152 18.847 1.00 0.00 H ATOM 1190 HG21 VAL A 75 12.052 34.936 16.294 1.00 0.00 H ATOM 1191 HG22 VAL A 75 11.021 36.198 17.012 1.00 0.00 H ATOM 1192 HG23 VAL A 75 12.386 35.529 17.939 1.00 0.00 H ATOM 1193 H VAL A 75 8.128 35.359 17.295 1.00 0.00 H ATOM 1194 N LEU A 76 8.806 31.682 16.584 1.00 19.77 N ATOM 1195 CA LEU A 76 8.085 30.498 16.981 1.00 20.40 C ATOM 1196 C LEU A 76 8.981 29.599 17.801 1.00 21.41 C ATOM 1197 O LEU A 76 10.165 29.408 17.484 1.00 21.21 O ATOM 1198 CB LEU A 76 7.509 29.728 15.764 1.00 19.53 C ATOM 1199 CG LEU A 76 6.888 30.558 14.643 1.00 21.06 C ATOM 1200 CD1 LEU A 76 6.534 29.725 13.392 1.00 19.95 C ATOM 1201 CD2 LEU A 76 5.713 31.284 15.229 1.00 19.45 C ATOM 1202 HA LEU A 76 7.238 30.815 17.589 1.00 0.00 H ATOM 1203 HB2 LEU A 76 8.322 29.146 15.330 1.00 0.00 H ATOM 1204 HB3 LEU A 76 6.739 29.053 16.137 1.00 0.00 H ATOM 1205 HG LEU A 76 7.615 31.277 14.265 1.00 0.00 H ATOM 1206 HD21 LEU A 76 4.995 30.560 15.614 1.00 0.00 H ATOM 1207 HD22 LEU A 76 6.053 31.927 16.041 1.00 0.00 H ATOM 1208 HD23 LEU A 76 5.240 31.891 14.457 1.00 0.00 H ATOM 1209 HD11 LEU A 76 7.439 29.263 12.997 1.00 0.00 H ATOM 1210 HD12 LEU A 76 5.817 28.950 13.664 1.00 0.00 H ATOM 1211 HD13 LEU A 76 6.097 30.376 12.635 1.00 0.00 H ATOM 1212 H LEU A 76 9.421 31.640 15.747 1.00 0.00 H ATOM 1213 N VAL A 77 8.360 28.950 18.790 1.00 22.33 N ATOM 1214 CA VAL A 77 9.079 28.094 19.700 1.00 22.34 C ATOM 1215 C VAL A 77 8.419 26.735 19.778 1.00 22.47 C ATOM 1216 O VAL A 77 7.226 26.652 19.978 1.00 21.61 O ATOM 1217 CB VAL A 77 9.162 28.748 21.103 1.00 22.08 C ATOM 1218 CG1 VAL A 77 9.881 27.847 22.061 1.00 24.08 C ATOM 1219 CG2 VAL A 77 9.834 30.084 21.015 1.00 21.47 C ATOM 1220 HA VAL A 77 10.094 27.959 19.326 1.00 0.00 H ATOM 1221 HB VAL A 77 8.150 28.900 21.479 1.00 0.00 H ATOM 1222 HG11 VAL A 77 9.344 26.902 22.142 1.00 0.00 H ATOM 1223 HG12 VAL A 77 10.891 27.662 21.696 1.00 0.00 H ATOM 1224 HG13 VAL A 77 9.929 28.324 23.040 1.00 0.00 H ATOM 1225 HG21 VAL A 77 10.842 29.957 20.621 1.00 0.00 H ATOM 1226 HG22 VAL A 77 9.263 30.734 20.352 1.00 0.00 H ATOM 1227 HG23 VAL A 77 9.884 30.530 22.008 1.00 0.00 H ATOM 1228 H VAL A 77 7.333 29.065 18.906 1.00 0.00 H ATOM 1229 N GLY A 78 9.198 25.682 19.556 1.00 22.04 N ATOM 1230 CA GLY A 78 8.646 24.348 19.646 1.00 22.96 C ATOM 1231 C GLY A 78 9.678 23.282 19.334 1.00 23.50 C ATOM 1232 O GLY A 78 10.890 23.584 19.228 1.00 24.39 O ATOM 1233 HA3 GLY A 78 7.823 24.259 18.937 1.00 0.00 H ATOM 1234 HA2 GLY A 78 8.271 24.190 20.657 1.00 0.00 H ATOM 1235 H GLY A 78 10.202 25.816 19.318 1.00 0.00 H ATOM 1236 N PRO A 79 9.224 22.042 19.123 1.00 24.11 N ATOM 1237 CA PRO A 79 10.167 20.933 18.916 1.00 25.68 C ATOM 1238 C PRO A 79 10.776 20.820 17.479 1.00 25.98 C ATOM 1239 O PRO A 79 10.728 19.770 16.784 1.00 25.61 O ATOM 1240 CB PRO A 79 9.323 19.702 19.281 1.00 24.36 C ATOM 1241 CG PRO A 79 7.901 20.110 18.955 1.00 25.53 C ATOM 1242 CD PRO A 79 7.827 21.571 19.136 1.00 24.62 C ATOM 1243 HA PRO A 79 11.064 21.066 19.520 1.00 0.00 H ATOM 1244 HD3 PRO A 79 7.263 22.028 18.322 1.00 0.00 H ATOM 1245 HD2 PRO A 79 7.352 21.814 20.087 1.00 0.00 H ATOM 1246 HG3 PRO A 79 7.203 19.612 19.628 1.00 0.00 H ATOM 1247 HG2 PRO A 79 7.661 19.846 17.925 1.00 0.00 H ATOM 1248 HB2 PRO A 79 9.623 18.839 18.687 1.00 0.00 H ATOM 1249 HB3 PRO A 79 9.424 19.465 20.340 1.00 0.00 H ATOM 1250 N THR A 80 11.399 21.910 17.035 1.00 26.24 N ATOM 1251 CA THR A 80 12.080 21.912 15.758 1.00 25.22 C ATOM 1252 C THR A 80 13.413 21.113 15.941 1.00 25.31 C ATOM 1253 O THR A 80 14.058 21.205 16.988 1.00 26.77 O ATOM 1254 CB THR A 80 12.298 23.327 15.255 1.00 25.29 C ATOM 1255 OG1 THR A 80 13.069 23.305 14.057 1.00 25.49 O ATOM 1256 CG2 THR A 80 13.079 24.214 16.252 1.00 23.90 C ATOM 1257 HA THR A 80 11.476 21.428 14.990 1.00 0.00 H ATOM 1258 HB THR A 80 11.301 23.741 15.105 1.00 0.00 H ATOM 1259 HG1 THR A 80 13.947 22.884 14.238 1.00 0.00 H ATOM 1260 HG23 THR A 80 12.533 24.268 17.194 1.00 0.00 H ATOM 1261 HG21 THR A 80 14.064 23.782 16.426 1.00 0.00 H ATOM 1262 HG22 THR A 80 13.189 25.216 15.836 1.00 0.00 H ATOM 1263 H THR A 80 11.396 22.773 17.615 1.00 0.00 H ATOM 1264 N PRO A 81 13.800 20.338 14.931 1.00 25.38 N ATOM 1265 CA PRO A 81 15.077 19.611 14.954 1.00 27.70 C ATOM 1266 C PRO A 81 16.360 20.509 15.047 1.00 27.95 C ATOM 1267 O PRO A 81 17.362 20.154 15.616 1.00 27.35 O ATOM 1268 CB PRO A 81 15.007 18.744 13.672 1.00 28.04 C ATOM 1269 CG PRO A 81 13.534 18.703 13.310 1.00 28.35 C ATOM 1270 CD PRO A 81 12.983 20.009 13.741 1.00 28.06 C ATOM 1271 HA PRO A 81 15.189 19.022 15.864 1.00 0.00 H ATOM 1272 HD3 PRO A 81 13.104 20.762 12.962 1.00 0.00 H ATOM 1273 HD2 PRO A 81 11.928 19.923 14.001 1.00 0.00 H ATOM 1274 HG3 PRO A 81 13.035 17.887 13.834 1.00 0.00 H ATOM 1275 HG2 PRO A 81 13.409 18.573 12.235 1.00 0.00 H ATOM 1276 HB2 PRO A 81 15.587 19.198 12.869 1.00 0.00 H ATOM 1277 HB3 PRO A 81 15.383 17.740 13.867 1.00 0.00 H ATOM 1278 N VAL A 82 16.288 21.721 14.533 1.00 27.64 N ATOM 1279 CA VAL A 82 17.417 22.653 14.571 1.00 27.63 C ATOM 1280 C VAL A 82 16.838 24.095 14.619 1.00 26.07 C ATOM 1281 O VAL A 82 15.731 24.350 14.102 1.00 24.59 O ATOM 1282 CB VAL A 82 18.324 22.487 13.313 1.00 31.57 C ATOM 1283 CG1 VAL A 82 17.638 22.905 12.038 1.00 32.46 C ATOM 1284 CG2 VAL A 82 19.653 23.276 13.425 1.00 33.12 C ATOM 1285 HA VAL A 82 18.032 22.451 15.448 1.00 0.00 H ATOM 1286 HB VAL A 82 18.538 21.419 13.274 1.00 0.00 H ATOM 1287 HG11 VAL A 82 16.747 22.295 11.889 1.00 0.00 H ATOM 1288 HG12 VAL A 82 17.353 23.955 12.107 1.00 0.00 H ATOM 1289 HG13 VAL A 82 18.319 22.767 11.198 1.00 0.00 H ATOM 1290 HG21 VAL A 82 19.435 24.338 13.542 1.00 0.00 H ATOM 1291 HG22 VAL A 82 20.213 22.921 14.290 1.00 0.00 H ATOM 1292 HG23 VAL A 82 20.242 23.123 12.521 1.00 0.00 H ATOM 1293 H VAL A 82 15.400 22.025 14.086 1.00 0.00 H ATOM 1294 N ASN A 83 17.623 25.026 15.128 1.00 23.53 N ATOM 1295 CA ASN A 83 17.180 26.419 15.174 1.00 23.45 C ATOM 1296 C ASN A 83 17.221 26.979 13.732 1.00 22.34 C ATOM 1297 O ASN A 83 18.224 26.802 13.010 1.00 23.48 O ATOM 1298 CB ASN A 83 18.043 27.226 16.095 1.00 24.47 C ATOM 1299 CG ASN A 83 17.898 26.816 17.609 1.00 25.09 C ATOM 1300 OD1 ASN A 83 16.859 26.362 18.056 1.00 26.93 O ATOM 1301 ND2 ASN A 83 18.987 26.960 18.350 1.00 26.18 N ATOM 1302 HA ASN A 83 16.164 26.477 15.565 1.00 0.00 H ATOM 1303 HB2 ASN A 83 19.084 27.093 15.799 1.00 0.00 H ATOM 1304 HB3 ASN A 83 17.769 28.276 15.994 1.00 0.00 H ATOM 1305 HD22 ASN A 83 19.854 27.352 17.930 1.00 0.00 H ATOM 1306 HD21 ASN A 83 18.975 26.681 19.352 1.00 0.00 H ATOM 1307 H ASN A 83 18.560 24.768 15.498 1.00 0.00 H ATOM 1308 N ILE A 84 16.149 27.634 13.310 1.00 20.96 N ATOM 1309 CA ILE A 84 16.022 28.155 11.960 1.00 20.73 C ATOM 1310 C ILE A 84 15.721 29.651 11.965 1.00 20.80 C ATOM 1311 O ILE A 84 14.769 30.101 12.638 1.00 20.84 O ATOM 1312 CB ILE A 84 14.864 27.394 11.264 1.00 23.43 C ATOM 1313 CG1 ILE A 84 15.252 25.967 10.971 1.00 25.12 C ATOM 1314 CG2 ILE A 84 14.406 28.086 9.955 1.00 24.95 C ATOM 1315 CD1 ILE A 84 14.021 25.033 10.831 1.00 27.19 C ATOM 1316 HA ILE A 84 16.963 28.011 11.429 1.00 0.00 H ATOM 1317 HB ILE A 84 14.026 27.405 11.961 1.00 0.00 H ATOM 1318 HG12 ILE A 84 15.817 25.942 10.039 1.00 0.00 H ATOM 1319 HG13 ILE A 84 15.878 25.601 11.784 1.00 0.00 H ATOM 1320 HD11 ILE A 84 13.452 25.042 11.761 1.00 0.00 H ATOM 1321 HD12 ILE A 84 13.391 25.385 10.014 1.00 0.00 H ATOM 1322 HD13 ILE A 84 14.359 24.018 10.620 1.00 0.00 H ATOM 1323 HG21 ILE A 84 14.060 29.095 10.181 1.00 0.00 H ATOM 1324 HG22 ILE A 84 15.244 28.135 9.259 1.00 0.00 H ATOM 1325 HG23 ILE A 84 13.594 27.513 9.508 1.00 0.00 H ATOM 1326 H ILE A 84 15.363 27.782 13.975 1.00 0.00 H ATOM 1327 N ILE A 85 16.541 30.436 11.274 1.00 18.70 N ATOM 1328 CA ILE A 85 16.244 31.811 11.024 1.00 20.11 C ATOM 1329 C ILE A 85 15.600 31.888 9.646 1.00 18.96 C ATOM 1330 O ILE A 85 16.212 31.555 8.655 1.00 20.33 O ATOM 1331 CB ILE A 85 17.456 32.652 11.027 1.00 21.43 C ATOM 1332 CG1 ILE A 85 18.160 32.598 12.369 1.00 22.95 C ATOM 1333 CG2 ILE A 85 17.167 34.084 10.583 1.00 21.52 C ATOM 1334 CD1 ILE A 85 17.339 32.869 13.550 1.00 24.72 C ATOM 1335 HA ILE A 85 15.588 32.181 11.812 1.00 0.00 H ATOM 1336 HB ILE A 85 18.140 32.237 10.287 1.00 0.00 H ATOM 1337 HG12 ILE A 85 18.583 31.600 12.481 1.00 0.00 H ATOM 1338 HG13 ILE A 85 18.966 33.332 12.350 1.00 0.00 H ATOM 1339 HD11 ILE A 85 16.917 33.871 13.475 1.00 0.00 H ATOM 1340 HD12 ILE A 85 16.533 32.137 13.607 1.00 0.00 H ATOM 1341 HD13 ILE A 85 17.958 32.800 14.445 1.00 0.00 H ATOM 1342 HG21 ILE A 85 16.764 34.075 9.570 1.00 0.00 H ATOM 1343 HG22 ILE A 85 16.441 34.534 11.260 1.00 0.00 H ATOM 1344 HG23 ILE A 85 18.091 34.662 10.602 1.00 0.00 H ATOM 1345 H ILE A 85 17.427 30.037 10.903 1.00 0.00 H ATOM 1346 N GLY A 86 14.361 32.332 9.613 1.00 19.01 N ATOM 1347 CA GLY A 86 13.596 32.334 8.376 1.00 18.58 C ATOM 1348 C GLY A 86 13.511 33.647 7.725 1.00 17.99 C ATOM 1349 O GLY A 86 14.128 34.612 8.184 1.00 18.76 O ATOM 1350 HA3 GLY A 86 12.584 31.996 8.599 1.00 0.00 H ATOM 1351 HA2 GLY A 86 14.066 31.637 7.682 1.00 0.00 H ATOM 1352 H GLY A 86 13.922 32.687 10.486 1.00 0.00 H ATOM 1353 N ARG A 87 12.729 33.713 6.638 1.00 19.38 N ATOM 1354 CA ARG A 87 12.671 34.918 5.838 1.00 19.24 C ATOM 1355 C ARG A 87 12.161 36.138 6.616 1.00 21.46 C ATOM 1356 O ARG A 87 12.652 37.220 6.392 1.00 21.55 O ATOM 1357 CB ARG A 87 11.861 34.758 4.534 1.00 19.39 C ATOM 1358 CG ARG A 87 12.483 33.776 3.537 1.00 19.47 C ATOM 1359 CD ARG A 87 11.772 33.730 2.210 1.00 19.89 C ATOM 1360 NE ARG A 87 10.403 33.286 2.383 1.00 19.29 N ATOM 1361 CZ ARG A 87 9.341 34.078 2.380 1.00 19.88 C ATOM 1362 NH1 ARG A 87 8.162 33.537 2.574 1.00 21.47 N ATOM 1363 NH2 ARG A 87 9.443 35.395 2.266 1.00 18.83 N ATOM 1364 HA ARG A 87 13.711 35.097 5.565 1.00 0.00 H ATOM 1365 HB2 ARG A 87 10.863 34.402 4.790 1.00 0.00 H ATOM 1366 HB3 ARG A 87 11.785 35.734 4.054 1.00 0.00 H ATOM 1367 HG2 ARG A 87 13.518 34.071 3.363 1.00 0.00 H ATOM 1368 HG3 ARG A 87 12.459 32.778 3.975 1.00 0.00 H ATOM 1369 HD2 ARG A 87 12.293 33.039 1.547 1.00 0.00 H ATOM 1370 HD3 ARG A 87 11.773 34.726 1.767 1.00 0.00 H ATOM 1371 HE ARG A 87 10.242 32.268 2.520 1.00 0.00 H ATOM 1372 HH12 ARG A 87 7.310 34.134 2.577 1.00 0.00 H ATOM 1373 HH11 ARG A 87 8.079 32.511 2.725 1.00 0.00 H ATOM 1374 HH22 ARG A 87 8.587 35.985 2.268 1.00 0.00 H ATOM 1375 HH21 ARG A 87 10.379 35.838 2.175 1.00 0.00 H ATOM 1376 H ARG A 87 12.157 32.888 6.366 1.00 0.00 H ATOM 1377 N ASN A 88 11.227 35.951 7.553 1.00 20.02 N ATOM 1378 CA ASN A 88 10.731 37.086 8.323 1.00 21.69 C ATOM 1379 C ASN A 88 11.828 37.881 8.974 1.00 22.74 C ATOM 1380 O ASN A 88 11.614 39.055 9.241 1.00 23.64 O ATOM 1381 CB ASN A 88 9.691 36.662 9.372 1.00 20.54 C ATOM 1382 CG ASN A 88 10.283 35.944 10.531 1.00 21.40 C ATOM 1383 OD1 ASN A 88 11.001 34.973 10.358 1.00 21.01 O ATOM 1384 ND2 ASN A 88 10.033 36.452 11.751 1.00 19.02 N ATOM 1385 HA ASN A 88 10.244 37.736 7.596 1.00 0.00 H ATOM 1386 HB2 ASN A 88 9.186 37.555 9.739 1.00 0.00 H ATOM 1387 HB3 ASN A 88 8.964 36.006 8.893 1.00 0.00 H ATOM 1388 HD22 ASN A 88 9.414 37.282 11.852 1.00 0.00 H ATOM 1389 HD21 ASN A 88 10.458 36.015 12.593 1.00 0.00 H ATOM 1390 H ASN A 88 10.854 34.997 7.733 1.00 0.00 H ATOM 1391 N LEU A 89 12.963 37.241 9.310 1.00 21.93 N ATOM 1392 CA LEU A 89 14.071 37.923 9.948 1.00 21.73 C ATOM 1393 C LEU A 89 15.261 38.142 9.007 1.00 21.56 C ATOM 1394 O LEU A 89 15.983 39.174 9.140 1.00 23.76 O ATOM 1395 CB LEU A 89 14.533 37.213 11.219 1.00 22.69 C ATOM 1396 CG LEU A 89 13.578 37.236 12.414 1.00 24.95 C ATOM 1397 CD1 LEU A 89 14.202 36.486 13.575 1.00 26.51 C ATOM 1398 CD2 LEU A 89 13.336 38.608 12.762 1.00 24.84 C ATOM 1399 HA LEU A 89 13.682 38.904 10.223 1.00 0.00 H ATOM 1400 HB2 LEU A 89 14.717 36.169 10.965 1.00 0.00 H ATOM 1401 HB3 LEU A 89 15.467 37.678 11.535 1.00 0.00 H ATOM 1402 HG LEU A 89 12.634 36.751 12.167 1.00 0.00 H ATOM 1403 HD21 LEU A 89 14.279 39.087 13.024 1.00 0.00 H ATOM 1404 HD22 LEU A 89 12.889 39.124 11.912 1.00 0.00 H ATOM 1405 HD23 LEU A 89 12.656 38.651 13.613 1.00 0.00 H ATOM 1406 HD11 LEU A 89 14.391 35.454 13.280 1.00 0.00 H ATOM 1407 HD12 LEU A 89 15.142 36.964 13.851 1.00 0.00 H ATOM 1408 HD13 LEU A 89 13.520 36.503 14.425 1.00 0.00 H ATOM 1409 H LEU A 89 13.048 36.225 9.105 1.00 0.00 H ATOM 1410 N LEU A 90 15.483 37.207 8.074 1.00 20.57 N ATOM 1411 CA LEU A 90 16.549 37.426 7.064 1.00 19.99 C ATOM 1412 C LEU A 90 16.384 38.778 6.314 1.00 19.78 C ATOM 1413 O LEU A 90 17.373 39.501 6.077 1.00 20.45 O ATOM 1414 CB LEU A 90 16.598 36.253 6.084 1.00 20.33 C ATOM 1415 CG LEU A 90 16.949 34.866 6.672 1.00 19.45 C ATOM 1416 CD1 LEU A 90 16.895 33.776 5.584 1.00 20.54 C ATOM 1417 CD2 LEU A 90 18.314 34.886 7.260 1.00 19.87 C ATOM 1418 HA LEU A 90 17.499 37.480 7.595 1.00 0.00 H ATOM 1419 HB2 LEU A 90 15.617 36.174 5.615 1.00 0.00 H ATOM 1420 HB3 LEU A 90 17.344 36.488 5.325 1.00 0.00 H ATOM 1421 HG LEU A 90 16.215 34.639 7.445 1.00 0.00 H ATOM 1422 HD21 LEU A 90 19.038 35.139 6.486 1.00 0.00 H ATOM 1423 HD22 LEU A 90 18.355 35.631 8.055 1.00 0.00 H ATOM 1424 HD23 LEU A 90 18.546 33.903 7.670 1.00 0.00 H ATOM 1425 HD11 LEU A 90 15.890 33.734 5.163 1.00 0.00 H ATOM 1426 HD12 LEU A 90 17.611 34.014 4.797 1.00 0.00 H ATOM 1427 HD13 LEU A 90 17.146 32.811 6.025 1.00 0.00 H ATOM 1428 H LEU A 90 14.914 36.336 8.057 1.00 0.00 H ATOM 1429 N THR A 91 15.154 39.147 5.965 1.00 19.38 N ATOM 1430 CA THR A 91 14.940 40.420 5.272 1.00 20.34 C ATOM 1431 C THR A 91 15.495 41.579 6.102 1.00 21.44 C ATOM 1432 O THR A 91 15.983 42.552 5.551 1.00 21.61 O ATOM 1433 CB THR A 91 13.487 40.733 5.024 1.00 22.58 C ATOM 1434 OG1 THR A 91 12.731 40.649 6.244 1.00 22.17 O ATOM 1435 CG2 THR A 91 12.808 39.702 4.071 1.00 22.01 C ATOM 1436 HA THR A 91 15.452 40.312 4.316 1.00 0.00 H ATOM 1437 HB THR A 91 13.484 41.733 4.590 1.00 0.00 H ATOM 1438 HG1 THR A 91 11.781 40.858 6.058 1.00 0.00 H ATOM 1439 HG23 THR A 91 13.325 39.701 3.111 1.00 0.00 H ATOM 1440 HG21 THR A 91 12.862 38.708 4.515 1.00 0.00 H ATOM 1441 HG22 THR A 91 11.764 39.979 3.923 1.00 0.00 H ATOM 1442 H THR A 91 14.345 38.532 6.184 1.00 0.00 H ATOM 1443 N GLN A 92 15.277 41.513 7.424 1.00 22.44 N ATOM 1444 CA GLN A 92 15.553 42.641 8.304 1.00 22.02 C ATOM 1445 C GLN A 92 17.019 42.924 8.396 1.00 24.00 C ATOM 1446 O GLN A 92 17.446 44.062 8.643 1.00 24.09 O ATOM 1447 CB GLN A 92 14.904 42.402 9.678 1.00 20.74 C ATOM 1448 CG GLN A 92 13.387 42.235 9.596 1.00 20.73 C ATOM 1449 CD GLN A 92 12.653 43.451 9.070 1.00 21.10 C ATOM 1450 OE1 GLN A 92 12.502 44.461 9.780 1.00 22.96 O ATOM 1451 NE2 GLN A 92 12.232 43.382 7.830 1.00 23.68 N ATOM 1452 HA GLN A 92 15.106 43.539 7.878 1.00 0.00 H ATOM 1453 HB2 GLN A 92 15.331 41.498 10.113 1.00 0.00 H ATOM 1454 HB3 GLN A 92 15.127 43.253 10.321 1.00 0.00 H ATOM 1455 HG2 GLN A 92 13.171 41.394 8.937 1.00 0.00 H ATOM 1456 HG3 GLN A 92 13.013 42.016 10.596 1.00 0.00 H ATOM 1457 HE22 GLN A 92 12.383 42.514 7.277 1.00 0.00 H ATOM 1458 HE21 GLN A 92 11.748 44.195 7.399 1.00 0.00 H ATOM 1459 H GLN A 92 14.901 40.633 7.832 1.00 0.00 H ATOM 1460 N ILE A 93 17.841 41.906 8.166 1.00 25.53 N ATOM 1461 CA ILE A 93 19.291 42.076 8.307 1.00 27.12 C ATOM 1462 C ILE A 93 19.914 42.295 6.943 1.00 26.05 C ATOM 1463 O ILE A 93 21.138 42.366 6.787 1.00 24.48 O ATOM 1464 CB ILE A 93 19.944 40.856 9.007 1.00 27.50 C ATOM 1465 CG1 ILE A 93 19.890 39.592 8.137 1.00 28.08 C ATOM 1466 CG2 ILE A 93 19.291 40.631 10.372 1.00 27.77 C ATOM 1467 CD1 ILE A 93 20.729 38.523 8.709 1.00 28.31 C ATOM 1468 HA ILE A 93 19.471 42.949 8.934 1.00 0.00 H ATOM 1469 HB ILE A 93 21.001 41.076 9.157 1.00 0.00 H ATOM 1470 HG12 ILE A 93 18.859 39.243 8.077 1.00 0.00 H ATOM 1471 HG13 ILE A 93 20.250 39.832 7.136 1.00 0.00 H ATOM 1472 HD11 ILE A 93 21.762 38.865 8.767 1.00 0.00 H ATOM 1473 HD12 ILE A 93 20.370 38.277 9.708 1.00 0.00 H ATOM 1474 HD13 ILE A 93 20.673 37.639 8.073 1.00 0.00 H ATOM 1475 HG21 ILE A 93 19.429 41.518 10.990 1.00 0.00 H ATOM 1476 HG22 ILE A 93 18.226 40.442 10.237 1.00 0.00 H ATOM 1477 HG23 ILE A 93 19.755 39.773 10.858 1.00 0.00 H ATOM 1478 H ILE A 93 17.454 40.983 7.884 1.00 0.00 H ATOM 1479 N GLY A 94 19.044 42.353 5.941 1.00 25.71 N ATOM 1480 CA GLY A 94 19.474 42.700 4.599 1.00 25.44 C ATOM 1481 C GLY A 94 20.075 41.538 3.843 1.00 25.71 C ATOM 1482 O GLY A 94 20.935 41.734 2.953 1.00 26.87 O ATOM 1483 HA3 GLY A 94 20.221 43.491 4.669 1.00 0.00 H ATOM 1484 HA2 GLY A 94 18.611 43.065 4.043 1.00 0.00 H ATOM 1485 H GLY A 94 18.041 42.147 6.121 1.00 0.00 H ATOM 1486 N CYS A 95 19.639 40.336 4.181 1.00 22.53 N ATOM 1487 CA CYS A 95 20.256 39.103 3.649 1.00 21.06 C ATOM 1488 C CYS A 95 19.646 38.821 2.281 1.00 21.34 C ATOM 1489 O CYS A 95 18.418 38.851 2.091 1.00 24.02 O ATOM 1490 CB CYS A 95 20.106 37.951 4.649 1.00 23.05 C ATOM 1491 SG CYS A 95 20.818 36.347 4.073 1.00 24.15 S ATOM 1492 HA CYS A 95 21.331 39.223 3.514 1.00 0.00 H ATOM 1493 HB2 CYS A 95 19.044 37.803 4.843 1.00 0.00 H ATOM 1494 HB3 CYS A 95 20.607 38.235 5.575 1.00 0.00 H ATOM 1495 HG CYS A 95 20.628 35.386 5.045 1.00 0.00 H ATOM 1496 H CYS A 95 18.839 40.256 4.840 1.00 0.00 H ATOM 1497 N THR A 96 20.495 38.637 1.267 1.00 23.86 N ATOM 1498 CA THR A 96 20.024 38.181 -0.044 1.00 21.21 C ATOM 1499 C THR A 96 20.786 36.977 -0.543 1.00 22.76 C ATOM 1500 O THR A 96 21.828 36.597 0.000 1.00 23.70 O ATOM 1501 CB THR A 96 20.170 39.288 -1.090 1.00 23.49 C ATOM 1502 OG1 THR A 96 21.553 39.666 -1.191 1.00 24.69 O ATOM 1503 CG2 THR A 96 19.325 40.535 -0.693 1.00 23.94 C ATOM 1504 HA THR A 96 18.977 37.911 0.092 1.00 0.00 H ATOM 1505 HB THR A 96 19.812 38.913 -2.049 1.00 0.00 H ATOM 1506 HG1 THR A 96 22.090 38.880 -1.462 1.00 0.00 H ATOM 1507 HG23 THR A 96 18.275 40.251 -0.616 1.00 0.00 H ATOM 1508 HG21 THR A 96 19.671 40.916 0.268 1.00 0.00 H ATOM 1509 HG22 THR A 96 19.439 41.307 -1.454 1.00 0.00 H ATOM 1510 H THR A 96 21.509 38.821 1.410 1.00 0.00 H ATOM 1511 N LEU A 97 20.198 36.333 -1.543 1.00 20.90 N ATOM 1512 CA LEU A 97 20.853 35.266 -2.298 1.00 23.52 C ATOM 1513 C LEU A 97 21.518 35.878 -3.516 1.00 24.32 C ATOM 1514 O LEU A 97 20.924 36.715 -4.208 1.00 25.65 O ATOM 1515 CB LEU A 97 19.839 34.230 -2.781 1.00 23.46 C ATOM 1516 CG LEU A 97 19.324 33.310 -1.682 1.00 24.03 C ATOM 1517 CD1 LEU A 97 18.055 32.610 -2.167 1.00 25.11 C ATOM 1518 CD2 LEU A 97 20.405 32.253 -1.324 1.00 24.53 C ATOM 1519 HA LEU A 97 21.578 34.776 -1.649 1.00 0.00 H ATOM 1520 HB2 LEU A 97 18.989 34.757 -3.214 1.00 0.00 H ATOM 1521 HB3 LEU A 97 20.313 33.617 -3.548 1.00 0.00 H ATOM 1522 HG LEU A 97 19.100 33.898 -0.792 1.00 0.00 H ATOM 1523 HD21 LEU A 97 20.639 31.660 -2.208 1.00 0.00 H ATOM 1524 HD22 LEU A 97 21.305 32.759 -0.976 1.00 0.00 H ATOM 1525 HD23 LEU A 97 20.027 31.600 -0.537 1.00 0.00 H ATOM 1526 HD11 LEU A 97 17.298 33.357 -2.405 1.00 0.00 H ATOM 1527 HD12 LEU A 97 18.282 32.025 -3.058 1.00 0.00 H ATOM 1528 HD13 LEU A 97 17.683 31.950 -1.383 1.00 0.00 H ATOM 1529 H LEU A 97 19.227 36.599 -1.802 1.00 0.00 H ATOM 1530 N ASN A 98 22.733 35.457 -3.799 1.00 26.29 N ATOM 1531 CA ASN A 98 23.448 35.999 -4.968 1.00 24.71 C ATOM 1532 C ASN A 98 24.183 34.908 -5.739 1.00 26.00 C ATOM 1533 O ASN A 98 24.846 34.084 -5.138 1.00 21.91 O ATOM 1534 CB ASN A 98 24.439 37.050 -4.497 1.00 26.50 C ATOM 1535 CG ASN A 98 23.770 38.196 -3.829 1.00 28.39 C ATOM 1536 OD1 ASN A 98 23.373 38.138 -2.642 1.00 28.18 O ATOM 1537 ND2 ASN A 98 23.592 39.236 -4.583 1.00 28.93 N ATOM 1538 HA ASN A 98 22.715 36.441 -5.643 1.00 0.00 H ATOM 1539 HB2 ASN A 98 25.131 36.589 -3.793 1.00 0.00 H ATOM 1540 HB3 ASN A 98 24.993 37.421 -5.359 1.00 0.00 H ATOM 1541 HD22 ASN A 98 23.941 39.234 -5.563 1.00 0.00 H ATOM 1542 HD21 ASN A 98 23.100 40.072 -4.208 1.00 0.00 H ATOM 1543 H ASN A 98 23.188 34.741 -3.197 1.00 0.00 H ATOM 1544 N PHE A 99 24.051 34.941 -7.063 1.00 29.37 N ATOM 1545 CA PHE A 99 24.784 34.044 -7.994 1.00 30.64 C ATOM 1546 C PHE A 99 24.824 34.631 -9.414 1.00 33.70 C ATOM 1547 O PHE A 99 25.365 33.952 -10.299 1.00 33.18 O ATOM 1548 CB PHE A 99 24.194 32.635 -8.056 1.00 30.40 C ATOM 1549 CG PHE A 99 22.750 32.575 -8.465 1.00 33.01 C ATOM 1550 CD1 PHE A 99 22.385 32.089 -9.726 1.00 33.86 C ATOM 1551 CD2 PHE A 99 21.731 32.950 -7.577 1.00 33.14 C ATOM 1552 CE1 PHE A 99 21.042 31.982 -10.085 1.00 36.04 C ATOM 1553 CE2 PHE A 99 20.398 32.885 -7.967 1.00 33.43 C ATOM 1554 CZ PHE A 99 20.060 32.401 -9.213 1.00 33.78 C ATOM 1555 HA PHE A 99 25.795 33.968 -7.594 1.00 0.00 H ATOM 1556 OXT PHE A 99 24.265 35.720 -9.618 1.00 32.66 O ATOM 1557 HB2 PHE A 99 24.774 32.055 -8.774 1.00 0.00 H ATOM 1558 HB3 PHE A 99 24.286 32.185 -7.068 1.00 0.00 H ATOM 1559 HD2 PHE A 99 21.986 33.295 -6.575 1.00 0.00 H ATOM 1560 HE2 PHE A 99 19.616 33.218 -7.284 1.00 0.00 H ATOM 1561 HZ PHE A 99 19.012 32.349 -9.510 1.00 0.00 H ATOM 1562 HE1 PHE A 99 20.769 31.567 -11.055 1.00 0.00 H ATOM 1563 HD1 PHE A 99 23.158 31.791 -10.434 1.00 0.00 H ATOM 1564 H PHE A 99 23.395 35.637 -7.471 1.00 0.00 H TER 1565 PHE A 99 ATOM 1566 N PRO B 1 22.045 36.807 -10.534 1.00 37.44 N ATOM 1567 CA PRO B 1 21.099 37.821 -9.973 1.00 36.50 C ATOM 1568 C PRO B 1 21.164 37.945 -8.454 1.00 34.70 C ATOM 1569 O PRO B 1 21.842 37.180 -7.773 1.00 32.17 O ATOM 1570 CB PRO B 1 19.728 37.290 -10.395 1.00 37.60 C ATOM 1571 CG PRO B 1 19.921 35.849 -10.515 1.00 38.18 C ATOM 1572 CD PRO B 1 21.308 35.724 -11.201 1.00 38.55 C ATOM 1573 HA PRO B 1 21.333 38.821 -10.338 1.00 0.00 H ATOM 1574 HD3 PRO B 1 21.764 34.752 -11.011 1.00 0.00 H ATOM 1575 HD2 PRO B 1 21.240 35.888 -12.276 1.00 0.00 H ATOM 1576 HG3 PRO B 1 19.140 35.401 -11.130 1.00 0.00 H ATOM 1577 HG2 PRO B 1 19.927 35.374 -9.534 1.00 0.00 H ATOM 1578 HB2 PRO B 1 18.976 37.518 -9.639 1.00 0.00 H ATOM 1579 HB3 PRO B 1 19.424 37.720 -11.349 1.00 0.00 H ATOM 1580 N GLN B 2 20.508 38.974 -7.944 1.00 33.85 N ATOM 1581 CA GLN B 2 20.341 39.161 -6.499 1.00 33.75 C ATOM 1582 C GLN B 2 18.865 38.925 -6.175 1.00 34.15 C ATOM 1583 O GLN B 2 17.972 39.457 -6.846 1.00 34.29 O ATOM 1584 CB GLN B 2 20.791 40.556 -6.058 1.00 35.30 C ATOM 1585 CG GLN B 2 20.559 40.830 -4.556 1.00 35.86 C ATOM 1586 CD GLN B 2 21.371 41.989 -4.022 1.00 37.79 C ATOM 1587 OE1 GLN B 2 20.829 43.079 -3.805 1.00 42.94 O ATOM 1588 NE2 GLN B 2 22.655 41.766 -3.795 1.00 36.96 N ATOM 1589 HA GLN B 2 20.967 38.454 -5.954 1.00 0.00 H ATOM 1590 HB2 GLN B 2 21.856 40.658 -6.268 1.00 0.00 H ATOM 1591 HB3 GLN B 2 20.236 41.296 -6.634 1.00 0.00 H ATOM 1592 HG2 GLN B 2 19.502 41.050 -4.404 1.00 0.00 H ATOM 1593 HG3 GLN B 2 20.827 39.934 -3.996 1.00 0.00 H ATOM 1594 HE22 GLN B 2 23.064 40.831 -3.994 1.00 0.00 H ATOM 1595 HE21 GLN B 2 23.256 42.526 -3.417 1.00 0.00 H ATOM 1596 H GLN B 2 20.096 39.676 -8.591 1.00 0.00 H ATOM 1597 N ILE B 3 18.610 38.030 -5.224 1.00 31.84 N ATOM 1598 CA ILE B 3 17.261 37.662 -4.868 1.00 29.68 C ATOM 1599 C ILE B 3 17.043 38.064 -3.379 1.00 28.45 C ATOM 1600 O ILE B 3 17.759 37.618 -2.514 1.00 25.75 O ATOM 1601 CB ILE B 3 17.023 36.160 -5.114 1.00 29.08 C ATOM 1602 CG1 ILE B 3 17.177 35.846 -6.627 1.00 30.73 C ATOM 1603 CG2 ILE B 3 15.644 35.762 -4.664 1.00 30.18 C ATOM 1604 CD1 ILE B 3 16.941 34.447 -6.980 1.00 31.63 C ATOM 1605 HA ILE B 3 16.535 38.185 -5.491 1.00 0.00 H ATOM 1606 HB ILE B 3 17.759 35.596 -4.542 1.00 0.00 H ATOM 1607 HG12 ILE B 3 16.466 36.462 -7.177 1.00 0.00 H ATOM 1608 HG13 ILE B 3 18.191 36.108 -6.928 1.00 0.00 H ATOM 1609 HD11 ILE B 3 17.653 33.815 -6.449 1.00 0.00 H ATOM 1610 HD12 ILE B 3 15.925 34.169 -6.698 1.00 0.00 H ATOM 1611 HD13 ILE B 3 17.070 34.318 -8.055 1.00 0.00 H ATOM 1612 HG21 ILE B 3 15.537 35.967 -3.599 1.00 0.00 H ATOM 1613 HG22 ILE B 3 14.902 36.334 -5.222 1.00 0.00 H ATOM 1614 HG23 ILE B 3 15.497 34.698 -4.847 1.00 0.00 H ATOM 1615 H ILE B 3 19.405 37.583 -4.724 1.00 0.00 H ATOM 1616 N THR B 4 16.081 38.945 -3.139 1.00 26.57 N ATOM 1617 CA THR B 4 15.692 39.334 -1.805 1.00 26.01 C ATOM 1618 C THR B 4 14.708 38.292 -1.240 1.00 23.40 C ATOM 1619 O THR B 4 14.274 37.393 -1.932 1.00 24.51 O ATOM 1620 CB THR B 4 15.048 40.713 -1.810 1.00 27.54 C ATOM 1621 OG1 THR B 4 13.852 40.696 -2.599 1.00 27.40 O ATOM 1622 CG2 THR B 4 15.954 41.750 -2.455 1.00 28.66 C ATOM 1623 HA THR B 4 16.581 39.379 -1.176 1.00 0.00 H ATOM 1624 HB THR B 4 14.850 40.966 -0.768 1.00 0.00 H ATOM 1625 HG1 THR B 4 13.215 40.041 -2.217 1.00 0.00 H ATOM 1626 HG23 THR B 4 16.888 41.812 -1.897 1.00 0.00 H ATOM 1627 HG21 THR B 4 16.162 41.458 -3.484 1.00 0.00 H ATOM 1628 HG22 THR B 4 15.458 42.721 -2.444 1.00 0.00 H ATOM 1629 H THR B 4 15.586 39.374 -3.947 1.00 0.00 H ATOM 1630 N LEU B 5 14.391 38.411 0.026 1.00 22.47 N ATOM 1631 CA LEU B 5 13.638 37.364 0.718 1.00 21.79 C ATOM 1632 C LEU B 5 12.280 37.814 1.237 1.00 21.65 C ATOM 1633 O LEU B 5 11.714 37.189 2.160 1.00 20.52 O ATOM 1634 CB LEU B 5 14.526 36.779 1.815 1.00 22.58 C ATOM 1635 CG LEU B 5 15.801 36.156 1.232 1.00 22.48 C ATOM 1636 CD1 LEU B 5 16.845 35.843 2.329 1.00 21.09 C ATOM 1637 CD2 LEU B 5 15.403 34.895 0.462 1.00 23.56 C ATOM 1638 HA LEU B 5 13.387 36.589 -0.006 1.00 0.00 H ATOM 1639 HB2 LEU B 5 14.804 37.573 2.508 1.00 0.00 H ATOM 1640 HB3 LEU B 5 13.969 36.011 2.350 1.00 0.00 H ATOM 1641 HG LEU B 5 16.279 36.868 0.559 1.00 0.00 H ATOM 1642 HD21 LEU B 5 14.918 34.194 1.141 1.00 0.00 H ATOM 1643 HD22 LEU B 5 14.714 35.162 -0.339 1.00 0.00 H ATOM 1644 HD23 LEU B 5 16.295 34.434 0.037 1.00 0.00 H ATOM 1645 HD11 LEU B 5 17.119 36.765 2.842 1.00 0.00 H ATOM 1646 HD12 LEU B 5 16.418 35.141 3.045 1.00 0.00 H ATOM 1647 HD13 LEU B 5 17.731 35.403 1.871 1.00 0.00 H ATOM 1648 H LEU B 5 14.679 39.263 0.548 1.00 0.00 H ATOM 1649 N TRP B 6 11.757 38.916 0.667 1.00 21.06 N ATOM 1650 CA TRP B 6 10.429 39.420 1.081 1.00 21.92 C ATOM 1651 C TRP B 6 9.290 38.481 0.658 1.00 22.26 C ATOM 1652 O TRP B 6 8.215 38.458 1.270 1.00 21.71 O ATOM 1653 CB TRP B 6 10.206 40.843 0.538 1.00 21.36 C ATOM 1654 CG TRP B 6 11.271 41.748 0.933 1.00 22.90 C ATOM 1655 CD1 TRP B 6 12.389 42.073 0.208 1.00 23.68 C ATOM 1656 CD2 TRP B 6 11.414 42.413 2.207 1.00 23.18 C ATOM 1657 NE1 TRP B 6 13.212 42.891 0.949 1.00 25.47 N ATOM 1658 CE2 TRP B 6 12.620 43.163 2.152 1.00 24.11 C ATOM 1659 CE3 TRP B 6 10.639 42.469 3.369 1.00 23.65 C ATOM 1660 CZ2 TRP B 6 13.090 43.901 3.217 1.00 24.08 C ATOM 1661 CZ3 TRP B 6 11.090 43.264 4.437 1.00 23.48 C ATOM 1662 CH2 TRP B 6 12.301 43.950 4.354 1.00 23.28 C ATOM 1663 HA TRP B 6 10.416 39.453 2.170 1.00 0.00 H ATOM 1664 HB2 TRP B 6 10.164 40.802 -0.550 1.00 0.00 H ATOM 1665 HB3 TRP B 6 9.260 41.223 0.923 1.00 0.00 H ATOM 1666 HE1 TRP B 6 14.140 43.247 0.642 1.00 0.00 H ATOM 1667 HD1 TRP B 6 12.596 41.733 -0.807 1.00 0.00 H ATOM 1668 HZ2 TRP B 6 14.044 44.425 3.166 1.00 0.00 H ATOM 1669 HH2 TRP B 6 12.636 44.541 5.207 1.00 0.00 H ATOM 1670 HZ3 TRP B 6 10.486 43.345 5.341 1.00 0.00 H ATOM 1671 HE3 TRP B 6 9.707 41.909 3.445 1.00 0.00 H ATOM 1672 H TRP B 6 12.291 39.417 -0.071 1.00 0.00 H ATOM 1673 N GLN B 7 9.564 37.669 -0.364 1.00 21.66 N ATOM 1674 CA GLN B 7 8.685 36.607 -0.805 1.00 24.40 C ATOM 1675 C GLN B 7 9.551 35.372 -0.925 1.00 21.66 C ATOM 1676 O GLN B 7 10.760 35.476 -0.915 1.00 18.31 O ATOM 1677 CB GLN B 7 8.099 36.980 -2.173 1.00 27.94 C ATOM 1678 CG GLN B 7 7.120 38.138 -2.110 1.00 33.38 C ATOM 1679 CD GLN B 7 5.967 37.963 -1.064 1.00 37.54 C ATOM 1680 OE1 GLN B 7 5.518 36.824 -0.776 1.00 40.16 O ATOM 1681 NE2 GLN B 7 5.502 39.111 -0.472 1.00 39.40 N ATOM 1682 HA GLN B 7 7.858 36.440 -0.114 1.00 0.00 H ATOM 1683 HB2 GLN B 7 8.918 37.255 -2.838 1.00 0.00 H ATOM 1684 HB3 GLN B 7 7.581 36.110 -2.577 1.00 0.00 H ATOM 1685 HG2 GLN B 7 7.676 39.040 -1.855 1.00 0.00 H ATOM 1686 HG3 GLN B 7 6.670 38.257 -3.096 1.00 0.00 H ATOM 1687 HE22 GLN B 7 5.902 40.033 -0.740 1.00 0.00 H ATOM 1688 HE21 GLN B 7 4.750 39.059 0.244 1.00 0.00 H ATOM 1689 H GLN B 7 10.460 37.807 -0.873 1.00 0.00 H ATOM 1690 N ARG B 8 8.955 34.209 -1.039 1.00 20.18 N ATOM 1691 CA ARG B 8 9.780 33.001 -1.256 1.00 21.54 C ATOM 1692 C ARG B 8 10.649 33.113 -2.492 1.00 20.16 C ATOM 1693 O ARG B 8 10.200 33.598 -3.547 1.00 18.98 O ATOM 1694 CB ARG B 8 8.895 31.776 -1.434 1.00 23.95 C ATOM 1695 CG ARG B 8 8.099 31.413 -0.243 1.00 24.35 C ATOM 1696 CD ARG B 8 7.396 30.113 -0.392 1.00 27.52 C ATOM 1697 NE ARG B 8 6.695 29.764 0.819 1.00 29.22 N ATOM 1698 CZ ARG B 8 5.955 28.679 0.965 1.00 32.75 C ATOM 1699 NH1 ARG B 8 5.359 28.477 2.100 1.00 32.17 N ATOM 1700 NH2 ARG B 8 5.829 27.771 -0.014 1.00 32.78 N ATOM 1701 HA ARG B 8 10.414 32.905 -0.375 1.00 0.00 H ATOM 1702 HB2 ARG B 8 8.207 31.970 -2.257 1.00 0.00 H ATOM 1703 HB3 ARG B 8 9.533 30.929 -1.688 1.00 0.00 H ATOM 1704 HG2 ARG B 8 8.767 31.351 0.616 1.00 0.00 H ATOM 1705 HG3 ARG B 8 7.357 32.192 -0.070 1.00 0.00 H ATOM 1706 HD2 ARG B 8 8.126 29.336 -0.618 1.00 0.00 H ATOM 1707 HD3 ARG B 8 6.680 30.186 -1.211 1.00 0.00 H ATOM 1708 HE ARG B 8 6.777 30.409 1.631 1.00 0.00 H ATOM 1709 HH12 ARG B 8 4.772 27.629 2.235 1.00 0.00 H ATOM 1710 HH11 ARG B 8 5.468 29.163 2.874 1.00 0.00 H ATOM 1711 HH22 ARG B 8 5.239 26.927 0.132 1.00 0.00 H ATOM 1712 HH21 ARG B 8 6.321 27.911 -0.919 1.00 0.00 H ATOM 1713 H ARG B 8 7.919 34.138 -0.978 1.00 0.00 H ATOM 1714 N PRO B 9 11.889 32.641 -2.391 1.00 20.64 N ATOM 1715 CA PRO B 9 12.799 32.674 -3.551 1.00 22.42 C ATOM 1716 C PRO B 9 12.570 31.501 -4.478 1.00 23.45 C ATOM 1717 O PRO B 9 13.372 30.544 -4.611 1.00 20.74 O ATOM 1718 CB PRO B 9 14.161 32.624 -2.926 1.00 21.48 C ATOM 1719 CG PRO B 9 13.973 31.734 -1.646 1.00 20.26 C ATOM 1720 CD PRO B 9 12.602 32.221 -1.147 1.00 20.13 C ATOM 1721 HA PRO B 9 12.651 33.554 -4.176 1.00 0.00 H ATOM 1722 HD3 PRO B 9 12.064 31.416 -0.645 1.00 0.00 H ATOM 1723 HD2 PRO B 9 12.715 33.062 -0.463 1.00 0.00 H ATOM 1724 HG3 PRO B 9 14.756 31.920 -0.911 1.00 0.00 H ATOM 1725 HG2 PRO B 9 13.955 30.673 -1.895 1.00 0.00 H ATOM 1726 HB2 PRO B 9 14.882 32.172 -3.608 1.00 0.00 H ATOM 1727 HB3 PRO B 9 14.498 33.624 -2.654 1.00 0.00 H ATOM 1728 N LEU B 10 11.453 31.608 -5.145 1.00 22.69 N ATOM 1729 CA LEU B 10 11.029 30.620 -6.102 1.00 24.29 C ATOM 1730 C LEU B 10 11.617 30.939 -7.454 1.00 23.75 C ATOM 1731 O LEU B 10 11.627 32.117 -7.884 1.00 24.92 O ATOM 1732 CB LEU B 10 9.504 30.642 -6.201 1.00 26.97 C ATOM 1733 CG LEU B 10 8.724 30.070 -5.032 1.00 28.77 C ATOM 1734 CD1 LEU B 10 7.302 30.397 -5.243 1.00 31.09 C ATOM 1735 CD2 LEU B 10 8.930 28.522 -4.972 1.00 30.44 C ATOM 1736 HA LEU B 10 11.368 29.635 -5.782 1.00 0.00 H ATOM 1737 HB2 LEU B 10 9.198 31.681 -6.322 1.00 0.00 H ATOM 1738 HB3 LEU B 10 9.225 30.076 -7.090 1.00 0.00 H ATOM 1739 HG LEU B 10 9.068 30.493 -4.088 1.00 0.00 H ATOM 1740 HD21 LEU B 10 8.575 28.073 -5.900 1.00 0.00 H ATOM 1741 HD22 LEU B 10 9.990 28.303 -4.843 1.00 0.00 H ATOM 1742 HD23 LEU B 10 8.369 28.114 -4.131 1.00 0.00 H ATOM 1743 HD11 LEU B 10 7.182 31.479 -5.287 1.00 0.00 H ATOM 1744 HD12 LEU B 10 6.964 29.954 -6.180 1.00 0.00 H ATOM 1745 HD13 LEU B 10 6.712 29.999 -4.417 1.00 0.00 H ATOM 1746 H LEU B 10 10.848 32.437 -4.979 1.00 0.00 H ATOM 1747 N VAL B 11 12.147 29.929 -8.141 1.00 22.81 N ATOM 1748 CA VAL B 11 12.700 30.146 -9.487 1.00 22.26 C ATOM 1749 C VAL B 11 12.224 29.090 -10.455 1.00 22.12 C ATOM 1750 O VAL B 11 11.751 28.058 -10.070 1.00 22.40 O ATOM 1751 CB VAL B 11 14.241 30.169 -9.536 1.00 24.45 C ATOM 1752 CG1 VAL B 11 14.810 31.341 -8.715 1.00 27.67 C ATOM 1753 CG2 VAL B 11 14.805 28.837 -9.046 1.00 25.00 C ATOM 1754 HA VAL B 11 12.335 31.132 -9.774 1.00 0.00 H ATOM 1755 HB VAL B 11 14.546 30.316 -10.572 1.00 0.00 H ATOM 1756 HG11 VAL B 11 14.436 32.282 -9.119 1.00 0.00 H ATOM 1757 HG12 VAL B 11 14.497 31.241 -7.676 1.00 0.00 H ATOM 1758 HG13 VAL B 11 15.898 31.328 -8.771 1.00 0.00 H ATOM 1759 HG21 VAL B 11 14.483 28.663 -8.019 1.00 0.00 H ATOM 1760 HG22 VAL B 11 14.439 28.032 -9.684 1.00 0.00 H ATOM 1761 HG23 VAL B 11 15.894 28.868 -9.086 1.00 0.00 H ATOM 1762 H VAL B 11 12.170 28.977 -7.722 1.00 0.00 H ATOM 1763 N THR B 12 12.389 29.343 -11.745 1.00 20.93 N ATOM 1764 CA THR B 12 12.103 28.331 -12.715 1.00 20.64 C ATOM 1765 C THR B 12 13.306 27.426 -12.918 1.00 22.26 C ATOM 1766 O THR B 12 14.397 27.912 -13.170 1.00 24.95 O ATOM 1767 CB THR B 12 11.736 28.989 -14.014 1.00 23.74 C ATOM 1768 OG1 THR B 12 10.520 29.699 -13.813 1.00 24.29 O ATOM 1769 CG2 THR B 12 11.386 27.978 -15.008 1.00 20.68 C ATOM 1770 HA THR B 12 11.273 27.721 -12.359 1.00 0.00 H ATOM 1771 HB THR B 12 12.572 29.610 -14.334 1.00 0.00 H ATOM 1772 HG1 THR B 12 9.811 29.066 -13.536 1.00 0.00 H ATOM 1773 HG23 THR B 12 12.264 27.373 -15.233 1.00 0.00 H ATOM 1774 HG21 THR B 12 10.595 27.340 -14.613 1.00 0.00 H ATOM 1775 HG22 THR B 12 11.039 28.469 -15.917 1.00 0.00 H ATOM 1776 H THR B 12 12.726 30.277 -12.053 1.00 0.00 H ATOM 1777 N ILE B 13 13.099 26.115 -12.841 1.00 21.12 N ATOM 1778 CA ILE B 13 14.144 25.150 -13.171 1.00 21.84 C ATOM 1779 C ILE B 13 13.679 24.382 -14.387 1.00 24.08 C ATOM 1780 O ILE B 13 12.492 24.403 -14.692 1.00 21.78 O ATOM 1781 CB ILE B 13 14.422 24.198 -11.963 1.00 22.98 C ATOM 1782 CG1 ILE B 13 13.143 23.428 -11.580 1.00 23.33 C ATOM 1783 CG2 ILE B 13 14.842 25.011 -10.779 1.00 22.06 C ATOM 1784 CD1 ILE B 13 13.391 22.085 -10.818 1.00 21.69 C ATOM 1785 HA ILE B 13 15.084 25.657 -13.387 1.00 0.00 H ATOM 1786 HB ILE B 13 15.204 23.495 -12.250 1.00 0.00 H ATOM 1787 HG12 ILE B 13 12.536 24.072 -10.944 1.00 0.00 H ATOM 1788 HG13 ILE B 13 12.595 23.203 -12.495 1.00 0.00 H ATOM 1789 HD11 ILE B 13 13.985 21.418 -11.443 1.00 0.00 H ATOM 1790 HD12 ILE B 13 13.926 22.288 -9.891 1.00 0.00 H ATOM 1791 HD13 ILE B 13 12.434 21.615 -10.591 1.00 0.00 H ATOM 1792 HG21 ILE B 13 15.748 25.565 -11.023 1.00 0.00 H ATOM 1793 HG22 ILE B 13 14.046 25.709 -10.519 1.00 0.00 H ATOM 1794 HG23 ILE B 13 15.036 24.349 -9.935 1.00 0.00 H ATOM 1795 H ILE B 13 12.167 25.767 -12.537 1.00 0.00 H ATOM 1796 N LYS B 14 14.613 23.724 -15.069 1.00 22.97 N ATOM 1797 CA LYS B 14 14.270 22.798 -16.112 1.00 22.54 C ATOM 1798 C LYS B 14 14.918 21.438 -15.887 1.00 21.26 C ATOM 1799 O LYS B 14 16.135 21.318 -15.737 1.00 19.84 O ATOM 1800 CB LYS B 14 14.717 23.349 -17.459 1.00 23.70 C ATOM 1801 CG LYS B 14 14.237 22.468 -18.621 1.00 27.99 C ATOM 1802 CD LYS B 14 14.390 23.117 -20.041 1.00 31.20 C ATOM 1803 CE LYS B 14 15.767 23.354 -20.487 1.00 32.25 C ATOM 1804 NZ LYS B 14 15.790 23.483 -22.026 1.00 33.54 N ATOM 1805 HA LYS B 14 13.188 22.669 -16.100 1.00 0.00 H ATOM 1806 HB2 LYS B 14 14.309 24.352 -17.584 1.00 0.00 H ATOM 1807 HB3 LYS B 14 15.806 23.396 -17.478 1.00 0.00 H ATOM 1808 HG2 LYS B 14 14.813 21.543 -18.606 1.00 0.00 H ATOM 1809 HG3 LYS B 14 13.183 22.241 -18.463 1.00 0.00 H ATOM 1810 HD2 LYS B 14 13.912 22.457 -20.765 1.00 0.00 H ATOM 1811 HD3 LYS B 14 13.872 24.076 -20.029 1.00 0.00 H ATOM 1812 HE2 LYS B 14 16.398 22.519 -20.182 1.00 0.00 H ATOM 1813 HE3 LYS B 14 16.142 24.274 -20.039 1.00 0.00 H ATOM 1814 HZ1 LYS B 14 15.432 22.604 -22.452 1.00 0.00 H ATOM 1815 HZ2 LYS B 14 15.188 24.280 -22.315 1.00 0.00 H ATOM 1816 HZ3 LYS B 14 16.766 23.651 -22.344 1.00 0.00 H ATOM 1817 H LYS B 14 15.615 23.884 -14.841 1.00 0.00 H ATOM 1818 N ILE B 15 14.110 20.414 -15.923 1.00 21.87 N ATOM 1819 CA ILE B 15 14.598 19.062 -15.706 1.00 22.97 C ATOM 1820 C ILE B 15 13.719 18.142 -16.565 1.00 23.97 C ATOM 1821 O ILE B 15 12.536 18.343 -16.674 1.00 24.35 O ATOM 1822 CB ILE B 15 14.571 18.688 -14.211 1.00 24.13 C ATOM 1823 CG1 ILE B 15 15.160 17.312 -14.016 1.00 23.35 C ATOM 1824 CG2 ILE B 15 13.109 18.748 -13.559 1.00 23.97 C ATOM 1825 CD1 ILE B 15 15.441 17.104 -12.583 1.00 23.14 C ATOM 1826 HA ILE B 15 15.643 18.963 -16.001 1.00 0.00 H ATOM 1827 HB ILE B 15 15.171 19.438 -13.696 1.00 0.00 H ATOM 1828 HG12 ILE B 15 14.452 16.559 -14.362 1.00 0.00 H ATOM 1829 HG13 ILE B 15 16.085 17.227 -14.586 1.00 0.00 H ATOM 1830 HD11 ILE B 15 16.149 17.858 -12.240 1.00 0.00 H ATOM 1831 HD12 ILE B 15 14.514 17.190 -12.016 1.00 0.00 H ATOM 1832 HD13 ILE B 15 15.867 16.111 -12.438 1.00 0.00 H ATOM 1833 HG21 ILE B 15 12.714 19.760 -13.648 1.00 0.00 H ATOM 1834 HG22 ILE B 15 12.451 18.052 -14.080 1.00 0.00 H ATOM 1835 HG23 ILE B 15 13.170 18.472 -12.506 1.00 0.00 H ATOM 1836 H ILE B 15 13.099 20.568 -16.110 1.00 0.00 H ATOM 1837 N GLY B 16 14.314 17.140 -17.152 1.00 25.51 N ATOM 1838 CA GLY B 16 13.613 16.267 -18.078 1.00 27.29 C ATOM 1839 C GLY B 16 12.956 16.993 -19.230 1.00 28.16 C ATOM 1840 O GLY B 16 11.930 16.569 -19.708 1.00 25.42 O ATOM 1841 HA3 GLY B 16 12.841 15.730 -17.526 1.00 0.00 H ATOM 1842 HA2 GLY B 16 14.329 15.554 -18.486 1.00 0.00 H ATOM 1843 H GLY B 16 15.319 16.961 -16.951 1.00 0.00 H ATOM 1844 N GLY B 17 13.507 18.106 -19.664 1.00 27.40 N ATOM 1845 CA GLY B 17 12.873 18.884 -20.715 1.00 28.63 C ATOM 1846 C GLY B 17 11.670 19.726 -20.302 1.00 27.46 C ATOM 1847 O GLY B 17 11.071 20.377 -21.141 1.00 28.54 O ATOM 1848 HA3 GLY B 17 12.543 18.191 -21.489 1.00 0.00 H ATOM 1849 HA2 GLY B 17 13.624 19.558 -21.129 1.00 0.00 H ATOM 1850 H GLY B 17 14.404 18.432 -19.251 1.00 0.00 H ATOM 1851 N GLN B 18 11.331 19.766 -19.017 1.00 27.14 N ATOM 1852 CA GLN B 18 10.132 20.428 -18.538 1.00 27.97 C ATOM 1853 C GLN B 18 10.496 21.480 -17.508 1.00 27.13 C ATOM 1854 O GLN B 18 11.488 21.336 -16.778 1.00 23.41 O ATOM 1855 CB GLN B 18 9.110 19.456 -17.911 1.00 31.94 C ATOM 1856 CG GLN B 18 8.587 18.358 -18.840 1.00 34.90 C ATOM 1857 CD GLN B 18 7.904 18.929 -20.122 1.00 38.06 C ATOM 1858 OE1 GLN B 18 7.063 19.817 -20.020 1.00 39.30 O ATOM 1859 NE2 GLN B 18 8.296 18.422 -21.319 1.00 38.36 N ATOM 1860 HA GLN B 18 9.664 20.882 -19.412 1.00 0.00 H ATOM 1861 HB2 GLN B 18 9.585 18.975 -17.056 1.00 0.00 H ATOM 1862 HB3 GLN B 18 8.256 20.041 -17.569 1.00 0.00 H ATOM 1863 HG2 GLN B 18 9.424 17.728 -19.141 1.00 0.00 H ATOM 1864 HG3 GLN B 18 7.859 17.757 -18.295 1.00 0.00 H ATOM 1865 HE22 GLN B 18 9.013 17.669 -21.355 1.00 0.00 H ATOM 1866 HE21 GLN B 18 7.880 18.786 -22.200 1.00 0.00 H ATOM 1867 H GLN B 18 11.953 19.302 -18.324 1.00 0.00 H ATOM 1868 N LEU B 19 9.697 22.537 -17.479 1.00 25.30 N ATOM 1869 CA LEU B 19 9.889 23.649 -16.586 1.00 27.06 C ATOM 1870 C LEU B 19 9.090 23.416 -15.314 1.00 26.84 C ATOM 1871 O LEU B 19 7.986 22.930 -15.369 1.00 24.49 O ATOM 1872 CB LEU B 19 9.422 24.922 -17.250 1.00 29.25 C ATOM 1873 CG LEU B 19 10.115 25.406 -18.527 1.00 30.36 C ATOM 1874 CD1 LEU B 19 9.567 26.795 -18.914 1.00 31.17 C ATOM 1875 CD2 LEU B 19 11.622 25.455 -18.369 1.00 29.99 C ATOM 1876 HA LEU B 19 10.947 23.740 -16.342 1.00 0.00 H ATOM 1877 HB2 LEU B 19 8.369 24.784 -17.494 1.00 0.00 H ATOM 1878 HB3 LEU B 19 9.522 25.719 -16.513 1.00 0.00 H ATOM 1879 HG LEU B 19 9.899 24.692 -19.322 1.00 0.00 H ATOM 1880 HD21 LEU B 19 11.879 26.139 -17.560 1.00 0.00 H ATOM 1881 HD22 LEU B 19 11.994 24.458 -18.135 1.00 0.00 H ATOM 1882 HD23 LEU B 19 12.072 25.804 -19.298 1.00 0.00 H ATOM 1883 HD11 LEU B 19 8.493 26.725 -19.087 1.00 0.00 H ATOM 1884 HD12 LEU B 19 9.761 27.499 -18.105 1.00 0.00 H ATOM 1885 HD13 LEU B 19 10.061 27.139 -19.823 1.00 0.00 H ATOM 1886 H LEU B 19 8.890 22.564 -18.135 1.00 0.00 H ATOM 1887 N LYS B 20 9.674 23.733 -14.163 1.00 25.38 N ATOM 1888 CA LYS B 20 9.011 23.556 -12.896 1.00 25.83 C ATOM 1889 C LYS B 20 9.430 24.795 -12.052 1.00 25.29 C ATOM 1890 O LYS B 20 10.487 25.400 -12.262 1.00 24.39 O ATOM 1891 CB LYS B 20 9.490 22.258 -12.197 1.00 26.19 C ATOM 1892 CG LYS B 20 9.029 20.934 -12.788 1.00 27.98 C ATOM 1893 CD LYS B 20 9.758 19.746 -12.170 1.00 30.19 C ATOM 1894 CE LYS B 20 9.221 18.389 -12.728 1.00 31.09 C ATOM 1895 NZ LYS B 20 7.948 18.020 -11.939 1.00 31.84 N ATOM 1896 HA LYS B 20 7.931 23.471 -13.014 1.00 0.00 H ATOM 1897 HB2 LYS B 20 10.580 22.261 -12.212 1.00 0.00 H ATOM 1898 HB3 LYS B 20 9.142 22.295 -11.165 1.00 0.00 H ATOM 1899 HG2 LYS B 20 7.960 20.822 -12.609 1.00 0.00 H ATOM 1900 HG3 LYS B 20 9.218 20.943 -13.861 1.00 0.00 H ATOM 1901 HD2 LYS B 20 10.821 19.826 -12.396 1.00 0.00 H ATOM 1902 HD3 LYS B 20 9.615 19.766 -11.090 1.00 0.00 H ATOM 1903 HE2 LYS B 20 9.974 17.612 -12.600 1.00 0.00 H ATOM 1904 HE3 LYS B 20 8.984 18.492 -13.787 1.00 0.00 H ATOM 1905 HZ1 LYS B 20 8.182 17.927 -10.930 1.00 0.00 H ATOM 1906 HZ2 LYS B 20 7.236 18.767 -12.063 1.00 0.00 H ATOM 1907 HZ3 LYS B 20 7.571 17.118 -12.293 1.00 0.00 H ATOM 1908 H LYS B 20 10.639 24.121 -14.177 1.00 0.00 H ATOM 1909 N GLU B 21 8.613 25.145 -11.076 1.00 24.63 N ATOM 1910 CA GLU B 21 9.004 26.127 -10.047 1.00 25.80 C ATOM 1911 C GLU B 21 9.631 25.427 -8.820 1.00 24.17 C ATOM 1912 O GLU B 21 9.124 24.399 -8.376 1.00 24.18 O ATOM 1913 CB GLU B 21 7.772 26.921 -9.575 1.00 28.89 C ATOM 1914 CG GLU B 21 7.142 27.738 -10.696 1.00 33.77 C ATOM 1915 CD GLU B 21 8.057 28.833 -11.287 1.00 36.65 C ATOM 1916 OE1 GLU B 21 8.541 28.611 -12.439 1.00 37.51 O ATOM 1917 OE2 GLU B 21 8.298 29.916 -10.634 1.00 40.43 O ATOM 1918 HA GLU B 21 9.737 26.798 -10.495 1.00 0.00 H ATOM 1919 HB2 GLU B 21 7.030 26.221 -9.192 1.00 0.00 H ATOM 1920 HB3 GLU B 21 8.076 27.598 -8.777 1.00 0.00 H ATOM 1921 HG2 GLU B 21 6.865 27.056 -11.500 1.00 0.00 H ATOM 1922 HG3 GLU B 21 6.246 28.219 -10.304 1.00 0.00 H ATOM 1923 H GLU B 21 7.667 24.716 -11.031 1.00 0.00 H ATOM 1924 N ALA B 22 10.721 25.979 -8.320 1.00 22.20 N ATOM 1925 CA ALA B 22 11.388 25.429 -7.145 1.00 21.52 C ATOM 1926 C ALA B 22 11.945 26.516 -6.246 1.00 21.65 C ATOM 1927 O ALA B 22 12.225 27.661 -6.710 1.00 21.73 O ATOM 1928 CB ALA B 22 12.470 24.461 -7.538 1.00 23.21 C ATOM 1929 HA ALA B 22 10.632 24.888 -6.576 1.00 0.00 H ATOM 1930 HB1 ALA B 22 12.033 23.640 -8.107 1.00 0.00 H ATOM 1931 HB2 ALA B 22 13.211 24.975 -8.151 1.00 0.00 H ATOM 1932 HB3 ALA B 22 12.948 24.069 -6.641 1.00 0.00 H ATOM 1933 H ALA B 22 11.114 26.827 -8.775 1.00 0.00 H ATOM 1934 N LEU B 23 12.127 26.143 -4.967 1.00 19.62 N ATOM 1935 CA LEU B 23 12.505 27.050 -3.885 1.00 21.89 C ATOM 1936 C LEU B 23 14.010 26.984 -3.652 1.00 20.76 C ATOM 1937 O LEU B 23 14.514 25.905 -3.439 1.00 22.61 O ATOM 1938 CB LEU B 23 11.849 26.611 -2.606 1.00 22.24 C ATOM 1939 CG LEU B 23 11.945 27.505 -1.396 1.00 24.03 C ATOM 1940 CD1 LEU B 23 11.456 28.922 -1.712 1.00 23.49 C ATOM 1941 CD2 LEU B 23 11.133 26.856 -0.282 1.00 25.14 C ATOM 1942 HA LEU B 23 12.197 28.058 -4.163 1.00 0.00 H ATOM 1943 HB2 LEU B 23 10.789 26.474 -2.820 1.00 0.00 H ATOM 1944 HB3 LEU B 23 12.290 25.653 -2.332 1.00 0.00 H ATOM 1945 HG LEU B 23 12.983 27.612 -1.081 1.00 0.00 H ATOM 1946 HD21 LEU B 23 10.096 26.756 -0.601 1.00 0.00 H ATOM 1947 HD22 LEU B 23 11.543 25.870 -0.062 1.00 0.00 H ATOM 1948 HD23 LEU B 23 11.181 27.479 0.611 1.00 0.00 H ATOM 1949 HD11 LEU B 23 12.068 29.347 -2.508 1.00 0.00 H ATOM 1950 HD12 LEU B 23 10.415 28.883 -2.034 1.00 0.00 H ATOM 1951 HD13 LEU B 23 11.538 29.541 -0.819 1.00 0.00 H ATOM 1952 H LEU B 23 11.989 25.139 -4.731 1.00 0.00 H ATOM 1953 N LEU B 24 14.707 28.126 -3.758 1.00 19.71 N ATOM 1954 CA LEU B 24 16.118 28.187 -3.374 1.00 20.91 C ATOM 1955 C LEU B 24 16.236 28.102 -1.877 1.00 21.45 C ATOM 1956 O LEU B 24 15.798 29.015 -1.160 1.00 22.35 O ATOM 1957 CB LEU B 24 16.813 29.424 -3.969 1.00 21.03 C ATOM 1958 CG LEU B 24 16.637 29.653 -5.466 1.00 22.17 C ATOM 1959 CD1 LEU B 24 17.451 30.904 -5.867 1.00 24.83 C ATOM 1960 CD2 LEU B 24 17.076 28.430 -6.315 1.00 23.91 C ATOM 1961 HA LEU B 24 16.645 27.330 -3.794 1.00 0.00 H ATOM 1962 HB2 LEU B 24 16.425 30.302 -3.452 1.00 0.00 H ATOM 1963 HB3 LEU B 24 17.881 29.330 -3.772 1.00 0.00 H ATOM 1964 HG LEU B 24 15.576 29.801 -5.667 1.00 0.00 H ATOM 1965 HD21 LEU B 24 18.130 28.220 -6.130 1.00 0.00 H ATOM 1966 HD22 LEU B 24 16.478 27.563 -6.037 1.00 0.00 H ATOM 1967 HD23 LEU B 24 16.928 28.651 -7.372 1.00 0.00 H ATOM 1968 HD11 LEU B 24 17.085 31.767 -5.311 1.00 0.00 H ATOM 1969 HD12 LEU B 24 18.503 30.741 -5.635 1.00 0.00 H ATOM 1970 HD13 LEU B 24 17.337 31.083 -6.936 1.00 0.00 H ATOM 1971 H LEU B 24 14.237 28.981 -4.119 1.00 0.00 H ATOM 1972 N ASP B 25 16.746 26.983 -1.371 1.00 19.28 N ATOM 1973 CA ASP B 25 16.628 26.703 0.038 1.00 19.85 C ATOM 1974 C ASP B 25 17.957 26.437 0.704 1.00 19.32 C ATOM 1975 O ASP B 25 18.478 25.355 0.635 1.00 19.28 O ATOM 1976 CB ASP B 25 15.723 25.488 0.219 1.00 22.43 C ATOM 1977 CG ASP B 25 15.375 25.233 1.685 1.00 22.80 C ATOM 1978 OD1 ASP B 25 14.443 24.504 1.887 1.00 27.04 O ATOM 1979 OD2 ASP B 25 15.916 25.772 2.645 1.00 26.25 O ATOM 1980 HA ASP B 25 16.208 27.589 0.514 1.00 0.00 H ATOM 1981 HB2 ASP B 25 14.800 25.653 -0.336 1.00 0.00 H ATOM 1982 HB3 ASP B 25 16.232 24.610 -0.178 1.00 0.00 H ATOM 1983 H ASP B 25 17.232 26.307 -1.994 1.00 0.00 H ATOM 1984 N THR B 26 18.520 27.460 1.332 1.00 21.22 N ATOM 1985 CA THR B 26 19.780 27.318 2.041 1.00 21.46 C ATOM 1986 C THR B 26 19.704 26.392 3.246 1.00 21.59 C ATOM 1987 O THR B 26 20.722 25.850 3.685 1.00 23.76 O ATOM 1988 CB THR B 26 20.347 28.675 2.454 1.00 20.19 C ATOM 1989 OG1 THR B 26 19.446 29.352 3.340 1.00 21.89 O ATOM 1990 CG2 THR B 26 20.515 29.496 1.238 1.00 20.18 C ATOM 1991 HA THR B 26 20.458 26.849 1.328 1.00 0.00 H ATOM 1992 HB THR B 26 21.298 28.525 2.965 1.00 0.00 H ATOM 1993 HG1 THR B 26 19.307 28.802 4.151 1.00 0.00 H ATOM 1994 HG23 THR B 26 21.198 28.994 0.554 1.00 0.00 H ATOM 1995 HG21 THR B 26 19.547 29.629 0.754 1.00 0.00 H ATOM 1996 HG22 THR B 26 20.923 30.469 1.512 1.00 0.00 H ATOM 1997 H THR B 26 18.048 28.387 1.317 1.00 0.00 H ATOM 1998 N GLY B 27 18.516 26.204 3.779 1.00 20.97 N ATOM 1999 CA GLY B 27 18.335 25.292 4.894 1.00 21.96 C ATOM 2000 C GLY B 27 18.258 23.819 4.510 1.00 22.19 C ATOM 2001 O GLY B 27 18.141 22.943 5.375 1.00 22.87 O ATOM 2002 HA3 GLY B 27 17.409 25.559 5.403 1.00 0.00 H ATOM 2003 HA2 GLY B 27 19.174 25.421 5.577 1.00 0.00 H ATOM 2004 H GLY B 27 17.695 26.716 3.396 1.00 0.00 H ATOM 2005 N ALA B 28 18.250 23.544 3.206 1.00 22.15 N ATOM 2006 CA ALA B 28 18.231 22.155 2.709 1.00 22.46 C ATOM 2007 C ALA B 28 19.602 21.668 2.274 1.00 21.85 C ATOM 2008 O ALA B 28 20.261 22.285 1.414 1.00 20.43 O ATOM 2009 CB ALA B 28 17.219 22.035 1.568 1.00 21.97 C ATOM 2010 HA ALA B 28 17.929 21.511 3.535 1.00 0.00 H ATOM 2011 HB1 ALA B 28 16.228 22.304 1.933 1.00 0.00 H ATOM 2012 HB2 ALA B 28 17.504 22.707 0.759 1.00 0.00 H ATOM 2013 HB3 ALA B 28 17.206 21.008 1.202 1.00 0.00 H ATOM 2014 H ALA B 28 18.257 24.328 2.522 1.00 0.00 H ATOM 2015 N ASP B 29 20.055 20.548 2.833 1.00 21.24 N ATOM 2016 CA ASP B 29 21.319 19.970 2.377 1.00 23.56 C ATOM 2017 C ASP B 29 21.251 19.509 0.925 1.00 24.25 C ATOM 2018 O ASP B 29 22.203 19.650 0.154 1.00 21.22 O ATOM 2019 CB ASP B 29 21.690 18.762 3.213 1.00 24.19 C ATOM 2020 CG ASP B 29 21.982 19.109 4.673 1.00 26.09 C ATOM 2021 OD1 ASP B 29 22.083 18.121 5.444 1.00 24.10 O ATOM 2022 OD2 ASP B 29 22.116 20.290 5.143 1.00 26.34 O ATOM 2023 HA ASP B 29 22.063 20.760 2.476 1.00 0.00 H ATOM 2024 HB2 ASP B 29 20.863 18.052 3.184 1.00 0.00 H ATOM 2025 HB3 ASP B 29 22.578 18.301 2.781 1.00 0.00 H ATOM 2026 H ASP B 29 19.513 20.086 3.591 1.00 0.00 H ATOM 2027 N ASP B 30 20.110 18.927 0.578 1.00 22.41 N ATOM 2028 CA ASP B 30 19.872 18.279 -0.681 1.00 19.66 C ATOM 2029 C ASP B 30 18.780 18.959 -1.518 1.00 19.88 C ATOM 2030 O ASP B 30 17.957 19.740 -1.022 1.00 20.18 O ATOM 2031 CB ASP B 30 19.407 16.843 -0.385 1.00 21.22 C ATOM 2032 CG ASP B 30 20.428 16.062 0.438 1.00 24.59 C ATOM 2033 OD1 ASP B 30 20.026 15.396 1.401 1.00 27.02 O ATOM 2034 OD2 ASP B 30 21.645 16.031 0.163 1.00 23.26 O ATOM 2035 HA ASP B 30 20.799 18.322 -1.253 1.00 0.00 H ATOM 2036 HB2 ASP B 30 18.469 16.885 0.168 1.00 0.00 H ATOM 2037 HB3 ASP B 30 19.247 16.324 -1.330 1.00 0.00 H ATOM 2038 H ASP B 30 19.332 18.941 1.268 1.00 0.00 H ATOM 2039 N THR B 31 18.698 18.547 -2.767 1.00 20.12 N ATOM 2040 CA THR B 31 17.646 18.948 -3.667 1.00 19.26 C ATOM 2041 C THR B 31 16.586 17.841 -3.722 1.00 21.18 C ATOM 2042 O THR B 31 16.899 16.670 -3.927 1.00 19.78 O ATOM 2043 CB THR B 31 18.326 19.175 -5.047 1.00 19.63 C ATOM 2044 OG1 THR B 31 19.191 20.327 -4.984 1.00 20.52 O ATOM 2045 CG2 THR B 31 17.316 19.443 -6.206 1.00 21.02 C ATOM 2046 HA THR B 31 17.139 19.859 -3.348 1.00 0.00 H ATOM 2047 HB THR B 31 18.868 18.253 -5.258 1.00 0.00 H ATOM 2048 HG1 THR B 31 19.888 20.178 -4.297 1.00 0.00 H ATOM 2049 HG23 THR B 31 16.635 18.596 -6.296 1.00 0.00 H ATOM 2050 HG21 THR B 31 16.747 20.347 -5.989 1.00 0.00 H ATOM 2051 HG22 THR B 31 17.863 19.572 -7.140 1.00 0.00 H ATOM 2052 H THR B 31 19.430 17.899 -3.122 1.00 0.00 H ATOM 2053 N VAL B 32 15.332 18.209 -3.489 1.00 20.47 N ATOM 2054 CA VAL B 32 14.268 17.252 -3.427 1.00 20.77 C ATOM 2055 C VAL B 32 13.115 17.771 -4.295 1.00 20.02 C ATOM 2056 O VAL B 32 12.604 18.893 -4.078 1.00 19.55 O ATOM 2057 CB VAL B 32 13.769 17.003 -1.975 1.00 22.84 C ATOM 2058 CG1 VAL B 32 12.858 15.776 -1.980 1.00 23.11 C ATOM 2059 CG2 VAL B 32 14.953 16.823 -1.047 1.00 26.16 C ATOM 2060 HA VAL B 32 14.641 16.295 -3.793 1.00 0.00 H ATOM 2061 HB VAL B 32 13.200 17.859 -1.611 1.00 0.00 H ATOM 2062 HG11 VAL B 32 12.010 15.958 -2.640 1.00 0.00 H ATOM 2063 HG12 VAL B 32 13.418 14.911 -2.335 1.00 0.00 H ATOM 2064 HG13 VAL B 32 12.499 15.587 -0.968 1.00 0.00 H ATOM 2065 HG21 VAL B 32 15.544 15.969 -1.376 1.00 0.00 H ATOM 2066 HG22 VAL B 32 15.569 17.722 -1.067 1.00 0.00 H ATOM 2067 HG23 VAL B 32 14.595 16.649 -0.032 1.00 0.00 H ATOM 2068 H VAL B 32 15.117 19.217 -3.348 1.00 0.00 H ATOM 2069 N LEU B 33 12.674 16.973 -5.240 1.00 18.40 N ATOM 2070 CA LEU B 33 11.578 17.394 -6.124 1.00 19.99 C ATOM 2071 C LEU B 33 10.367 16.503 -5.919 1.00 20.32 C ATOM 2072 O LEU B 33 10.473 15.347 -5.519 1.00 19.95 O ATOM 2073 CB LEU B 33 11.988 17.335 -7.589 1.00 19.30 C ATOM 2074 CG LEU B 33 13.230 18.143 -7.981 1.00 21.09 C ATOM 2075 CD1 LEU B 33 13.467 17.947 -9.493 1.00 22.73 C ATOM 2076 CD2 LEU B 33 12.973 19.546 -7.670 1.00 22.26 C ATOM 2077 HA LEU B 33 11.333 18.425 -5.869 1.00 0.00 H ATOM 2078 HB2 LEU B 33 12.178 16.291 -7.839 1.00 0.00 H ATOM 2079 HB3 LEU B 33 11.151 17.703 -8.183 1.00 0.00 H ATOM 2080 HG LEU B 33 14.116 17.816 -7.437 1.00 0.00 H ATOM 2081 HD21 LEU B 33 12.106 19.889 -8.235 1.00 0.00 H ATOM 2082 HD22 LEU B 33 12.777 19.650 -6.603 1.00 0.00 H ATOM 2083 HD23 LEU B 33 13.844 20.142 -7.941 1.00 0.00 H ATOM 2084 HD11 LEU B 33 13.624 16.889 -9.701 1.00 0.00 H ATOM 2085 HD12 LEU B 33 12.596 18.301 -10.045 1.00 0.00 H ATOM 2086 HD13 LEU B 33 14.347 18.513 -9.798 1.00 0.00 H ATOM 2087 H LEU B 33 13.104 16.034 -5.364 1.00 0.00 H ATOM 2088 N GLU B 34 9.213 17.070 -6.238 1.00 23.19 N ATOM 2089 CA GLU B 34 7.965 16.373 -6.156 1.00 24.37 C ATOM 2090 C GLU B 34 7.989 15.210 -7.133 1.00 25.92 C ATOM 2091 O GLU B 34 8.725 15.191 -8.138 1.00 24.18 O ATOM 2092 CB GLU B 34 6.756 17.316 -6.420 1.00 27.69 C ATOM 2093 CG GLU B 34 6.639 18.537 -5.489 1.00 28.52 C ATOM 2094 CD GLU B 34 5.776 19.670 -6.085 1.00 33.28 C ATOM 2095 OE1 GLU B 34 5.801 20.829 -5.530 1.00 34.61 O ATOM 2096 OE2 GLU B 34 5.141 19.436 -7.157 1.00 35.35 O ATOM 2097 HA GLU B 34 7.837 15.992 -5.143 1.00 0.00 H ATOM 2098 HB2 GLU B 34 6.835 17.683 -7.443 1.00 0.00 H ATOM 2099 HB3 GLU B 34 5.844 16.728 -6.316 1.00 0.00 H ATOM 2100 HG2 GLU B 34 6.190 18.216 -4.549 1.00 0.00 H ATOM 2101 HG3 GLU B 34 7.639 18.926 -5.298 1.00 0.00 H ATOM 2102 H GLU B 34 9.214 18.059 -6.560 1.00 0.00 H ATOM 2103 N GLU B 35 7.216 14.189 -6.787 1.00 27.47 N ATOM 2104 CA GLU B 35 7.043 13.006 -7.613 1.00 27.97 C ATOM 2105 C GLU B 35 7.081 13.254 -9.094 1.00 29.48 C ATOM 2106 O GLU B 35 6.322 14.071 -9.621 1.00 26.57 O ATOM 2107 CB GLU B 35 5.688 12.367 -7.238 1.00 31.29 C ATOM 2108 CG GLU B 35 5.621 10.864 -7.125 1.00 33.72 C ATOM 2109 CD GLU B 35 6.860 10.180 -6.551 1.00 34.50 C ATOM 2110 OE1 GLU B 35 7.608 9.707 -7.430 1.00 31.49 O ATOM 2111 OE2 GLU B 35 7.049 10.052 -5.267 1.00 33.67 O ATOM 2112 HA GLU B 35 7.891 12.352 -7.411 1.00 0.00 H ATOM 2113 HB2 GLU B 35 5.391 12.778 -6.273 1.00 0.00 H ATOM 2114 HB3 GLU B 35 4.966 12.668 -7.997 1.00 0.00 H ATOM 2115 HG2 GLU B 35 4.775 10.615 -6.484 1.00 0.00 H ATOM 2116 HG3 GLU B 35 5.450 10.461 -8.123 1.00 0.00 H ATOM 2117 H GLU B 35 6.709 14.238 -5.880 1.00 0.00 H ATOM 2118 N MET B 36 7.994 12.571 -9.776 1.00 29.54 N ATOM 2119 CA MET B 36 8.229 12.720 -11.220 1.00 30.09 C ATOM 2120 C MET B 36 9.007 11.507 -11.722 1.00 32.27 C ATOM 2121 O MET B 36 9.451 10.668 -10.935 1.00 30.69 O ATOM 2122 CB MET B 36 9.024 13.983 -11.567 1.00 31.10 C ATOM 2123 CG MET B 36 10.441 14.003 -10.995 1.00 30.46 C ATOM 2124 SD MET B 36 11.423 15.478 -11.412 1.00 28.05 S ATOM 2125 CE MET B 36 11.581 15.324 -13.130 1.00 28.82 C ATOM 2126 HA MET B 36 7.253 12.801 -11.699 1.00 0.00 H ATOM 2127 HB2 MET B 36 9.091 14.059 -12.652 1.00 0.00 H ATOM 2128 HB3 MET B 36 8.484 14.846 -11.177 1.00 0.00 H ATOM 2129 HG2 MET B 36 10.970 13.128 -11.372 1.00 0.00 H ATOM 2130 HG3 MET B 36 10.368 13.942 -9.909 1.00 0.00 H ATOM 2131 HE1 MET B 36 12.090 14.389 -13.364 1.00 0.00 H ATOM 2132 HE2 MET B 36 10.591 15.324 -13.586 1.00 0.00 H ATOM 2133 HE3 MET B 36 12.161 16.162 -13.517 1.00 0.00 H ATOM 2134 H MET B 36 8.580 11.887 -9.255 1.00 0.00 H ATOM 2135 N ASN B 37 9.231 11.438 -13.023 1.00 33.60 N ATOM 2136 CA ASN B 37 9.943 10.309 -13.589 1.00 35.46 C ATOM 2137 C ASN B 37 11.322 10.764 -14.041 1.00 33.15 C ATOM 2138 O ASN B 37 11.448 11.808 -14.674 1.00 34.14 O ATOM 2139 CB ASN B 37 9.106 9.714 -14.725 1.00 39.22 C ATOM 2140 CG ASN B 37 7.657 9.405 -14.272 1.00 44.24 C ATOM 2141 OD1 ASN B 37 7.400 9.113 -13.067 1.00 49.02 O ATOM 2142 ND2 ASN B 37 6.688 9.492 -15.208 1.00 47.40 N ATOM 2143 HA ASN B 37 10.092 9.523 -12.849 1.00 0.00 H ATOM 2144 HB2 ASN B 37 9.074 10.426 -15.550 1.00 0.00 H ATOM 2145 HB3 ASN B 37 9.575 8.790 -15.062 1.00 0.00 H ATOM 2146 HD22 ASN B 37 6.933 9.734 -16.189 1.00 0.00 H ATOM 2147 HD21 ASN B 37 5.696 9.317 -14.948 1.00 0.00 H ATOM 2148 H ASN B 37 8.894 12.200 -13.646 1.00 0.00 H ATOM 2149 N LEU B 38 12.357 10.025 -13.655 1.00 29.07 N ATOM 2150 CA LEU B 38 13.711 10.311 -14.088 1.00 27.94 C ATOM 2151 C LEU B 38 14.353 9.012 -14.565 1.00 29.50 C ATOM 2152 O LEU B 38 14.022 7.945 -14.097 1.00 28.52 O ATOM 2153 CB LEU B 38 14.529 10.859 -12.932 1.00 27.00 C ATOM 2154 CG LEU B 38 14.347 12.313 -12.513 1.00 26.83 C ATOM 2155 CD1 LEU B 38 15.332 12.670 -11.364 1.00 25.30 C ATOM 2156 CD2 LEU B 38 14.493 13.244 -13.704 1.00 25.10 C ATOM 2157 HA LEU B 38 13.683 11.049 -14.890 1.00 0.00 H ATOM 2158 HB2 LEU B 38 14.300 10.246 -12.061 1.00 0.00 H ATOM 2159 HB3 LEU B 38 15.579 10.733 -13.197 1.00 0.00 H ATOM 2160 HG LEU B 38 13.335 12.446 -12.131 1.00 0.00 H ATOM 2161 HD21 LEU B 38 15.487 13.126 -14.136 1.00 0.00 H ATOM 2162 HD22 LEU B 38 13.738 12.997 -14.451 1.00 0.00 H ATOM 2163 HD23 LEU B 38 14.358 14.275 -13.376 1.00 0.00 H ATOM 2164 HD11 LEU B 38 15.138 12.025 -10.507 1.00 0.00 H ATOM 2165 HD12 LEU B 38 16.356 12.523 -11.706 1.00 0.00 H ATOM 2166 HD13 LEU B 38 15.190 13.712 -11.076 1.00 0.00 H ATOM 2167 H LEU B 38 12.191 9.216 -13.023 1.00 0.00 H ATOM 2168 N PRO B 39 15.293 9.111 -15.480 1.00 31.58 N ATOM 2169 CA PRO B 39 15.899 7.911 -16.033 1.00 31.71 C ATOM 2170 C PRO B 39 16.996 7.324 -15.154 1.00 30.04 C ATOM 2171 O PRO B 39 17.567 8.033 -14.319 1.00 28.39 O ATOM 2172 CB PRO B 39 16.463 8.399 -17.378 1.00 32.46 C ATOM 2173 CG PRO B 39 16.781 9.810 -17.184 1.00 33.38 C ATOM 2174 CD PRO B 39 15.840 10.342 -16.105 1.00 31.73 C ATOM 2175 HA PRO B 39 15.179 7.097 -16.122 1.00 0.00 H ATOM 2176 HD3 PRO B 39 16.384 10.941 -15.375 1.00 0.00 H ATOM 2177 HD2 PRO B 39 15.044 10.943 -16.544 1.00 0.00 H ATOM 2178 HG3 PRO B 39 16.631 10.358 -18.114 1.00 0.00 H ATOM 2179 HG2 PRO B 39 17.817 9.919 -16.863 1.00 0.00 H ATOM 2180 HB2 PRO B 39 17.361 7.839 -17.640 1.00 0.00 H ATOM 2181 HB3 PRO B 39 15.720 8.281 -18.167 1.00 0.00 H ATOM 2182 N GLY B 40 17.289 6.036 -15.359 1.00 28.07 N ATOM 2183 CA GLY B 40 18.397 5.369 -14.661 1.00 28.60 C ATOM 2184 C GLY B 40 18.053 4.675 -13.355 1.00 27.51 C ATOM 2185 O GLY B 40 16.862 4.573 -12.985 1.00 25.05 O ATOM 2186 HA3 GLY B 40 19.155 6.122 -14.447 1.00 0.00 H ATOM 2187 HA2 GLY B 40 18.811 4.620 -15.336 1.00 0.00 H ATOM 2188 H GLY B 40 16.716 5.489 -16.033 1.00 0.00 H ATOM 2189 N ARG B 41 19.100 4.180 -12.682 1.00 25.22 N ATOM 2190 CA ARG B 41 19.000 3.514 -11.373 1.00 28.31 C ATOM 2191 C ARG B 41 18.816 4.580 -10.289 1.00 26.88 C ATOM 2192 O ARG B 41 19.297 5.716 -10.425 1.00 26.75 O ATOM 2193 CB ARG B 41 20.274 2.756 -11.041 1.00 28.42 C ATOM 2194 CG ARG B 41 20.686 1.717 -12.040 1.00 30.56 C ATOM 2195 CD ARG B 41 19.910 0.456 -11.860 1.00 29.50 C ATOM 2196 NE ARG B 41 20.083 -0.119 -10.498 1.00 27.56 N ATOM 2197 CZ ARG B 41 19.470 -1.236 -10.118 1.00 26.15 C ATOM 2198 NH1 ARG B 41 18.694 -1.872 -10.996 1.00 23.25 N ATOM 2199 NH2 ARG B 41 19.619 -1.706 -8.898 1.00 24.71 N ATOM 2200 HA ARG B 41 18.160 2.820 -11.413 1.00 0.00 H ATOM 2201 HB2 ARG B 41 21.084 3.481 -10.956 1.00 0.00 H ATOM 2202 HB3 ARG B 41 20.130 2.261 -10.081 1.00 0.00 H ATOM 2203 HG2 ARG B 41 20.512 2.101 -13.045 1.00 0.00 H ATOM 2204 HG3 ARG B 41 21.747 1.503 -11.913 1.00 0.00 H ATOM 2205 HD2 ARG B 41 20.249 -0.274 -12.595 1.00 0.00 H ATOM 2206 HD3 ARG B 41 18.853 0.668 -12.021 1.00 0.00 H ATOM 2207 HE ARG B 41 20.704 0.369 -9.821 1.00 0.00 H ATOM 2208 HH12 ARG B 41 18.205 -2.747 -10.720 1.00 0.00 H ATOM 2209 HH11 ARG B 41 18.577 -1.493 -11.957 1.00 0.00 H ATOM 2210 HH22 ARG B 41 19.133 -2.581 -8.615 1.00 0.00 H ATOM 2211 HH21 ARG B 41 20.222 -1.203 -8.217 1.00 0.00 H ATOM 2212 H ARG B 41 20.043 4.272 -13.111 1.00 0.00 H ATOM 2213 N TRP B 42 18.093 4.213 -9.252 1.00 23.33 N ATOM 2214 CA TRP B 42 18.036 5.032 -8.092 1.00 23.97 C ATOM 2215 C TRP B 42 18.420 4.230 -6.866 1.00 23.85 C ATOM 2216 O TRP B 42 18.342 3.005 -6.876 1.00 19.54 O ATOM 2217 CB TRP B 42 16.658 5.685 -7.970 1.00 22.63 C ATOM 2218 CG TRP B 42 15.527 4.745 -7.812 1.00 22.22 C ATOM 2219 CD1 TRP B 42 14.777 4.184 -8.827 1.00 19.18 C ATOM 2220 CD2 TRP B 42 14.944 4.304 -6.584 1.00 22.18 C ATOM 2221 NE1 TRP B 42 13.783 3.403 -8.302 1.00 20.89 N ATOM 2222 CE2 TRP B 42 13.872 3.428 -6.924 1.00 22.67 C ATOM 2223 CE3 TRP B 42 15.222 4.531 -5.220 1.00 22.26 C ATOM 2224 CZ2 TRP B 42 13.049 2.838 -5.966 1.00 21.91 C ATOM 2225 CZ3 TRP B 42 14.381 3.931 -4.259 1.00 22.33 C ATOM 2226 CH2 TRP B 42 13.340 3.058 -4.646 1.00 22.06 C ATOM 2227 HA TRP B 42 18.760 5.842 -8.179 1.00 0.00 H ATOM 2228 HB2 TRP B 42 16.673 6.344 -7.102 1.00 0.00 H ATOM 2229 HB3 TRP B 42 16.483 6.275 -8.870 1.00 0.00 H ATOM 2230 HE1 TRP B 42 13.075 2.876 -8.852 1.00 0.00 H ATOM 2231 HD1 TRP B 42 14.951 4.340 -9.892 1.00 0.00 H ATOM 2232 HZ2 TRP B 42 12.200 2.220 -6.259 1.00 0.00 H ATOM 2233 HH2 TRP B 42 12.757 2.549 -3.879 1.00 0.00 H ATOM 2234 HZ3 TRP B 42 14.537 4.144 -3.202 1.00 0.00 H ATOM 2235 HE3 TRP B 42 16.064 5.153 -4.916 1.00 0.00 H ATOM 2236 H TRP B 42 17.561 3.320 -9.282 1.00 0.00 H ATOM 2237 N LYS B 43 18.773 4.959 -5.806 1.00 24.69 N ATOM 2238 CA LYS B 43 19.141 4.425 -4.489 1.00 26.88 C ATOM 2239 C LYS B 43 18.240 5.059 -3.421 1.00 26.14 C ATOM 2240 O LYS B 43 17.724 6.130 -3.589 1.00 24.26 O ATOM 2241 CB LYS B 43 20.606 4.811 -4.093 1.00 29.61 C ATOM 2242 CG LYS B 43 21.713 4.304 -5.045 1.00 34.47 C ATOM 2243 CD LYS B 43 23.083 4.779 -4.609 1.00 38.27 C ATOM 2244 CE LYS B 43 23.271 6.316 -4.762 1.00 40.41 C ATOM 2245 NZ LYS B 43 24.696 6.787 -5.205 1.00 42.65 N ATOM 2246 HA LYS B 43 19.038 3.341 -4.544 1.00 0.00 H ATOM 2247 HB2 LYS B 43 20.668 5.899 -4.056 1.00 0.00 H ATOM 2248 HB3 LYS B 43 20.804 4.403 -3.102 1.00 0.00 H ATOM 2249 HG2 LYS B 43 21.702 3.214 -5.052 1.00 0.00 H ATOM 2250 HG3 LYS B 43 21.513 4.675 -6.050 1.00 0.00 H ATOM 2251 HD2 LYS B 43 23.226 4.514 -3.561 1.00 0.00 H ATOM 2252 HD3 LYS B 43 23.835 4.275 -5.216 1.00 0.00 H ATOM 2253 HE2 LYS B 43 23.050 6.778 -3.800 1.00 0.00 H ATOM 2254 HE3 LYS B 43 22.556 6.668 -5.505 1.00 0.00 H ATOM 2255 HZ1 LYS B 43 25.397 6.476 -4.502 1.00 0.00 H ATOM 2256 HZ2 LYS B 43 24.925 6.372 -6.131 1.00 0.00 H ATOM 2257 HZ3 LYS B 43 24.710 7.824 -5.276 1.00 0.00 H ATOM 2258 H LYS B 43 18.789 5.992 -5.922 1.00 0.00 H ATOM 2259 N PRO B 44 18.089 4.401 -2.289 1.00 25.60 N ATOM 2260 CA PRO B 44 17.177 4.892 -1.253 1.00 23.37 C ATOM 2261 C PRO B 44 17.867 5.951 -0.407 1.00 24.03 C ATOM 2262 O PRO B 44 19.104 5.958 -0.245 1.00 24.13 O ATOM 2263 CB PRO B 44 16.891 3.626 -0.431 1.00 25.01 C ATOM 2264 CG PRO B 44 18.124 2.873 -0.539 1.00 25.32 C ATOM 2265 CD PRO B 44 18.662 3.098 -1.921 1.00 25.47 C ATOM 2266 HA PRO B 44 16.274 5.362 -1.643 1.00 0.00 H ATOM 2267 HD3 PRO B 44 19.751 3.135 -1.917 1.00 0.00 H ATOM 2268 HD2 PRO B 44 18.329 2.316 -2.604 1.00 0.00 H ATOM 2269 HG3 PRO B 44 17.929 1.812 -0.382 1.00 0.00 H ATOM 2270 HG2 PRO B 44 18.842 3.223 0.203 1.00 0.00 H ATOM 2271 HB2 PRO B 44 16.675 3.875 0.608 1.00 0.00 H ATOM 2272 HB3 PRO B 44 16.054 3.068 -0.851 1.00 0.00 H ATOM 2273 N LYS B 45 17.077 6.897 0.086 1.00 22.34 N ATOM 2274 CA LYS B 45 17.580 7.793 1.087 1.00 24.43 C ATOM 2275 C LYS B 45 16.434 8.208 1.998 1.00 24.98 C ATOM 2276 O LYS B 45 15.309 8.344 1.572 1.00 25.15 O ATOM 2277 CB LYS B 45 18.269 9.018 0.459 1.00 25.48 C ATOM 2278 CG LYS B 45 19.116 9.816 1.386 1.00 28.43 C ATOM 2279 CD LYS B 45 19.858 10.980 0.753 1.00 29.98 C ATOM 2280 CE LYS B 45 20.808 11.547 1.782 1.00 29.76 C ATOM 2281 NZ LYS B 45 21.462 12.774 1.350 1.00 31.99 N ATOM 2282 HA LYS B 45 18.340 7.279 1.675 1.00 0.00 H ATOM 2283 HB2 LYS B 45 18.901 8.668 -0.357 1.00 0.00 H ATOM 2284 HB3 LYS B 45 17.494 9.674 0.062 1.00 0.00 H ATOM 2285 HG2 LYS B 45 18.473 10.214 2.171 1.00 0.00 H ATOM 2286 HG3 LYS B 45 19.854 9.147 1.828 1.00 0.00 H ATOM 2287 HD2 LYS B 45 20.418 10.633 -0.116 1.00 0.00 H ATOM 2288 HD3 LYS B 45 19.148 11.747 0.443 1.00 0.00 H ATOM 2289 HE2 LYS B 45 21.575 10.802 1.992 1.00 0.00 H ATOM 2290 HE3 LYS B 45 20.247 11.756 2.693 1.00 0.00 H ATOM 2291 HZ1 LYS B 45 22.011 12.587 0.486 1.00 0.00 H ATOM 2292 HZ2 LYS B 45 20.742 13.499 1.155 1.00 0.00 H ATOM 2293 HZ3 LYS B 45 22.099 13.109 2.101 1.00 0.00 H ATOM 2294 H LYS B 45 16.098 6.988 -0.252 1.00 0.00 H ATOM 2295 N MET B 46 16.749 8.410 3.268 1.00 27.19 N ATOM 2296 CA MET B 46 15.817 9.024 4.229 1.00 27.18 C ATOM 2297 C MET B 46 16.333 10.402 4.490 1.00 26.88 C ATOM 2298 O MET B 46 17.528 10.584 4.723 1.00 24.42 O ATOM 2299 CB MET B 46 15.873 8.278 5.571 1.00 31.23 C ATOM 2300 CG MET B 46 15.472 6.856 5.448 1.00 35.09 C ATOM 2301 SD MET B 46 13.714 6.717 4.939 1.00 42.12 S ATOM 2302 CE MET B 46 12.943 7.830 6.257 1.00 37.05 C ATOM 2303 HA MET B 46 14.802 9.004 3.833 1.00 0.00 H ATOM 2304 HB2 MET B 46 16.893 8.322 5.953 1.00 0.00 H ATOM 2305 HB3 MET B 46 15.201 8.771 6.274 1.00 0.00 H ATOM 2306 HG2 MET B 46 15.606 6.362 6.410 1.00 0.00 H ATOM 2307 HG3 MET B 46 16.100 6.370 4.701 1.00 0.00 H ATOM 2308 HE1 MET B 46 13.161 7.426 7.245 1.00 0.00 H ATOM 2309 HE2 MET B 46 13.361 8.833 6.173 1.00 0.00 H ATOM 2310 HE3 MET B 46 11.864 7.871 6.110 1.00 0.00 H ATOM 2311 H MET B 46 17.692 8.124 3.600 1.00 0.00 H ATOM 2312 N ILE B 47 15.439 11.382 4.445 1.00 26.15 N ATOM 2313 CA ILE B 47 15.811 12.755 4.689 1.00 25.18 C ATOM 2314 C ILE B 47 14.833 13.296 5.709 1.00 25.66 C ATOM 2315 O ILE B 47 13.654 12.856 5.738 1.00 27.19 O ATOM 2316 CB ILE B 47 15.748 13.576 3.371 1.00 24.02 C ATOM 2317 CG1 ILE B 47 14.355 13.596 2.773 1.00 24.64 C ATOM 2318 CG2 ILE B 47 16.738 13.078 2.358 1.00 24.91 C ATOM 2319 CD1 ILE B 47 14.120 14.608 1.673 1.00 22.46 C ATOM 2320 HA ILE B 47 16.833 12.826 5.060 1.00 0.00 H ATOM 2321 HB ILE B 47 16.013 14.599 3.638 1.00 0.00 H ATOM 2322 HG12 ILE B 47 14.153 12.606 2.364 1.00 0.00 H ATOM 2323 HG13 ILE B 47 13.650 13.807 3.577 1.00 0.00 H ATOM 2324 HD11 ILE B 47 14.298 15.611 2.060 1.00 0.00 H ATOM 2325 HD12 ILE B 47 14.802 14.409 0.846 1.00 0.00 H ATOM 2326 HD13 ILE B 47 13.091 14.530 1.323 1.00 0.00 H ATOM 2327 HG21 ILE B 47 17.746 13.160 2.766 1.00 0.00 H ATOM 2328 HG22 ILE B 47 16.523 12.035 2.124 1.00 0.00 H ATOM 2329 HG23 ILE B 47 16.662 13.679 1.452 1.00 0.00 H ATOM 2330 H ILE B 47 14.447 11.155 4.229 1.00 0.00 H ATOM 2331 N GLY B 48 15.304 14.219 6.546 1.00 25.56 N ATOM 2332 CA GLY B 48 14.542 14.765 7.652 1.00 27.16 C ATOM 2333 C GLY B 48 14.316 16.269 7.555 1.00 27.00 C ATOM 2334 O GLY B 48 15.216 17.001 7.209 1.00 27.96 O ATOM 2335 HA3 GLY B 48 15.079 14.556 8.577 1.00 0.00 H ATOM 2336 HA2 GLY B 48 13.571 14.271 7.678 1.00 0.00 H ATOM 2337 H GLY B 48 16.273 14.568 6.398 1.00 0.00 H ATOM 2338 N GLY B 49 13.111 16.706 7.852 1.00 26.68 N ATOM 2339 CA GLY B 49 12.779 18.116 7.926 1.00 26.10 C ATOM 2340 C GLY B 49 12.105 18.441 9.256 1.00 28.79 C ATOM 2341 O GLY B 49 12.309 17.769 10.296 1.00 28.70 O ATOM 2342 HA3 GLY B 49 12.102 18.368 7.110 1.00 0.00 H ATOM 2343 HA2 GLY B 49 13.692 18.704 7.834 1.00 0.00 H ATOM 2344 H GLY B 49 12.363 16.009 8.042 1.00 0.00 H ATOM 2345 N ILE B 50 11.284 19.478 9.190 1.00 28.46 N ATOM 2346 CA ILE B 50 10.521 20.006 10.341 1.00 31.45 C ATOM 2347 C ILE B 50 9.678 18.929 11.010 1.00 30.87 C ATOM 2348 O ILE B 50 9.700 18.794 12.234 1.00 32.77 O ATOM 2349 CB ILE B 50 9.598 21.165 9.858 1.00 32.92 C ATOM 2350 CG1 ILE B 50 10.377 22.472 9.788 1.00 36.76 C ATOM 2351 CG2 ILE B 50 8.427 21.390 10.791 1.00 33.98 C ATOM 2352 CD1 ILE B 50 10.949 22.872 11.175 1.00 37.35 C ATOM 2353 HA ILE B 50 11.236 20.370 11.078 1.00 0.00 H ATOM 2354 HB ILE B 50 9.229 20.871 8.875 1.00 0.00 H ATOM 2355 HG12 ILE B 50 11.202 22.355 9.085 1.00 0.00 H ATOM 2356 HG13 ILE B 50 9.712 23.262 9.438 1.00 0.00 H ATOM 2357 HD11 ILE B 50 10.129 22.997 11.882 1.00 0.00 H ATOM 2358 HD12 ILE B 50 11.620 22.090 11.529 1.00 0.00 H ATOM 2359 HD13 ILE B 50 11.498 23.809 11.084 1.00 0.00 H ATOM 2360 HG21 ILE B 50 7.829 20.481 10.847 1.00 0.00 H ATOM 2361 HG22 ILE B 50 8.799 21.644 11.784 1.00 0.00 H ATOM 2362 HG23 ILE B 50 7.814 22.207 10.412 1.00 0.00 H ATOM 2363 H ILE B 50 11.169 19.951 8.271 1.00 0.00 H ATOM 2364 N GLY B 51 8.941 18.153 10.247 1.00 29.51 N ATOM 2365 CA GLY B 51 8.006 17.255 10.940 1.00 30.39 C ATOM 2366 C GLY B 51 8.388 15.792 11.038 1.00 29.18 C ATOM 2367 O GLY B 51 7.547 14.940 11.464 1.00 27.66 O ATOM 2368 HA3 GLY B 51 7.051 17.310 10.417 1.00 0.00 H ATOM 2369 HA2 GLY B 51 7.884 17.630 11.956 1.00 0.00 H ATOM 2370 H GLY B 51 9.015 18.173 9.210 1.00 0.00 H ATOM 2371 N GLY B 52 9.603 15.476 10.601 1.00 27.53 N ATOM 2372 CA GLY B 52 10.073 14.090 10.587 1.00 29.08 C ATOM 2373 C GLY B 52 10.779 13.699 9.300 1.00 29.91 C ATOM 2374 O GLY B 52 11.264 14.545 8.561 1.00 27.80 O ATOM 2375 HA3 GLY B 52 9.214 13.433 10.722 1.00 0.00 H ATOM 2376 HA2 GLY B 52 10.767 13.953 11.416 1.00 0.00 H ATOM 2377 H GLY B 52 10.233 16.230 10.262 1.00 0.00 H ATOM 2378 N PHE B 53 10.822 12.405 9.036 1.00 29.48 N ATOM 2379 CA PHE B 53 11.635 11.853 7.972 1.00 29.64 C ATOM 2380 C PHE B 53 10.705 11.308 6.906 1.00 30.09 C ATOM 2381 O PHE B 53 9.591 10.855 7.210 1.00 29.18 O ATOM 2382 CB PHE B 53 12.583 10.753 8.494 1.00 30.65 C ATOM 2383 CG PHE B 53 13.657 11.274 9.383 1.00 33.39 C ATOM 2384 CD1 PHE B 53 14.922 11.503 8.908 1.00 36.45 C ATOM 2385 CD2 PHE B 53 13.376 11.578 10.697 1.00 36.97 C ATOM 2386 CE1 PHE B 53 15.915 12.004 9.757 1.00 37.12 C ATOM 2387 CE2 PHE B 53 14.354 12.138 11.543 1.00 37.07 C ATOM 2388 CZ PHE B 53 15.614 12.320 11.078 1.00 37.54 C ATOM 2389 HA PHE B 53 12.269 12.635 7.554 1.00 0.00 H ATOM 2390 HB2 PHE B 53 11.994 10.025 9.052 1.00 0.00 H ATOM 2391 HB3 PHE B 53 13.049 10.263 7.639 1.00 0.00 H ATOM 2392 HD2 PHE B 53 12.378 11.382 11.090 1.00 0.00 H ATOM 2393 HE2 PHE B 53 14.099 12.423 12.564 1.00 0.00 H ATOM 2394 HZ PHE B 53 16.389 12.713 11.737 1.00 0.00 H ATOM 2395 HE1 PHE B 53 16.928 12.147 9.382 1.00 0.00 H ATOM 2396 HD1 PHE B 53 15.156 11.294 7.864 1.00 0.00 H ATOM 2397 H PHE B 53 10.250 11.758 9.615 1.00 0.00 H ATOM 2398 N ILE B 54 11.138 11.389 5.654 1.00 27.92 N ATOM 2399 CA ILE B 54 10.411 10.777 4.562 1.00 28.75 C ATOM 2400 C ILE B 54 11.403 10.005 3.706 1.00 28.61 C ATOM 2401 O ILE B 54 12.629 10.279 3.737 1.00 28.15 O ATOM 2402 CB ILE B 54 9.673 11.792 3.673 1.00 29.06 C ATOM 2403 CG1 ILE B 54 10.705 12.701 2.981 1.00 28.16 C ATOM 2404 CG2 ILE B 54 8.506 12.543 4.458 1.00 28.88 C ATOM 2405 CD1 ILE B 54 10.169 13.480 1.834 1.00 27.06 C ATOM 2406 HA ILE B 54 9.651 10.129 4.998 1.00 0.00 H ATOM 2407 HB ILE B 54 9.136 11.277 2.876 1.00 0.00 H ATOM 2408 HG12 ILE B 54 11.090 13.404 3.720 1.00 0.00 H ATOM 2409 HG13 ILE B 54 11.520 12.076 2.617 1.00 0.00 H ATOM 2410 HD11 ILE B 54 9.791 12.794 1.076 1.00 0.00 H ATOM 2411 HD12 ILE B 54 9.360 14.124 2.180 1.00 0.00 H ATOM 2412 HD13 ILE B 54 10.965 14.091 1.408 1.00 0.00 H ATOM 2413 HG21 ILE B 54 7.780 11.812 4.813 1.00 0.00 H ATOM 2414 HG22 ILE B 54 8.928 13.080 5.307 1.00 0.00 H ATOM 2415 HG23 ILE B 54 8.015 13.249 3.788 1.00 0.00 H ATOM 2416 H ILE B 54 12.019 11.904 5.453 1.00 0.00 H ATOM 2417 N LYS B 55 10.870 9.058 2.935 1.00 27.07 N ATOM 2418 CA LYS B 55 11.666 8.213 2.070 1.00 27.79 C ATOM 2419 C LYS B 55 11.658 8.820 0.707 1.00 25.71 C ATOM 2420 O LYS B 55 10.602 9.251 0.196 1.00 25.64 O ATOM 2421 CB LYS B 55 11.078 6.809 1.970 1.00 30.30 C ATOM 2422 CG LYS B 55 11.628 5.870 2.954 1.00 34.01 C ATOM 2423 CD LYS B 55 10.982 4.420 2.742 1.00 37.17 C ATOM 2424 CE LYS B 55 11.833 3.329 3.394 1.00 38.61 C ATOM 2425 NZ LYS B 55 11.053 2.071 3.855 1.00 41.02 N ATOM 2426 HA LYS B 55 12.674 8.138 2.479 1.00 0.00 H ATOM 2427 HB2 LYS B 55 10.001 6.875 2.121 1.00 0.00 H ATOM 2428 HB3 LYS B 55 11.281 6.421 0.972 1.00 0.00 H ATOM 2429 HG2 LYS B 55 12.709 5.807 2.829 1.00 0.00 H ATOM 2430 HG3 LYS B 55 11.400 6.224 3.959 1.00 0.00 H ATOM 2431 HD2 LYS B 55 9.987 4.407 3.186 1.00 0.00 H ATOM 2432 HD3 LYS B 55 10.905 4.219 1.674 1.00 0.00 H ATOM 2433 HE2 LYS B 55 12.324 3.760 4.266 1.00 0.00 H ATOM 2434 HE3 LYS B 55 12.587 3.013 2.673 1.00 0.00 H ATOM 2435 HZ1 LYS B 55 10.336 2.347 4.556 1.00 0.00 H ATOM 2436 HZ2 LYS B 55 10.587 1.633 3.035 1.00 0.00 H ATOM 2437 HZ3 LYS B 55 11.714 1.392 4.283 1.00 0.00 H ATOM 2438 H LYS B 55 9.839 8.920 2.955 1.00 0.00 H ATOM 2439 N VAL B 56 12.827 8.861 0.083 1.00 24.51 N ATOM 2440 CA VAL B 56 12.925 9.482 -1.240 1.00 23.02 C ATOM 2441 C VAL B 56 13.834 8.611 -2.118 1.00 22.61 C ATOM 2442 O VAL B 56 14.580 7.770 -1.604 1.00 23.38 O ATOM 2443 CB VAL B 56 13.481 10.976 -1.180 1.00 23.12 C ATOM 2444 CG1 VAL B 56 12.567 11.868 -0.323 1.00 23.24 C ATOM 2445 CG2 VAL B 56 14.896 11.021 -0.675 1.00 21.65 C ATOM 2446 HA VAL B 56 11.922 9.545 -1.663 1.00 0.00 H ATOM 2447 HB VAL B 56 13.483 11.365 -2.198 1.00 0.00 H ATOM 2448 HG11 VAL B 56 11.567 11.883 -0.756 1.00 0.00 H ATOM 2449 HG12 VAL B 56 12.520 11.470 0.691 1.00 0.00 H ATOM 2450 HG13 VAL B 56 12.969 12.881 -0.299 1.00 0.00 H ATOM 2451 HG21 VAL B 56 14.936 10.598 0.329 1.00 0.00 H ATOM 2452 HG22 VAL B 56 15.536 10.442 -1.340 1.00 0.00 H ATOM 2453 HG23 VAL B 56 15.238 12.056 -0.649 1.00 0.00 H ATOM 2454 H VAL B 56 13.672 8.453 0.532 1.00 0.00 H ATOM 2455 N ARG B 57 13.766 8.832 -3.426 1.00 22.41 N ATOM 2456 CA ARG B 57 14.578 8.131 -4.379 1.00 22.59 C ATOM 2457 C ARG B 57 15.729 9.032 -4.823 1.00 21.34 C ATOM 2458 O ARG B 57 15.511 10.139 -5.286 1.00 21.31 O ATOM 2459 CB ARG B 57 13.748 7.737 -5.597 1.00 24.88 C ATOM 2460 CG ARG B 57 12.412 7.017 -5.256 1.00 25.66 C ATOM 2461 CD ARG B 57 11.831 6.258 -6.411 1.00 26.53 C ATOM 2462 NE ARG B 57 11.685 7.096 -7.599 1.00 28.32 N ATOM 2463 CZ ARG B 57 10.653 7.880 -7.804 1.00 29.97 C ATOM 2464 NH1 ARG B 57 9.706 7.975 -6.881 1.00 32.03 N ATOM 2465 NH2 ARG B 57 10.562 8.595 -8.902 1.00 31.38 N ATOM 2466 HA ARG B 57 14.970 7.228 -3.911 1.00 0.00 H ATOM 2467 HB2 ARG B 57 13.515 8.642 -6.159 1.00 0.00 H ATOM 2468 HB3 ARG B 57 14.347 7.070 -6.217 1.00 0.00 H ATOM 2469 HG2 ARG B 57 12.595 6.318 -4.440 1.00 0.00 H ATOM 2470 HG3 ARG B 57 11.688 7.766 -4.936 1.00 0.00 H ATOM 2471 HD2 ARG B 57 10.850 5.878 -6.125 1.00 0.00 H ATOM 2472 HD3 ARG B 57 12.488 5.421 -6.649 1.00 0.00 H ATOM 2473 HE ARG B 57 12.436 7.070 -8.318 1.00 0.00 H ATOM 2474 HH12 ARG B 57 8.886 8.595 -7.039 1.00 0.00 H ATOM 2475 HH11 ARG B 57 9.783 7.429 -5.999 1.00 0.00 H ATOM 2476 HH22 ARG B 57 9.739 9.213 -9.053 1.00 0.00 H ATOM 2477 HH21 ARG B 57 11.313 8.543 -9.620 1.00 0.00 H ATOM 2478 H ARG B 57 13.094 9.545 -3.775 1.00 0.00 H ATOM 2479 N GLN B 58 16.944 8.545 -4.730 1.00 20.27 N ATOM 2480 CA GLN B 58 18.115 9.330 -5.183 1.00 20.33 C ATOM 2481 C GLN B 58 18.599 8.974 -6.568 1.00 21.80 C ATOM 2482 O GLN B 58 19.016 7.830 -6.866 1.00 22.19 O ATOM 2483 CB GLN B 58 19.280 9.120 -4.168 1.00 21.93 C ATOM 2484 CG GLN B 58 20.571 9.919 -4.502 1.00 23.49 C ATOM 2485 CD GLN B 58 21.706 9.719 -3.484 1.00 25.75 C ATOM 2486 OE1 GLN B 58 21.439 9.550 -2.305 1.00 26.43 O ATOM 2487 NE2 GLN B 58 22.989 9.787 -3.939 1.00 25.58 N ATOM 2488 HA GLN B 58 17.795 10.371 -5.229 1.00 0.00 H ATOM 2489 HB2 GLN B 58 18.933 9.428 -3.181 1.00 0.00 H ATOM 2490 HB3 GLN B 58 19.530 8.059 -4.149 1.00 0.00 H ATOM 2491 HG2 GLN B 58 20.928 9.602 -5.482 1.00 0.00 H ATOM 2492 HG3 GLN B 58 20.321 10.979 -4.534 1.00 0.00 H ATOM 2493 HE22 GLN B 58 23.174 9.932 -4.952 1.00 0.00 H ATOM 2494 HE21 GLN B 58 23.782 9.694 -3.273 1.00 0.00 H ATOM 2495 H GLN B 58 17.086 7.595 -4.333 1.00 0.00 H ATOM 2496 N TYR B 59 18.596 9.963 -7.436 1.00 20.26 N ATOM 2497 CA TYR B 59 19.201 9.859 -8.733 1.00 21.14 C ATOM 2498 C TYR B 59 20.440 10.718 -8.799 1.00 21.41 C ATOM 2499 O TYR B 59 20.395 11.908 -8.452 1.00 22.26 O ATOM 2500 CB TYR B 59 18.233 10.378 -9.797 1.00 20.60 C ATOM 2501 CG TYR B 59 16.950 9.567 -9.861 1.00 22.39 C ATOM 2502 CD1 TYR B 59 15.910 9.835 -8.988 1.00 23.74 C ATOM 2503 CD2 TYR B 59 16.812 8.494 -10.764 1.00 22.47 C ATOM 2504 CE1 TYR B 59 14.715 9.093 -9.026 1.00 24.28 C ATOM 2505 CE2 TYR B 59 15.618 7.753 -10.828 1.00 24.13 C ATOM 2506 CZ TYR B 59 14.598 8.058 -9.942 1.00 24.16 C ATOM 2507 OH TYR B 59 13.463 7.348 -9.983 1.00 26.21 O ATOM 2508 HA TYR B 59 19.450 8.812 -8.908 1.00 0.00 H ATOM 2509 HB3 TYR B 59 18.724 10.333 -10.769 1.00 0.00 H ATOM 2510 HB2 TYR B 59 17.981 11.413 -9.566 1.00 0.00 H ATOM 2511 HD2 TYR B 59 17.642 8.235 -11.422 1.00 0.00 H ATOM 2512 HE2 TYR B 59 15.498 6.955 -11.560 1.00 0.00 H ATOM 2513 HE1 TYR B 59 13.895 9.328 -8.347 1.00 0.00 H ATOM 2514 HD1 TYR B 59 16.019 10.636 -8.257 1.00 0.00 H ATOM 2515 HH TYR B 59 13.049 7.441 -10.878 1.00 0.00 H ATOM 2516 H TYR B 59 18.136 10.857 -7.171 1.00 0.00 H ATOM 2517 N ASP B 60 21.523 10.156 -9.330 1.00 21.56 N ATOM 2518 CA ASP B 60 22.776 10.897 -9.500 1.00 23.08 C ATOM 2519 C ASP B 60 23.023 11.375 -10.953 1.00 23.22 C ATOM 2520 O ASP B 60 22.447 10.810 -11.890 1.00 23.02 O ATOM 2521 CB ASP B 60 23.911 10.002 -9.050 1.00 24.35 C ATOM 2522 CG ASP B 60 23.825 9.717 -7.585 1.00 28.09 C ATOM 2523 OD1 ASP B 60 24.025 8.541 -7.198 1.00 29.97 O ATOM 2524 OD2 ASP B 60 23.442 10.599 -6.755 1.00 26.41 O ATOM 2525 HA ASP B 60 22.714 11.803 -8.897 1.00 0.00 H ATOM 2526 HB2 ASP B 60 23.862 9.062 -9.599 1.00 0.00 H ATOM 2527 HB3 ASP B 60 24.859 10.496 -9.262 1.00 0.00 H ATOM 2528 H ASP B 60 21.479 9.162 -9.633 1.00 0.00 H ATOM 2529 N GLN B 61 23.850 12.417 -11.107 1.00 21.98 N ATOM 2530 CA GLN B 61 24.322 12.936 -12.380 1.00 24.79 C ATOM 2531 C GLN B 61 23.162 13.318 -13.304 1.00 25.65 C ATOM 2532 O GLN B 61 23.137 12.969 -14.472 1.00 24.23 O ATOM 2533 CB GLN B 61 25.242 11.880 -13.043 1.00 29.34 C ATOM 2534 CG GLN B 61 26.343 12.442 -13.878 1.00 32.06 C ATOM 2535 CD GLN B 61 27.466 11.385 -14.181 1.00 34.38 C ATOM 2536 OE1 GLN B 61 27.710 10.499 -13.348 1.00 37.83 O ATOM 2537 NE2 GLN B 61 28.109 11.478 -15.347 1.00 32.67 N ATOM 2538 HA GLN B 61 24.888 13.850 -12.200 1.00 0.00 H ATOM 2539 HB2 GLN B 61 25.690 11.277 -12.253 1.00 0.00 H ATOM 2540 HB3 GLN B 61 24.625 11.244 -13.678 1.00 0.00 H ATOM 2541 HG2 GLN B 61 25.924 12.788 -14.823 1.00 0.00 H ATOM 2542 HG3 GLN B 61 26.789 13.284 -13.349 1.00 0.00 H ATOM 2543 HE22 GLN B 61 27.869 12.239 -16.014 1.00 0.00 H ATOM 2544 HE21 GLN B 61 28.850 10.789 -15.589 1.00 0.00 H ATOM 2545 H GLN B 61 24.182 12.894 -10.245 1.00 0.00 H ATOM 2546 N ILE B 62 22.187 14.027 -12.736 1.00 22.24 N ATOM 2547 CA ILE B 62 21.023 14.462 -13.461 1.00 22.82 C ATOM 2548 C ILE B 62 21.241 15.878 -13.932 1.00 22.23 C ATOM 2549 O ILE B 62 21.630 16.753 -13.153 1.00 22.27 O ATOM 2550 CB ILE B 62 19.804 14.423 -12.561 1.00 21.66 C ATOM 2551 CG1 ILE B 62 19.522 12.955 -12.121 1.00 23.71 C ATOM 2552 CG2 ILE B 62 18.580 15.099 -13.260 1.00 20.25 C ATOM 2553 CD1 ILE B 62 19.099 12.012 -13.258 1.00 25.49 C ATOM 2554 HA ILE B 62 20.861 13.800 -14.312 1.00 0.00 H ATOM 2555 HB ILE B 62 19.995 15.000 -11.656 1.00 0.00 H ATOM 2556 HG12 ILE B 62 20.430 12.556 -11.669 1.00 0.00 H ATOM 2557 HG13 ILE B 62 18.724 12.970 -11.378 1.00 0.00 H ATOM 2558 HD11 ILE B 62 18.183 12.385 -13.716 1.00 0.00 H ATOM 2559 HD12 ILE B 62 19.890 11.970 -14.007 1.00 0.00 H ATOM 2560 HD13 ILE B 62 18.925 11.014 -12.855 1.00 0.00 H ATOM 2561 HG21 ILE B 62 18.820 16.138 -13.485 1.00 0.00 H ATOM 2562 HG22 ILE B 62 18.353 14.569 -14.185 1.00 0.00 H ATOM 2563 HG23 ILE B 62 17.717 15.060 -12.596 1.00 0.00 H ATOM 2564 H ILE B 62 22.271 14.275 -11.730 1.00 0.00 H ATOM 2565 N LEU B 63 20.929 16.102 -15.196 1.00 22.89 N ATOM 2566 CA LEU B 63 20.983 17.456 -15.734 1.00 24.80 C ATOM 2567 C LEU B 63 19.781 18.301 -15.203 1.00 22.21 C ATOM 2568 O LEU B 63 18.665 17.888 -15.282 1.00 21.78 O ATOM 2569 CB LEU B 63 20.910 17.406 -17.243 1.00 29.27 C ATOM 2570 CG LEU B 63 22.119 17.067 -18.127 1.00 33.47 C ATOM 2571 CD1 LEU B 63 21.714 17.113 -19.628 1.00 35.82 C ATOM 2572 CD2 LEU B 63 23.154 18.079 -17.923 1.00 38.07 C ATOM 2573 HA LEU B 63 21.919 17.917 -15.417 1.00 0.00 H ATOM 2574 HB2 LEU B 63 20.145 16.667 -17.483 1.00 0.00 H ATOM 2575 HB3 LEU B 63 20.572 18.393 -17.561 1.00 0.00 H ATOM 2576 HG LEU B 63 22.478 16.072 -17.863 1.00 0.00 H ATOM 2577 HD21 LEU B 63 22.761 19.059 -18.195 1.00 0.00 H ATOM 2578 HD22 LEU B 63 23.453 18.085 -16.875 1.00 0.00 H ATOM 2579 HD23 LEU B 63 24.017 17.846 -18.547 1.00 0.00 H ATOM 2580 HD11 LEU B 63 20.921 16.388 -19.812 1.00 0.00 H ATOM 2581 HD12 LEU B 63 21.358 18.113 -19.876 1.00 0.00 H ATOM 2582 HD13 LEU B 63 22.580 16.871 -20.244 1.00 0.00 H ATOM 2583 H LEU B 63 20.644 15.311 -15.808 1.00 0.00 H ATOM 2584 N ILE B 64 20.053 19.471 -14.682 1.00 23.46 N ATOM 2585 CA ILE B 64 19.039 20.381 -14.213 1.00 23.61 C ATOM 2586 C ILE B 64 19.516 21.813 -14.376 1.00 25.47 C ATOM 2587 O ILE B 64 20.650 22.153 -14.058 1.00 24.65 O ATOM 2588 CB ILE B 64 18.690 20.051 -12.720 1.00 25.87 C ATOM 2589 CG1 ILE B 64 17.659 21.020 -12.148 1.00 27.26 C ATOM 2590 CG2 ILE B 64 19.954 19.895 -11.859 1.00 26.19 C ATOM 2591 CD1 ILE B 64 17.137 20.558 -10.755 1.00 27.69 C ATOM 2592 HA ILE B 64 18.131 20.265 -14.805 1.00 0.00 H ATOM 2593 HB ILE B 64 18.206 19.075 -12.698 1.00 0.00 H ATOM 2594 HG12 ILE B 64 18.119 22.003 -12.044 1.00 0.00 H ATOM 2595 HG13 ILE B 64 16.816 21.085 -12.836 1.00 0.00 H ATOM 2596 HD11 ILE B 64 16.669 19.578 -10.850 1.00 0.00 H ATOM 2597 HD12 ILE B 64 17.972 20.497 -10.057 1.00 0.00 H ATOM 2598 HD13 ILE B 64 16.406 21.277 -10.386 1.00 0.00 H ATOM 2599 HG21 ILE B 64 20.564 19.084 -12.256 1.00 0.00 H ATOM 2600 HG22 ILE B 64 20.524 20.824 -11.881 1.00 0.00 H ATOM 2601 HG23 ILE B 64 19.667 19.667 -10.832 1.00 0.00 H ATOM 2602 H ILE B 64 21.050 19.758 -14.603 1.00 0.00 H ATOM 2603 N GLU B 65 18.637 22.677 -14.867 1.00 26.38 N ATOM 2604 CA GLU B 65 18.955 24.101 -15.035 1.00 26.94 C ATOM 2605 C GLU B 65 18.238 24.875 -13.956 1.00 27.34 C ATOM 2606 O GLU B 65 17.123 24.553 -13.641 1.00 26.46 O ATOM 2607 CB GLU B 65 18.429 24.566 -16.387 1.00 30.10 C ATOM 2608 CG GLU B 65 19.308 24.147 -17.489 1.00 34.16 C ATOM 2609 CD GLU B 65 18.953 24.755 -18.836 1.00 35.96 C ATOM 2610 OE1 GLU B 65 18.245 25.776 -18.890 1.00 37.61 O ATOM 2611 OE2 GLU B 65 19.393 24.146 -19.825 1.00 37.79 O ATOM 2612 HA GLU B 65 20.032 24.258 -14.975 1.00 0.00 H ATOM 2613 HB2 GLU B 65 17.438 24.141 -16.545 1.00 0.00 H ATOM 2614 HB3 GLU B 65 18.361 25.654 -16.384 1.00 0.00 H ATOM 2615 HG2 GLU B 65 20.329 24.437 -17.241 1.00 0.00 H ATOM 2616 HG3 GLU B 65 19.251 23.062 -17.578 1.00 0.00 H ATOM 2617 H GLU B 65 17.694 22.335 -15.141 1.00 0.00 H ATOM 2618 N ILE B 66 18.899 25.853 -13.343 1.00 26.05 N ATOM 2619 CA ILE B 66 18.268 26.647 -12.320 1.00 28.24 C ATOM 2620 C ILE B 66 18.409 28.108 -12.761 1.00 29.12 C ATOM 2621 O ILE B 66 19.513 28.607 -12.891 1.00 28.23 O ATOM 2622 CB ILE B 66 18.950 26.383 -10.983 1.00 30.45 C ATOM 2623 CG1 ILE B 66 18.898 24.898 -10.654 1.00 32.70 C ATOM 2624 CG2 ILE B 66 18.336 27.237 -9.924 1.00 29.86 C ATOM 2625 CD1 ILE B 66 19.919 24.477 -9.652 1.00 35.45 C ATOM 2626 HA ILE B 66 17.214 26.400 -12.190 1.00 0.00 H ATOM 2627 HB ILE B 66 20.004 26.655 -11.040 1.00 0.00 H ATOM 2628 HG12 ILE B 66 17.909 24.666 -10.258 1.00 0.00 H ATOM 2629 HG13 ILE B 66 19.062 24.334 -11.572 1.00 0.00 H ATOM 2630 HD11 ILE B 66 20.915 24.693 -10.038 1.00 0.00 H ATOM 2631 HD12 ILE B 66 19.762 25.024 -8.723 1.00 0.00 H ATOM 2632 HD13 ILE B 66 19.824 23.407 -9.466 1.00 0.00 H ATOM 2633 HG21 ILE B 66 18.458 28.287 -10.190 1.00 0.00 H ATOM 2634 HG22 ILE B 66 17.275 27.003 -9.840 1.00 0.00 H ATOM 2635 HG23 ILE B 66 18.829 27.043 -8.971 1.00 0.00 H ATOM 2636 H ILE B 66 19.886 26.047 -13.606 1.00 0.00 H ATOM 2637 N CYS B 67 17.305 28.772 -13.004 1.00 31.99 N ATOM 2638 CA CYS B 67 17.328 30.095 -13.636 1.00 37.32 C ATOM 2639 C CYS B 67 18.179 30.142 -14.890 1.00 36.43 C ATOM 2640 O CYS B 67 18.904 31.141 -15.077 1.00 35.72 O ATOM 2641 CB CYS B 67 17.967 31.123 -12.708 1.00 40.40 C ATOM 2642 SG CYS B 67 16.915 31.430 -11.339 1.00 46.23 S ATOM 2643 HA CYS B 67 16.284 30.308 -13.866 1.00 0.00 H ATOM 2644 HB2 CYS B 67 18.129 32.052 -13.255 1.00 0.00 H ATOM 2645 HB3 CYS B 67 18.924 30.742 -12.350 1.00 0.00 H ATOM 2646 HG CYS B 67 15.705 31.915 -11.791 1.00 0.00 H ATOM 2647 H CYS B 67 16.391 28.350 -12.742 1.00 0.00 H ATOM 2648 N GLY B 68 18.140 29.084 -15.701 1.00 34.38 N ATOM 2649 CA GLY B 68 18.997 28.983 -16.886 1.00 34.49 C ATOM 2650 C GLY B 68 20.473 28.624 -16.654 1.00 33.45 C ATOM 2651 O GLY B 68 21.207 28.436 -17.631 1.00 34.81 O ATOM 2652 HA3 GLY B 68 18.969 29.947 -17.395 1.00 0.00 H ATOM 2653 HA2 GLY B 68 18.571 28.218 -17.535 1.00 0.00 H ATOM 2654 H GLY B 68 17.482 28.308 -15.486 1.00 0.00 H ATOM 2655 N HIS B 69 20.930 28.536 -15.391 1.00 31.96 N ATOM 2656 CA HIS B 69 22.261 28.023 -15.066 1.00 30.57 C ATOM 2657 C HIS B 69 22.307 26.454 -15.090 1.00 29.81 C ATOM 2658 O HIS B 69 21.644 25.772 -14.271 1.00 28.24 O ATOM 2659 CB HIS B 69 22.698 28.502 -13.694 1.00 32.07 C ATOM 2660 CG HIS B 69 22.961 29.975 -13.612 1.00 33.70 C ATOM 2661 ND1 HIS B 69 24.178 30.476 -13.205 1.00 33.55 N ATOM 2662 CD2 HIS B 69 22.167 31.050 -13.855 1.00 34.70 C ATOM 2663 CE1 HIS B 69 24.134 31.800 -13.229 1.00 33.98 C ATOM 2664 NE2 HIS B 69 22.943 32.174 -13.657 1.00 35.61 N ATOM 2665 HA HIS B 69 22.939 28.404 -15.829 1.00 0.00 H ATOM 2666 HB2 HIS B 69 21.913 28.254 -12.979 1.00 0.00 H ATOM 2667 HB3 HIS B 69 23.613 27.976 -13.423 1.00 0.00 H ATOM 2668 HD2 HIS B 69 21.118 31.029 -14.150 1.00 0.00 H ATOM 2669 HE1 HIS B 69 24.946 32.469 -12.943 1.00 0.00 H ATOM 2670 H HIS B 69 20.312 28.845 -14.614 1.00 0.00 H ATOM 2671 N LYS B 70 23.087 25.889 -16.002 1.00 28.79 N ATOM 2672 CA LYS B 70 23.245 24.424 -16.114 1.00 31.23 C ATOM 2673 C LYS B 70 24.022 23.782 -14.992 1.00 30.99 C ATOM 2674 O LYS B 70 25.171 24.168 -14.708 1.00 32.36 O ATOM 2675 CB LYS B 70 23.876 24.066 -17.476 1.00 34.11 C ATOM 2676 CG LYS B 70 22.965 24.497 -18.642 1.00 36.80 C ATOM 2677 CD LYS B 70 23.524 24.225 -20.074 1.00 39.15 C ATOM 2678 CE LYS B 70 22.409 24.367 -21.123 1.00 40.09 C ATOM 2679 NZ LYS B 70 21.997 25.798 -21.373 1.00 40.50 N ATOM 2680 HA LYS B 70 22.238 24.013 -16.037 1.00 0.00 H ATOM 2681 HB2 LYS B 70 24.836 24.574 -17.568 1.00 0.00 H ATOM 2682 HB3 LYS B 70 24.030 22.988 -17.525 1.00 0.00 H ATOM 2683 HG2 LYS B 70 22.020 23.963 -18.544 1.00 0.00 H ATOM 2684 HG3 LYS B 70 22.787 25.568 -18.550 1.00 0.00 H ATOM 2685 HD2 LYS B 70 24.316 24.942 -20.292 1.00 0.00 H ATOM 2686 HD3 LYS B 70 23.929 23.214 -20.115 1.00 0.00 H ATOM 2687 HE2 LYS B 70 21.537 23.812 -20.778 1.00 0.00 H ATOM 2688 HE3 LYS B 70 22.762 23.940 -22.062 1.00 0.00 H ATOM 2689 HZ1 LYS B 70 21.648 26.217 -20.487 1.00 0.00 H ATOM 2690 HZ2 LYS B 70 22.817 26.339 -21.714 1.00 0.00 H ATOM 2691 HZ3 LYS B 70 21.243 25.820 -22.089 1.00 0.00 H ATOM 2692 H LYS B 70 23.607 26.500 -16.663 1.00 0.00 H ATOM 2693 N ALA B 71 23.387 22.774 -14.372 1.00 25.75 N ATOM 2694 CA ALA B 71 23.944 21.988 -13.309 1.00 25.25 C ATOM 2695 C ALA B 71 23.792 20.495 -13.620 1.00 24.84 C ATOM 2696 O ALA B 71 22.913 20.110 -14.403 1.00 21.88 O ATOM 2697 CB ALA B 71 23.255 22.307 -11.987 1.00 23.30 C ATOM 2698 HA ALA B 71 25.003 22.233 -13.223 1.00 0.00 H ATOM 2699 HB1 ALA B 71 23.390 23.363 -11.754 1.00 0.00 H ATOM 2700 HB2 ALA B 71 22.191 22.085 -12.070 1.00 0.00 H ATOM 2701 HB3 ALA B 71 23.693 21.700 -11.195 1.00 0.00 H ATOM 2702 H ALA B 71 22.422 22.547 -14.685 1.00 0.00 H ATOM 2703 N ILE B 72 24.695 19.693 -13.083 1.00 22.04 N ATOM 2704 CA ILE B 72 24.577 18.239 -13.193 1.00 23.56 C ATOM 2705 C ILE B 72 24.826 17.667 -11.863 1.00 23.75 C ATOM 2706 O ILE B 72 25.962 17.733 -11.366 1.00 25.49 O ATOM 2707 CB ILE B 72 25.547 17.576 -14.198 1.00 24.82 C ATOM 2708 CG1 ILE B 72 25.456 18.289 -15.535 1.00 25.66 C ATOM 2709 CG2 ILE B 72 25.166 16.057 -14.312 1.00 25.17 C ATOM 2710 CD1 ILE B 72 26.233 17.624 -16.670 1.00 25.45 C ATOM 2711 HA ILE B 72 23.574 18.038 -13.571 1.00 0.00 H ATOM 2712 HB ILE B 72 26.581 17.653 -13.861 1.00 0.00 H ATOM 2713 HG12 ILE B 72 24.406 18.335 -15.824 1.00 0.00 H ATOM 2714 HG13 ILE B 72 25.841 19.301 -15.407 1.00 0.00 H ATOM 2715 HD11 ILE B 72 27.290 17.580 -16.408 1.00 0.00 H ATOM 2716 HD12 ILE B 72 25.854 16.614 -16.825 1.00 0.00 H ATOM 2717 HD13 ILE B 72 26.108 18.205 -17.584 1.00 0.00 H ATOM 2718 HG21 ILE B 72 25.258 15.586 -13.333 1.00 0.00 H ATOM 2719 HG22 ILE B 72 24.139 15.967 -14.665 1.00 0.00 H ATOM 2720 HG23 ILE B 72 25.838 15.567 -15.017 1.00 0.00 H ATOM 2721 H ILE B 72 25.504 20.103 -12.573 1.00 0.00 H ATOM 2722 N GLY B 73 23.795 17.074 -11.248 1.00 22.09 N ATOM 2723 CA GLY B 73 23.991 16.594 -9.892 1.00 20.01 C ATOM 2724 C GLY B 73 22.934 15.648 -9.354 1.00 21.63 C ATOM 2725 O GLY B 73 22.095 15.108 -10.088 1.00 19.86 O ATOM 2726 HA3 GLY B 73 24.026 17.462 -9.234 1.00 0.00 H ATOM 2727 HA2 GLY B 73 24.949 16.075 -9.858 1.00 0.00 H ATOM 2728 H GLY B 73 22.880 16.960 -11.728 1.00 0.00 H ATOM 2729 N THR B 74 22.960 15.483 -8.029 1.00 20.88 N ATOM 2730 CA THR B 74 22.079 14.556 -7.393 1.00 23.10 C ATOM 2731 C THR B 74 20.747 15.249 -7.175 1.00 21.46 C ATOM 2732 O THR B 74 20.694 16.373 -6.705 1.00 20.80 O ATOM 2733 CB THR B 74 22.679 14.068 -6.088 1.00 25.09 C ATOM 2734 OG1 THR B 74 23.758 13.185 -6.389 1.00 26.72 O ATOM 2735 CG2 THR B 74 21.660 13.185 -5.237 1.00 23.04 C ATOM 2736 HA THR B 74 21.928 13.677 -8.019 1.00 0.00 H ATOM 2737 HB THR B 74 22.969 14.956 -5.527 1.00 0.00 H ATOM 2738 HG1 THR B 74 23.418 12.417 -6.913 1.00 0.00 H ATOM 2739 HG23 THR B 74 20.797 13.791 -4.963 1.00 0.00 H ATOM 2740 HG21 THR B 74 21.333 12.334 -5.834 1.00 0.00 H ATOM 2741 HG22 THR B 74 22.156 12.828 -4.334 1.00 0.00 H ATOM 2742 H THR B 74 23.628 16.035 -7.455 1.00 0.00 H ATOM 2743 N VAL B 75 19.700 14.531 -7.526 1.00 19.34 N ATOM 2744 CA VAL B 75 18.324 14.956 -7.356 1.00 20.21 C ATOM 2745 C VAL B 75 17.541 13.866 -6.652 1.00 20.39 C ATOM 2746 O VAL B 75 17.565 12.694 -7.078 1.00 20.69 O ATOM 2747 CB VAL B 75 17.688 15.269 -8.711 1.00 22.54 C ATOM 2748 CG1 VAL B 75 16.236 15.623 -8.579 1.00 23.76 C ATOM 2749 CG2 VAL B 75 18.417 16.409 -9.404 1.00 22.95 C ATOM 2750 HA VAL B 75 18.306 15.863 -6.751 1.00 0.00 H ATOM 2751 HB VAL B 75 17.772 14.363 -9.312 1.00 0.00 H ATOM 2752 HG11 VAL B 75 15.698 14.786 -8.134 1.00 0.00 H ATOM 2753 HG12 VAL B 75 16.134 16.502 -7.942 1.00 0.00 H ATOM 2754 HG13 VAL B 75 15.825 15.838 -9.565 1.00 0.00 H ATOM 2755 HG21 VAL B 75 18.369 17.302 -8.780 1.00 0.00 H ATOM 2756 HG22 VAL B 75 19.459 16.130 -9.562 1.00 0.00 H ATOM 2757 HG23 VAL B 75 17.944 16.610 -10.365 1.00 0.00 H ATOM 2758 H VAL B 75 19.871 13.598 -7.953 1.00 0.00 H ATOM 2759 N LEU B 76 16.893 14.245 -5.550 1.00 19.74 N ATOM 2760 CA LEU B 76 16.045 13.351 -4.791 1.00 19.53 C ATOM 2761 C LEU B 76 14.581 13.577 -5.189 1.00 22.33 C ATOM 2762 O LEU B 76 14.152 14.717 -5.462 1.00 24.05 O ATOM 2763 CB LEU B 76 16.165 13.553 -3.289 1.00 20.61 C ATOM 2764 CG LEU B 76 17.556 13.704 -2.718 1.00 21.03 C ATOM 2765 CD1 LEU B 76 17.473 13.887 -1.209 1.00 21.26 C ATOM 2766 CD2 LEU B 76 18.418 12.519 -3.152 1.00 21.64 C ATOM 2767 HA LEU B 76 16.372 12.337 -5.021 1.00 0.00 H ATOM 2768 HB2 LEU B 76 15.607 14.454 -3.034 1.00 0.00 H ATOM 2769 HB3 LEU B 76 15.704 12.692 -2.805 1.00 0.00 H ATOM 2770 HG LEU B 76 18.043 14.598 -3.108 1.00 0.00 H ATOM 2771 HD21 LEU B 76 17.973 11.594 -2.785 1.00 0.00 H ATOM 2772 HD22 LEU B 76 18.473 12.491 -4.240 1.00 0.00 H ATOM 2773 HD23 LEU B 76 19.421 12.630 -2.739 1.00 0.00 H ATOM 2774 HD11 LEU B 76 16.890 14.780 -0.984 1.00 0.00 H ATOM 2775 HD12 LEU B 76 16.991 13.016 -0.765 1.00 0.00 H ATOM 2776 HD13 LEU B 76 18.478 13.995 -0.802 1.00 0.00 H ATOM 2777 H LEU B 76 17.002 15.226 -5.222 1.00 0.00 H ATOM 2778 N VAL B 77 13.824 12.487 -5.202 1.00 21.32 N ATOM 2779 CA VAL B 77 12.433 12.529 -5.615 1.00 21.97 C ATOM 2780 C VAL B 77 11.559 11.805 -4.598 1.00 21.86 C ATOM 2781 O VAL B 77 11.834 10.686 -4.153 1.00 22.44 O ATOM 2782 CB VAL B 77 12.210 11.948 -7.050 1.00 21.53 C ATOM 2783 CG1 VAL B 77 10.706 11.988 -7.434 1.00 22.97 C ATOM 2784 CG2 VAL B 77 13.051 12.667 -8.091 1.00 21.79 C ATOM 2785 HA VAL B 77 12.143 13.579 -5.656 1.00 0.00 H ATOM 2786 HB VAL B 77 12.536 10.908 -7.032 1.00 0.00 H ATOM 2787 HG11 VAL B 77 10.134 11.394 -6.721 1.00 0.00 H ATOM 2788 HG12 VAL B 77 10.354 13.020 -7.414 1.00 0.00 H ATOM 2789 HG13 VAL B 77 10.577 11.579 -8.436 1.00 0.00 H ATOM 2790 HG21 VAL B 77 12.784 13.724 -8.105 1.00 0.00 H ATOM 2791 HG22 VAL B 77 14.106 12.561 -7.840 1.00 0.00 H ATOM 2792 HG23 VAL B 77 12.864 12.230 -9.072 1.00 0.00 H ATOM 2793 H VAL B 77 14.238 11.579 -4.909 1.00 0.00 H ATOM 2794 N GLY B 78 10.540 12.505 -4.128 1.00 24.61 N ATOM 2795 CA GLY B 78 9.645 11.932 -3.138 1.00 25.69 C ATOM 2796 C GLY B 78 8.526 12.853 -2.769 1.00 25.76 C ATOM 2797 O GLY B 78 8.323 13.860 -3.444 1.00 24.24 O ATOM 2798 HA3 GLY B 78 10.219 11.703 -2.240 1.00 0.00 H ATOM 2799 HA2 GLY B 78 9.221 11.012 -3.541 1.00 0.00 H ATOM 2800 H GLY B 78 10.378 13.474 -4.470 1.00 0.00 H ATOM 2801 N PRO B 79 7.848 12.545 -1.653 1.00 26.83 N ATOM 2802 CA PRO B 79 6.663 13.284 -1.228 1.00 27.25 C ATOM 2803 C PRO B 79 6.994 14.549 -0.460 1.00 25.81 C ATOM 2804 O PRO B 79 6.633 14.786 0.669 1.00 27.83 O ATOM 2805 CB PRO B 79 5.928 12.256 -0.352 1.00 26.94 C ATOM 2806 CG PRO B 79 6.973 11.498 0.272 1.00 27.46 C ATOM 2807 CD PRO B 79 8.129 11.434 -0.728 1.00 27.01 C ATOM 2808 HA PRO B 79 6.072 13.649 -2.068 1.00 0.00 H ATOM 2809 HD3 PRO B 79 9.086 11.577 -0.227 1.00 0.00 H ATOM 2810 HD2 PRO B 79 8.136 10.480 -1.255 1.00 0.00 H ATOM 2811 HG3 PRO B 79 6.621 10.493 0.504 1.00 0.00 H ATOM 2812 HG2 PRO B 79 7.297 11.989 1.190 1.00 0.00 H ATOM 2813 HB2 PRO B 79 5.316 12.757 0.398 1.00 0.00 H ATOM 2814 HB3 PRO B 79 5.297 11.611 -0.963 1.00 0.00 H ATOM 2815 N THR B 80 7.747 15.415 -1.116 1.00 27.14 N ATOM 2816 CA THR B 80 8.062 16.686 -0.515 1.00 23.34 C ATOM 2817 C THR B 80 6.952 17.650 -0.793 1.00 23.69 C ATOM 2818 O THR B 80 6.309 17.562 -1.842 1.00 23.84 O ATOM 2819 CB THR B 80 9.338 17.277 -1.105 1.00 22.03 C ATOM 2820 OG1 THR B 80 9.470 18.609 -0.651 1.00 20.85 O ATOM 2821 CG2 THR B 80 9.287 17.392 -2.572 1.00 21.57 C ATOM 2822 HA THR B 80 8.196 16.524 0.555 1.00 0.00 H ATOM 2823 HB THR B 80 10.151 16.616 -0.804 1.00 0.00 H ATOM 2824 HG1 THR B 80 10.296 19.004 -1.028 1.00 0.00 H ATOM 2825 HG23 THR B 80 9.184 16.399 -3.010 1.00 0.00 H ATOM 2826 HG21 THR B 80 8.433 18.006 -2.858 1.00 0.00 H ATOM 2827 HG22 THR B 80 10.206 17.856 -2.931 1.00 0.00 H ATOM 2828 H THR B 80 8.110 15.180 -2.062 1.00 0.00 H ATOM 2829 N PRO B 81 6.663 18.559 0.142 1.00 25.22 N ATOM 2830 CA PRO B 81 5.577 19.530 -0.080 1.00 25.66 C ATOM 2831 C PRO B 81 5.783 20.532 -1.221 1.00 28.23 C ATOM 2832 O PRO B 81 4.766 20.987 -1.780 1.00 28.51 O ATOM 2833 CB PRO B 81 5.492 20.275 1.252 1.00 26.37 C ATOM 2834 CG PRO B 81 5.978 19.389 2.194 1.00 27.19 C ATOM 2835 CD PRO B 81 7.151 18.607 1.527 1.00 26.14 C ATOM 2836 HA PRO B 81 4.677 18.998 -0.386 1.00 0.00 H ATOM 2837 HD3 PRO B 81 8.095 19.146 1.606 1.00 0.00 H ATOM 2838 HD2 PRO B 81 7.267 17.610 1.951 1.00 0.00 H ATOM 2839 HG3 PRO B 81 5.192 18.697 2.498 1.00 0.00 H ATOM 2840 HG2 PRO B 81 6.339 19.932 3.067 1.00 0.00 H ATOM 2841 HB2 PRO B 81 6.102 21.178 1.225 1.00 0.00 H ATOM 2842 HB3 PRO B 81 4.459 20.543 1.475 1.00 0.00 H ATOM 2843 N VAL B 82 7.036 20.803 -1.595 1.00 25.51 N ATOM 2844 CA VAL B 82 7.394 21.737 -2.706 1.00 24.36 C ATOM 2845 C VAL B 82 8.750 21.360 -3.272 1.00 23.57 C ATOM 2846 O VAL B 82 9.578 20.729 -2.561 1.00 20.15 O ATOM 2847 CB VAL B 82 7.531 23.210 -2.233 1.00 28.98 C ATOM 2848 CG1 VAL B 82 6.185 23.807 -1.876 1.00 32.79 C ATOM 2849 CG2 VAL B 82 8.522 23.306 -1.072 1.00 28.55 C ATOM 2850 HA VAL B 82 6.589 21.656 -3.437 1.00 0.00 H ATOM 2851 HB VAL B 82 7.925 23.800 -3.061 1.00 0.00 H ATOM 2852 HG11 VAL B 82 5.535 23.784 -2.751 1.00 0.00 H ATOM 2853 HG12 VAL B 82 5.733 23.227 -1.071 1.00 0.00 H ATOM 2854 HG13 VAL B 82 6.321 24.838 -1.550 1.00 0.00 H ATOM 2855 HG21 VAL B 82 8.166 22.697 -0.241 1.00 0.00 H ATOM 2856 HG22 VAL B 82 9.497 22.944 -1.398 1.00 0.00 H ATOM 2857 HG23 VAL B 82 8.606 24.345 -0.753 1.00 0.00 H ATOM 2858 H VAL B 82 7.810 20.336 -1.082 1.00 0.00 H ATOM 2859 N ASN B 83 9.001 21.739 -4.521 1.00 21.43 N ATOM 2860 CA ASN B 83 10.299 21.494 -5.172 1.00 20.44 C ATOM 2861 C ASN B 83 11.312 22.336 -4.466 1.00 20.25 C ATOM 2862 O ASN B 83 11.100 23.519 -4.276 1.00 21.45 O ATOM 2863 CB ASN B 83 10.288 21.842 -6.645 1.00 20.10 C ATOM 2864 CG ASN B 83 9.383 20.911 -7.494 1.00 23.12 C ATOM 2865 OD1 ASN B 83 9.293 19.732 -7.235 1.00 25.04 O ATOM 2866 ND2 ASN B 83 8.673 21.480 -8.510 1.00 21.43 N ATOM 2867 HA ASN B 83 10.533 20.431 -5.107 1.00 0.00 H ATOM 2868 HB2 ASN B 83 9.930 22.866 -6.755 1.00 0.00 H ATOM 2869 HB3 ASN B 83 11.308 21.772 -7.024 1.00 0.00 H ATOM 2870 HD22 ASN B 83 8.772 22.496 -8.708 1.00 0.00 H ATOM 2871 HD21 ASN B 83 8.033 20.898 -9.087 1.00 0.00 H ATOM 2872 H ASN B 83 8.255 22.226 -5.057 1.00 0.00 H ATOM 2873 N ILE B 84 12.413 21.710 -4.052 1.00 17.87 N ATOM 2874 CA ILE B 84 13.436 22.372 -3.213 1.00 19.61 C ATOM 2875 C ILE B 84 14.808 22.213 -3.859 1.00 20.84 C ATOM 2876 O ILE B 84 15.238 21.064 -4.114 1.00 18.39 O ATOM 2877 CB ILE B 84 13.511 21.668 -1.810 1.00 21.66 C ATOM 2878 CG1 ILE B 84 12.270 22.048 -0.981 1.00 24.34 C ATOM 2879 CG2 ILE B 84 14.759 22.029 -1.073 1.00 24.40 C ATOM 2880 CD1 ILE B 84 12.144 21.204 0.335 1.00 26.12 C ATOM 2881 HA ILE B 84 13.167 23.423 -3.110 1.00 0.00 H ATOM 2882 HB ILE B 84 13.532 20.590 -1.970 1.00 0.00 H ATOM 2883 HG12 ILE B 84 12.337 23.103 -0.715 1.00 0.00 H ATOM 2884 HG13 ILE B 84 11.380 21.884 -1.588 1.00 0.00 H ATOM 2885 HD11 ILE B 84 12.067 20.147 0.081 1.00 0.00 H ATOM 2886 HD12 ILE B 84 13.025 21.367 0.955 1.00 0.00 H ATOM 2887 HD13 ILE B 84 11.252 21.514 0.880 1.00 0.00 H ATOM 2888 HG21 ILE B 84 15.626 21.721 -1.657 1.00 0.00 H ATOM 2889 HG22 ILE B 84 14.788 23.107 -0.917 1.00 0.00 H ATOM 2890 HG23 ILE B 84 14.770 21.521 -0.109 1.00 0.00 H ATOM 2891 H ILE B 84 12.559 20.718 -4.329 1.00 0.00 H ATOM 2892 N ILE B 85 15.485 23.335 -4.066 1.00 19.29 N ATOM 2893 CA ILE B 85 16.847 23.362 -4.559 1.00 18.54 C ATOM 2894 C ILE B 85 17.768 23.573 -3.380 1.00 19.68 C ATOM 2895 O ILE B 85 17.768 24.652 -2.764 1.00 18.57 O ATOM 2896 CB ILE B 85 17.120 24.514 -5.547 1.00 19.19 C ATOM 2897 CG1 ILE B 85 16.183 24.452 -6.753 1.00 20.26 C ATOM 2898 CG2 ILE B 85 18.545 24.437 -6.030 1.00 20.31 C ATOM 2899 CD1 ILE B 85 15.935 23.103 -7.270 1.00 19.92 C ATOM 2900 HA ILE B 85 17.014 22.419 -5.080 1.00 0.00 H ATOM 2901 HB ILE B 85 16.946 25.453 -5.022 1.00 0.00 H ATOM 2902 HG12 ILE B 85 15.226 24.885 -6.462 1.00 0.00 H ATOM 2903 HG13 ILE B 85 16.621 25.047 -7.554 1.00 0.00 H ATOM 2904 HD11 ILE B 85 16.879 22.655 -7.581 1.00 0.00 H ATOM 2905 HD12 ILE B 85 15.483 22.493 -6.488 1.00 0.00 H ATOM 2906 HD13 ILE B 85 15.260 23.161 -8.124 1.00 0.00 H ATOM 2907 HG21 ILE B 85 19.221 24.521 -5.179 1.00 0.00 H ATOM 2908 HG22 ILE B 85 18.706 23.483 -6.531 1.00 0.00 H ATOM 2909 HG23 ILE B 85 18.735 25.252 -6.728 1.00 0.00 H ATOM 2910 H ILE B 85 15.015 24.240 -3.864 1.00 0.00 H ATOM 2911 N GLY B 86 18.517 22.555 -3.055 1.00 20.19 N ATOM 2912 CA GLY B 86 19.320 22.580 -1.862 1.00 20.34 C ATOM 2913 C GLY B 86 20.771 22.925 -2.102 1.00 19.73 C ATOM 2914 O GLY B 86 21.193 23.261 -3.236 1.00 20.11 O ATOM 2915 HA3 GLY B 86 19.274 21.595 -1.398 1.00 0.00 H ATOM 2916 HA2 GLY B 86 18.900 23.321 -1.182 1.00 0.00 H ATOM 2917 H GLY B 86 18.534 21.714 -3.667 1.00 0.00 H ATOM 2918 N ARG B 87 21.579 22.814 -1.049 1.00 20.66 N ATOM 2919 CA ARG B 87 22.936 23.350 -1.125 1.00 22.47 C ATOM 2920 C ARG B 87 23.787 22.589 -2.134 1.00 21.73 C ATOM 2921 O ARG B 87 24.732 23.169 -2.733 1.00 22.77 O ATOM 2922 CB ARG B 87 23.629 23.398 0.247 1.00 21.77 C ATOM 2923 CG ARG B 87 23.035 24.322 1.264 1.00 22.52 C ATOM 2924 CD ARG B 87 23.877 24.447 2.532 1.00 22.75 C ATOM 2925 NE ARG B 87 23.909 23.196 3.285 1.00 23.44 N ATOM 2926 CZ ARG B 87 24.920 22.307 3.221 1.00 24.41 C ATOM 2927 NH1 ARG B 87 24.824 21.191 3.882 1.00 24.04 N ATOM 2928 NH2 ARG B 87 26.047 22.569 2.545 1.00 23.97 N ATOM 2929 HA ARG B 87 22.837 24.378 -1.472 1.00 0.00 H ATOM 2930 HB2 ARG B 87 23.610 22.391 0.663 1.00 0.00 H ATOM 2931 HB3 ARG B 87 24.663 23.704 0.086 1.00 0.00 H ATOM 2932 HG2 ARG B 87 22.934 25.311 0.816 1.00 0.00 H ATOM 2933 HG3 ARG B 87 22.049 23.947 1.539 1.00 0.00 H ATOM 2934 HD2 ARG B 87 23.453 25.228 3.163 1.00 0.00 H ATOM 2935 HD3 ARG B 87 24.895 24.719 2.255 1.00 0.00 H ATOM 2936 HE ARG B 87 23.104 22.978 3.907 1.00 0.00 H ATOM 2937 HH12 ARG B 87 25.596 20.495 3.842 1.00 0.00 H ATOM 2938 HH11 ARG B 87 23.975 20.994 4.450 1.00 0.00 H ATOM 2939 HH22 ARG B 87 26.810 21.863 2.513 1.00 0.00 H ATOM 2940 HH21 ARG B 87 26.158 23.478 2.052 1.00 0.00 H ATOM 2941 H ARG B 87 21.247 22.350 -0.180 1.00 0.00 H ATOM 2942 N ASN B 88 23.513 21.298 -2.323 1.00 20.62 N ATOM 2943 CA ASN B 88 24.299 20.559 -3.311 1.00 21.95 C ATOM 2944 C ASN B 88 24.323 21.272 -4.673 1.00 24.12 C ATOM 2945 O ASN B 88 25.396 21.355 -5.330 1.00 25.91 O ATOM 2946 CB ASN B 88 23.886 19.102 -3.439 1.00 20.55 C ATOM 2947 CG ASN B 88 22.574 18.940 -4.143 1.00 20.38 C ATOM 2948 OD1 ASN B 88 21.523 19.553 -3.773 1.00 21.89 O ATOM 2949 ND2 ASN B 88 22.608 18.178 -5.200 1.00 19.12 N ATOM 2950 HA ASN B 88 25.321 20.546 -2.932 1.00 0.00 H ATOM 2951 HB2 ASN B 88 24.653 18.568 -4.000 1.00 0.00 H ATOM 2952 HB3 ASN B 88 23.803 18.672 -2.441 1.00 0.00 H ATOM 2953 HD22 ASN B 88 23.490 17.696 -5.465 1.00 0.00 H ATOM 2954 HD21 ASN B 88 21.753 18.052 -5.778 1.00 0.00 H ATOM 2955 H ASN B 88 22.759 20.828 -1.782 1.00 0.00 H ATOM 2956 N LEU B 89 23.169 21.817 -5.099 1.00 23.21 N ATOM 2957 CA LEU B 89 23.118 22.543 -6.341 1.00 21.74 C ATOM 2958 C LEU B 89 23.349 24.018 -6.212 1.00 22.00 C ATOM 2959 O LEU B 89 23.878 24.638 -7.130 1.00 22.15 O ATOM 2960 CB LEU B 89 21.829 22.268 -7.115 1.00 20.71 C ATOM 2961 CG LEU B 89 21.573 20.806 -7.456 1.00 23.01 C ATOM 2962 CD1 LEU B 89 20.248 20.569 -8.155 1.00 24.41 C ATOM 2963 CD2 LEU B 89 22.712 20.217 -8.273 1.00 24.61 C ATOM 2964 HA LEU B 89 23.962 22.156 -6.912 1.00 0.00 H ATOM 2965 HB2 LEU B 89 20.993 22.625 -6.514 1.00 0.00 H ATOM 2966 HB3 LEU B 89 21.870 22.829 -8.048 1.00 0.00 H ATOM 2967 HG LEU B 89 21.519 20.290 -6.497 1.00 0.00 H ATOM 2968 HD21 LEU B 89 22.817 20.776 -9.203 1.00 0.00 H ATOM 2969 HD22 LEU B 89 23.638 20.282 -7.702 1.00 0.00 H ATOM 2970 HD23 LEU B 89 22.494 19.173 -8.497 1.00 0.00 H ATOM 2971 HD11 LEU B 89 19.434 20.901 -7.510 1.00 0.00 H ATOM 2972 HD12 LEU B 89 20.226 21.131 -9.089 1.00 0.00 H ATOM 2973 HD13 LEU B 89 20.135 19.506 -8.366 1.00 0.00 H ATOM 2974 H LEU B 89 22.307 21.713 -4.526 1.00 0.00 H ATOM 2975 N LEU B 90 22.941 24.613 -5.107 1.00 20.52 N ATOM 2976 CA LEU B 90 23.222 26.046 -4.915 1.00 21.24 C ATOM 2977 C LEU B 90 24.736 26.345 -5.009 1.00 21.58 C ATOM 2978 O LEU B 90 25.180 27.350 -5.600 1.00 24.13 O ATOM 2979 CB LEU B 90 22.659 26.518 -3.571 1.00 20.78 C ATOM 2980 CG LEU B 90 21.155 26.407 -3.386 1.00 19.12 C ATOM 2981 CD1 LEU B 90 20.788 26.786 -1.925 1.00 21.01 C ATOM 2982 CD2 LEU B 90 20.353 27.263 -4.398 1.00 21.28 C ATOM 2983 HA LEU B 90 22.730 26.597 -5.717 1.00 0.00 H ATOM 2984 HB2 LEU B 90 23.133 25.927 -2.788 1.00 0.00 H ATOM 2985 HB3 LEU B 90 22.931 27.566 -3.448 1.00 0.00 H ATOM 2986 HG LEU B 90 20.874 25.372 -3.583 1.00 0.00 H ATOM 2987 HD21 LEU B 90 20.624 28.312 -4.280 1.00 0.00 H ATOM 2988 HD22 LEU B 90 20.586 26.938 -5.412 1.00 0.00 H ATOM 2989 HD23 LEU B 90 19.286 27.139 -4.212 1.00 0.00 H ATOM 2990 HD11 LEU B 90 21.292 26.107 -1.237 1.00 0.00 H ATOM 2991 HD12 LEU B 90 21.106 27.809 -1.726 1.00 0.00 H ATOM 2992 HD13 LEU B 90 19.709 26.707 -1.791 1.00 0.00 H ATOM 2993 H LEU B 90 22.427 24.076 -4.380 1.00 0.00 H ATOM 2994 N THR B 91 25.531 25.454 -4.469 1.00 25.24 N ATOM 2995 CA THR B 91 26.976 25.547 -4.640 1.00 26.05 C ATOM 2996 C THR B 91 27.411 25.454 -6.109 1.00 26.97 C ATOM 2997 O THR B 91 28.290 26.223 -6.512 1.00 27.15 O ATOM 2998 CB THR B 91 27.740 24.560 -3.804 1.00 24.82 C ATOM 2999 OG1 THR B 91 27.267 23.215 -4.007 1.00 24.59 O ATOM 3000 CG2 THR B 91 27.605 24.890 -2.312 1.00 24.23 C ATOM 3001 HA THR B 91 27.230 26.544 -4.279 1.00 0.00 H ATOM 3002 HB THR B 91 28.783 24.630 -4.114 1.00 0.00 H ATOM 3003 HG1 THR B 91 27.791 22.593 -3.442 1.00 0.00 H ATOM 3004 HG23 THR B 91 27.958 25.906 -2.132 1.00 0.00 H ATOM 3005 HG21 THR B 91 26.559 24.810 -2.017 1.00 0.00 H ATOM 3006 HG22 THR B 91 28.203 24.188 -1.730 1.00 0.00 H ATOM 3007 H THR B 91 25.127 24.673 -3.913 1.00 0.00 H ATOM 3008 N GLN B 92 26.807 24.581 -6.916 1.00 25.42 N ATOM 3009 CA GLN B 92 27.214 24.497 -8.312 1.00 27.21 C ATOM 3010 C GLN B 92 26.980 25.750 -9.063 1.00 28.61 C ATOM 3011 O GLN B 92 27.730 26.069 -9.982 1.00 30.59 O ATOM 3012 CB GLN B 92 26.489 23.406 -9.125 1.00 26.48 C ATOM 3013 CG GLN B 92 27.017 22.039 -8.875 1.00 27.67 C ATOM 3014 CD GLN B 92 26.605 20.961 -9.907 1.00 25.73 C ATOM 3015 OE1 GLN B 92 26.511 21.216 -11.117 1.00 27.16 O ATOM 3016 NE2 GLN B 92 26.529 19.764 -9.442 1.00 25.63 N ATOM 3017 HA GLN B 92 28.276 24.267 -8.223 1.00 0.00 H ATOM 3018 HB2 GLN B 92 25.432 23.423 -8.861 1.00 0.00 H ATOM 3019 HB3 GLN B 92 26.601 23.632 -10.185 1.00 0.00 H ATOM 3020 HG2 GLN B 92 28.105 22.096 -8.867 1.00 0.00 H ATOM 3021 HG3 GLN B 92 26.664 21.717 -7.895 1.00 0.00 H ATOM 3022 HE22 GLN B 92 26.613 19.597 -8.419 1.00 0.00 H ATOM 3023 HE21 GLN B 92 26.383 18.963 -10.089 1.00 0.00 H ATOM 3024 H GLN B 92 26.052 23.966 -6.552 1.00 0.00 H ATOM 3025 N ILE B 93 25.893 26.441 -8.756 1.00 26.72 N ATOM 3026 CA ILE B 93 25.622 27.639 -9.477 1.00 27.11 C ATOM 3027 C ILE B 93 26.316 28.872 -8.891 1.00 27.13 C ATOM 3028 O ILE B 93 26.187 29.944 -9.450 1.00 29.10 O ATOM 3029 CB ILE B 93 24.088 27.846 -9.641 1.00 28.54 C ATOM 3030 CG1 ILE B 93 23.425 28.056 -8.270 1.00 30.27 C ATOM 3031 CG2 ILE B 93 23.458 26.653 -10.350 1.00 28.35 C ATOM 3032 CD1 ILE B 93 21.919 28.200 -8.345 1.00 31.58 C ATOM 3033 HA ILE B 93 26.055 27.516 -10.470 1.00 0.00 H ATOM 3034 HB ILE B 93 23.927 28.736 -10.249 1.00 0.00 H ATOM 3035 HG12 ILE B 93 23.659 27.199 -7.638 1.00 0.00 H ATOM 3036 HG13 ILE B 93 23.837 28.960 -7.822 1.00 0.00 H ATOM 3037 HD11 ILE B 93 21.668 29.060 -8.966 1.00 0.00 H ATOM 3038 HD12 ILE B 93 21.490 27.298 -8.782 1.00 0.00 H ATOM 3039 HD13 ILE B 93 21.519 28.345 -7.342 1.00 0.00 H ATOM 3040 HG21 ILE B 93 23.907 26.540 -11.337 1.00 0.00 H ATOM 3041 HG22 ILE B 93 23.632 25.750 -9.764 1.00 0.00 H ATOM 3042 HG23 ILE B 93 22.386 26.819 -10.454 1.00 0.00 H ATOM 3043 H ILE B 93 25.251 26.116 -8.005 1.00 0.00 H ATOM 3044 N GLY B 94 27.018 28.722 -7.774 1.00 26.43 N ATOM 3045 CA GLY B 94 27.834 29.799 -7.201 1.00 26.18 C ATOM 3046 C GLY B 94 27.031 30.709 -6.314 1.00 25.48 C ATOM 3047 O GLY B 94 27.270 31.902 -6.268 1.00 23.15 O ATOM 3048 HA3 GLY B 94 28.261 30.387 -8.014 1.00 0.00 H ATOM 3049 HA2 GLY B 94 28.638 29.356 -6.614 1.00 0.00 H ATOM 3050 H GLY B 94 26.988 27.804 -7.285 1.00 0.00 H ATOM 3051 N CYS B 95 26.004 30.136 -5.675 1.00 24.07 N ATOM 3052 CA CYS B 95 25.067 30.905 -4.835 1.00 23.32 C ATOM 3053 C CYS B 95 25.626 31.122 -3.460 1.00 22.59 C ATOM 3054 O CYS B 95 26.109 30.225 -2.859 1.00 25.77 O ATOM 3055 CB CYS B 95 23.712 30.169 -4.725 1.00 23.60 C ATOM 3056 SG CYS B 95 22.403 31.194 -4.027 1.00 26.86 S ATOM 3057 HA CYS B 95 24.918 31.874 -5.310 1.00 0.00 H ATOM 3058 HB2 CYS B 95 23.843 29.293 -4.089 1.00 0.00 H ATOM 3059 HB3 CYS B 95 23.408 29.850 -5.722 1.00 0.00 H ATOM 3060 HG CYS B 95 21.233 30.464 -3.964 1.00 0.00 H ATOM 3061 H CYS B 95 25.861 29.111 -5.775 1.00 0.00 H ATOM 3062 N THR B 96 25.621 32.374 -2.994 1.00 24.86 N ATOM 3063 CA THR B 96 25.987 32.662 -1.648 1.00 22.14 C ATOM 3064 C THR B 96 24.911 33.467 -0.945 1.00 22.64 C ATOM 3065 O THR B 96 24.061 34.031 -1.577 1.00 23.99 O ATOM 3066 CB THR B 96 27.335 33.484 -1.614 1.00 23.49 C ATOM 3067 OG1 THR B 96 27.191 34.677 -2.407 1.00 25.36 O ATOM 3068 CG2 THR B 96 28.454 32.710 -2.238 1.00 24.25 C ATOM 3069 HA THR B 96 26.114 31.710 -1.132 1.00 0.00 H ATOM 3070 HB THR B 96 27.553 33.705 -0.569 1.00 0.00 H ATOM 3071 HG1 THR B 96 26.980 34.427 -3.341 1.00 0.00 H ATOM 3072 HG23 THR B 96 28.613 31.788 -1.678 1.00 0.00 H ATOM 3073 HG21 THR B 96 28.197 32.470 -3.270 1.00 0.00 H ATOM 3074 HG22 THR B 96 29.364 33.310 -2.219 1.00 0.00 H ATOM 3075 H THR B 96 25.345 33.153 -3.626 1.00 0.00 H ATOM 3076 N LEU B 97 24.963 33.518 0.379 1.00 22.05 N ATOM 3077 CA LEU B 97 24.147 34.491 1.140 1.00 21.85 C ATOM 3078 C LEU B 97 25.001 35.706 1.452 1.00 23.76 C ATOM 3079 O LEU B 97 26.170 35.570 1.782 1.00 23.84 O ATOM 3080 CB LEU B 97 23.679 33.887 2.475 1.00 21.92 C ATOM 3081 CG LEU B 97 22.673 32.748 2.393 1.00 19.90 C ATOM 3082 CD1 LEU B 97 22.667 31.991 3.693 1.00 20.94 C ATOM 3083 CD2 LEU B 97 21.288 33.313 2.002 1.00 21.95 C ATOM 3084 HA LEU B 97 23.278 34.759 0.539 1.00 0.00 H ATOM 3085 HB2 LEU B 97 24.560 33.513 2.996 1.00 0.00 H ATOM 3086 HB3 LEU B 97 23.225 34.688 3.059 1.00 0.00 H ATOM 3087 HG LEU B 97 22.952 32.035 1.617 1.00 0.00 H ATOM 3088 HD21 LEU B 97 20.964 34.032 2.755 1.00 0.00 H ATOM 3089 HD22 LEU B 97 21.359 33.807 1.033 1.00 0.00 H ATOM 3090 HD23 LEU B 97 20.568 32.497 1.943 1.00 0.00 H ATOM 3091 HD11 LEU B 97 23.661 31.586 3.881 1.00 0.00 H ATOM 3092 HD12 LEU B 97 22.389 32.665 4.503 1.00 0.00 H ATOM 3093 HD13 LEU B 97 21.946 31.175 3.634 1.00 0.00 H ATOM 3094 H LEU B 97 25.588 32.863 0.892 1.00 0.00 H ATOM 3095 N ASN B 98 24.389 36.889 1.402 1.00 25.08 N ATOM 3096 CA ASN B 98 25.133 38.139 1.621 1.00 26.11 C ATOM 3097 C ASN B 98 24.295 39.145 2.449 1.00 26.29 C ATOM 3098 O ASN B 98 23.112 39.365 2.164 1.00 24.81 O ATOM 3099 CB ASN B 98 25.502 38.751 0.275 1.00 26.07 C ATOM 3100 CG ASN B 98 26.403 37.858 -0.522 1.00 27.42 C ATOM 3101 OD1 ASN B 98 27.621 37.910 -0.370 1.00 27.63 O ATOM 3102 ND2 ASN B 98 25.812 36.978 -1.308 1.00 24.68 N ATOM 3103 HA ASN B 98 26.040 37.912 2.182 1.00 0.00 H ATOM 3104 HB2 ASN B 98 24.589 38.927 -0.293 1.00 0.00 H ATOM 3105 HB3 ASN B 98 26.010 39.700 0.447 1.00 0.00 H ATOM 3106 HD22 ASN B 98 24.776 36.977 -1.401 1.00 0.00 H ATOM 3107 HD21 ASN B 98 26.382 36.285 -1.834 1.00 0.00 H ATOM 3108 H ASN B 98 23.369 36.929 1.205 1.00 0.00 H ATOM 3109 N PHE B 99 24.907 39.703 3.470 1.00 30.10 N ATOM 3110 CA PHE B 99 24.305 40.837 4.191 1.00 30.65 C ATOM 3111 C PHE B 99 25.363 41.702 4.880 1.00 33.71 C ATOM 3112 O PHE B 99 24.981 42.713 5.479 1.00 33.29 O ATOM 3113 CB PHE B 99 23.302 40.320 5.215 1.00 30.88 C ATOM 3114 CG PHE B 99 23.881 39.370 6.244 1.00 31.02 C ATOM 3115 CD1 PHE B 99 24.307 39.830 7.475 1.00 32.34 C ATOM 3116 CD2 PHE B 99 23.898 37.999 6.008 1.00 30.28 C ATOM 3117 CE1 PHE B 99 24.789 38.947 8.443 1.00 32.96 C ATOM 3118 CE2 PHE B 99 24.373 37.118 6.939 1.00 30.81 C ATOM 3119 CZ PHE B 99 24.833 37.578 8.170 1.00 32.64 C ATOM 3120 HA PHE B 99 23.795 41.465 3.461 1.00 0.00 H ATOM 3121 OXT PHE B 99 26.549 41.349 4.862 1.00 36.45 O ATOM 3122 HB2 PHE B 99 22.882 41.177 5.742 1.00 0.00 H ATOM 3123 HB3 PHE B 99 22.508 39.799 4.680 1.00 0.00 H ATOM 3124 HD2 PHE B 99 23.524 37.618 5.058 1.00 0.00 H ATOM 3125 HE2 PHE B 99 24.392 36.051 6.717 1.00 0.00 H ATOM 3126 HZ PHE B 99 25.222 36.879 8.911 1.00 0.00 H ATOM 3127 HE1 PHE B 99 25.129 39.324 9.407 1.00 0.00 H ATOM 3128 HD1 PHE B 99 24.266 40.897 7.694 1.00 0.00 H ATOM 3129 H PHE B 99 25.832 39.337 3.774 1.00 0.00 H TER 3130 PHE B 99 HETATM 3131 O HOH 1 7.858 38.841 11.715 1.00 15.49 O HETATM 3132 O HOH 2 10.937 30.619 1.736 1.00 20.69 O HETATM 3133 O HOH 3 9.923 39.982 6.062 1.00 22.33 O HETATM 3134 O HOH 4 15.996 40.055 1.675 1.00 23.78 O HETATM 3135 O HOH 5 13.936 20.656 19.550 1.00 26.19 O HETATM 3136 O HOH 6 16.433 42.508 2.722 1.00 26.30 O HETATM 3137 O HOH 7 13.798 44.794 12.145 1.00 25.66 O HETATM 3138 O HOH 8 22.376 41.672 0.696 1.00 22.93 O HETATM 3139 O HOH 9 32.893 33.625 2.013 1.00 33.34 O HETATM 3140 O HOH 10 22.276 26.328 20.117 1.00 30.54 O HETATM 3141 O HOH 11 6.037 40.293 15.359 1.00 25.17 O HETATM 3142 O HOH 12 1.288 35.713 19.209 1.00 25.72 O HETATM 3143 O HOH 13 8.691 33.441 12.881 1.00 22.38 O HETATM 3144 O HOH 14 9.351 28.778 2.376 1.00 24.56 O HETATM 3145 O HOH 15 27.837 27.931 5.223 1.00 28.88 O HETATM 3146 O HOH 16 4.977 40.048 22.458 1.00 25.72 O HETATM 3147 O HOH 17 15.211 38.928 23.003 1.00 25.27 O HETATM 3148 O HOH 18 22.480 46.211 14.444 1.00 40.93 O HETATM 3149 O HOH 19 7.638 42.552 14.851 1.00 28.55 O HETATM 3150 O HOH 20 5.078 37.722 23.314 1.00 45.85 O HETATM 3151 O HOH 21 12.716 21.739 21.738 1.00 26.60 O HETATM 3152 O HOH 22 6.688 17.303 17.581 1.00 30.60 O HETATM 3153 O HOH 23 8.023 35.317 5.894 1.00 27.84 O HETATM 3154 O HOH 24 2.335 15.808 10.519 1.00 34.66 O HETATM 3155 O HOH 25 6.810 15.552 3.652 1.00 29.83 O HETATM 3156 O HOH 26 13.712 38.359 27.029 1.00 42.65 O HETATM 3157 O HOH 27 25.303 20.987 11.682 1.00 42.31 O HETATM 3158 O HOH 28 6.237 36.120 2.469 1.00 37.00 O HETATM 3159 O HOH 29 33.593 29.050 -2.580 1.00 38.44 O HETATM 3160 O HOH 30 28.323 28.650 -1.943 1.00 28.38 O HETATM 3161 O HOH 31 27.091 26.319 15.035 1.00 42.32 O HETATM 3162 O HOH 32 32.057 40.681 3.001 1.00 41.38 O HETATM 3163 O HOH 33 16.756 46.766 14.877 1.00 34.34 O HETATM 3164 O HOH 34 -1.662 31.723 25.391 1.00 45.34 O HETATM 3165 O HOH 35 19.511 22.899 22.817 1.00 41.44 O HETATM 3166 O HOH 36 4.249 18.891 17.564 1.00 29.60 O HETATM 3167 O HOH 37 -0.629 33.951 25.946 1.00 33.53 O HETATM 3168 O HOH 38 12.934 38.330 24.376 1.00 34.18 O HETATM 3169 O HOH 39 4.711 33.088 7.524 1.00 38.86 O HETATM 3170 O HOH 40 -0.820 36.629 20.762 1.00 34.33 O HETATM 3171 O HOH 41 24.285 39.701 -7.096 1.00 38.23 O HETATM 3172 O HOH 42 27.579 21.359 7.035 1.00 32.64 O HETATM 3173 O HOH 43 2.945 40.481 24.521 1.00 38.52 O HETATM 3174 O HOH 44 30.409 27.142 3.418 1.00 36.39 O HETATM 3175 O HOH 45 -3.998 24.326 20.399 1.00 37.88 O HETATM 3176 O HOH 46 7.252 45.251 15.557 1.00 37.95 O HETATM 3177 O HOH 47 -4.119 22.338 19.211 1.00 40.25 O HETATM 3178 O HOH 48 17.197 43.741 18.365 1.00 30.30 O HETATM 3179 O HOH 49 5.743 34.482 27.856 1.00 36.39 O HETATM 3180 O HOH 50 6.195 36.992 10.712 1.00 28.13 O HETATM 3181 O HOH 51 3.267 37.825 21.392 1.00 31.27 O HETATM 3182 O HOH 52 3.830 33.896 12.159 1.00 34.83 O HETATM 3183 O HOH 53 1.465 25.557 20.920 1.00 35.03 O HETATM 3184 O HOH 54 6.777 34.319 11.118 1.00 34.54 O HETATM 3185 O HOH 55 33.176 33.786 -0.773 1.00 39.95 O HETATM 3186 O HOH 56 4.549 32.982 2.791 1.00 38.98 O HETATM 3187 O HOH 57 5.587 34.315 5.163 1.00 36.36 O HETATM 3188 O HOH 58 9.456 17.302 16.320 1.00 37.55 O HETATM 3189 O HOH 59 -6.283 22.141 21.869 1.00 45.04 O HETATM 3190 O HOH 60 27.834 34.122 13.905 1.00 44.34 O HETATM 3191 O HOH 61 0.123 37.945 15.729 1.00 36.17 O HETATM 3192 O HOH 62 25.573 24.403 15.530 1.00 36.71 O HETATM 3193 O HOH 63 1.638 17.912 16.557 1.00 41.86 O HETATM 3194 O HOH 64 6.215 12.866 10.333 1.00 39.81 O HETATM 3195 O HOH 65 19.647 46.650 4.194 1.00 39.89 O HETATM 3196 O HOH 66 19.660 45.899 7.431 1.00 38.90 O HETATM 3197 O HOH 67 -3.970 30.244 17.361 1.00 35.64 O HETATM 3198 O HOH 68 19.122 39.253 23.710 1.00 42.82 O HETATM 3199 O HOH 69 3.443 30.905 9.490 1.00 46.28 O HETATM 3200 O HOH 70 15.775 41.441 24.386 1.00 37.94 O HETATM 3201 O HOH 71 2.818 13.776 7.002 1.00 40.59 O HETATM 3202 O HOH 72 18.339 49.128 15.054 1.00 39.21 O HETATM 3203 O HOH 73 29.120 34.030 20.762 1.00 51.41 O HETATM 3204 O HOH 74 -0.891 25.103 22.914 1.00 48.05 O HETATM 3205 O HOH 75 8.259 29.727 26.043 1.00 45.47 O HETATM 3206 O HOH 76 18.862 40.282 21.762 1.00 40.26 O HETATM 3207 O HOH 77 14.829 33.579 27.604 1.00 39.52 O HETATM 3208 O HOH 78 20.970 24.777 16.052 1.00 38.62 O HETATM 3209 O HOH 79 24.610 37.794 17.238 1.00 37.82 O HETATM 3210 O HOH 80 -2.510 35.341 22.657 1.00 36.99 O HETATM 3211 O HOH 81 -0.515 35.515 13.488 1.00 48.21 O HETATM 3212 O HOH 82 4.737 22.051 20.663 1.00 39.67 O HETATM 3213 O HOH 83 29.077 28.876 7.039 1.00 41.68 O HETATM 3214 O HOH 84 30.375 29.666 -3.888 1.00 44.69 O HETATM 3215 O HOH 85 19.775 44.850 11.028 1.00 47.43 O HETATM 3216 O HOH 86 23.217 31.204 26.579 1.00 47.99 O HETATM 3217 O HOH 87 21.067 25.939 22.432 1.00 40.80 O HETATM 3218 O HOH 88 20.177 23.351 18.223 1.00 50.75 O HETATM 3219 O HOH 89 23.966 46.036 11.731 1.00 57.66 O HETATM 3220 O HOH 90 4.882 15.534 12.247 1.00 46.30 O HETATM 3221 O HOH 91 30.080 33.370 18.369 1.00 56.41 O HETATM 3222 O HOH 92 12.084 41.086 22.997 1.00 38.67 O HETATM 3223 O HOH 93 1.883 27.885 9.667 1.00 39.96 O HETATM 3224 O HOH 94 19.749 47.571 8.923 1.00 53.15 O HETATM 3225 O HOH 95 31.889 34.022 5.737 1.00 43.43 O HETATM 3226 O HOH 96 11.519 35.075 29.256 1.00 39.14 O HETATM 3227 O HOH 97 13.484 42.116 24.768 1.00 47.16 O HETATM 3228 O HOH 98 3.388 41.372 15.456 1.00 39.95 O HETATM 3229 O HOH 99 18.477 25.856 21.265 1.00 38.74 O HETATM 3230 O HOH 100 15.766 45.080 0.684 1.00 18.17 O HETATM 3231 O HOH 101 27.729 34.369 -5.066 1.00 21.11 O HETATM 3232 O HOH 102 6.116 34.325 -1.042 1.00 20.23 O HETATM 3233 O HOH 103 11.024 20.183 -23.804 1.00 21.72 O HETATM 3234 O HOH 104 25.332 13.566 -8.979 1.00 24.95 O HETATM 3235 O HOH 105 25.125 16.954 -6.299 1.00 18.27 O HETATM 3236 O HOH 106 26.888 19.076 -6.618 1.00 26.54 O HETATM 3237 O HOH 107 20.137 16.157 -3.755 1.00 20.94 O HETATM 3238 O HOH 108 21.789 23.810 5.064 1.00 26.68 O HETATM 3239 O HOH 109 27.683 15.626 -12.175 1.00 24.63 O HETATM 3240 O HOH 110 12.322 36.029 -3.229 1.00 24.63 O HETATM 3241 O HOH 111 11.683 39.115 -2.373 1.00 28.21 O HETATM 3242 O HOH 112 6.204 23.372 -10.575 1.00 26.36 O HETATM 3243 O HOH 113 16.205 19.114 -19.414 1.00 28.13 O HETATM 3244 O HOH 114 17.295 16.564 -16.960 1.00 25.98 O HETATM 3245 O HOH 115 20.368 21.934 6.388 1.00 27.31 O HETATM 3246 O HOH 116 11.436 20.823 6.845 1.00 26.76 O HETATM 3247 O HOH 117 13.026 2.651 -11.352 1.00 23.24 O HETATM 3248 O HOH 118 16.880 13.481 -16.682 1.00 28.99 O HETATM 3249 O HOH 119 5.999 26.448 -5.262 1.00 31.70 O HETATM 3250 O HOH 120 15.948 4.448 -17.393 1.00 31.36 O HETATM 3251 O HOH 121 19.419 7.408 4.232 1.00 26.68 O HETATM 3252 O HOH 122 23.653 15.557 1.603 1.00 36.56 O HETATM 3253 O HOH 123 6.736 9.065 -9.651 1.00 41.86 O HETATM 3254 O HOH 124 21.846 4.736 -13.722 1.00 29.94 O HETATM 3255 O HOH 125 18.442 24.581 -22.179 1.00 31.72 O HETATM 3256 O HOH 126 21.191 -0.983 -5.967 1.00 27.52 O HETATM 3257 O HOH 127 14.987 21.476 -23.450 1.00 33.79 O HETATM 3258 O HOH 128 9.860 37.688 4.443 1.00 26.62 O HETATM 3259 O HOH 129 12.118 15.047 13.336 1.00 36.10 O HETATM 3260 O HOH 130 19.646 12.194 4.937 1.00 34.87 O HETATM 3261 O HOH 131 6.714 20.320 -10.058 1.00 28.95 O HETATM 3262 O HOH 132 9.986 16.571 -21.555 1.00 33.07 O HETATM 3263 O HOH 133 5.843 27.781 -2.768 1.00 31.65 O HETATM 3264 O HOH 134 7.678 22.766 -19.528 1.00 36.68 O HETATM 3265 O HOH 135 13.033 5.463 -11.742 1.00 34.02 O HETATM 3266 O HOH 136 24.653 27.608 -17.733 1.00 33.15 O HETATM 3267 O HOH 137 9.548 40.987 -3.306 1.00 41.47 O HETATM 3268 O HOH 138 8.024 8.308 3.414 1.00 32.29 O HETATM 3269 O HOH 139 14.195 5.445 -0.114 1.00 35.10 O HETATM 3270 O HOH 140 11.557 17.490 -24.670 1.00 38.47 O HETATM 3271 O HOH 141 5.502 25.589 -13.318 1.00 42.64 O HETATM 3272 O HOH 142 9.854 31.884 -11.120 1.00 36.92 O HETATM 3273 O HOH 143 7.553 26.728 -14.309 1.00 38.88 O HETATM 3274 O HOH 144 20.500 1.450 -7.608 1.00 32.18 O HETATM 3275 O HOH 145 9.786 16.500 13.828 1.00 31.01 O HETATM 3276 O HOH 146 8.835 17.580 -9.471 1.00 31.48 O HETATM 3277 O HOH 147 14.898 17.270 -23.429 1.00 37.33 O HETATM 3278 O HOH 148 14.667 5.274 -13.769 1.00 31.95 O HETATM 3279 O HOH 149 19.762 21.701 -19.337 1.00 41.52 O HETATM 3280 O HOH 150 13.140 34.436 -7.014 1.00 35.27 O HETATM 3281 O HOH 151 15.009 30.381 -15.839 1.00 44.84 O HETATM 3282 O HOH 152 9.774 10.880 11.174 1.00 33.58 O HETATM 3283 O HOH 153 2.644 26.122 1.182 1.00 56.63 O HETATM 3284 O HOH 154 7.501 24.122 -6.126 1.00 26.96 O HETATM 3285 O HOH 155 22.301 8.245 -12.733 1.00 28.71 O HETATM 3286 O HOH 156 28.434 13.688 -10.213 1.00 34.50 O HETATM 3287 O HOH 157 19.678 7.742 -12.524 1.00 35.58 O HETATM 3288 O HOH 158 22.351 15.710 -2.391 1.00 30.96 O HETATM 3289 O HOH 159 4.222 10.812 2.578 1.00 33.39 O HETATM 3290 O HOH 160 11.994 36.241 -5.440 1.00 33.76 O HETATM 3291 O HOH 161 22.393 12.643 -1.493 1.00 39.98 O HETATM 3292 O HOH 162 3.884 30.271 6.188 1.00 36.03 O HETATM 3293 O HOH 163 28.692 25.690 -12.317 1.00 39.21 O HETATM 3294 O HOH 164 21.632 6.846 -7.280 1.00 34.18 O HETATM 3295 O HOH 165 27.455 23.667 -12.764 1.00 37.14 O HETATM 3296 O HOH 166 22.168 15.647 5.013 1.00 34.74 O HETATM 3297 O HOH 167 24.885 19.107 0.305 1.00 31.55 O HETATM 3298 O HOH 168 28.649 21.044 -3.341 1.00 41.66 O HETATM 3299 O HOH 169 14.722 39.837 -5.709 1.00 36.01 O HETATM 3300 O HOH 170 7.874 34.181 -4.829 1.00 30.29 O HETATM 3301 O HOH 171 17.679 20.611 -17.912 1.00 35.45 O HETATM 3302 O HOH 172 5.482 19.530 -17.758 1.00 60.24 O HETATM 3303 O HOH 173 27.501 19.758 3.614 1.00 44.24 O HETATM 3304 O HOH 174 13.517 15.659 10.959 1.00 30.64 O HETATM 3305 O HOH 175 20.150 13.851 -16.905 1.00 30.63 O HETATM 3306 O HOH 176 16.078 27.204 -15.544 1.00 35.41 O HETATM 3307 O HOH 177 17.806 16.351 -19.610 1.00 29.93 O HETATM 3308 O HOH 178 4.818 16.049 -3.474 1.00 38.95 O HETATM 3309 O HOH 179 8.602 37.070 -5.763 1.00 48.36 O HETATM 3310 O HOH 180 19.490 40.855 -9.491 1.00 41.77 O HETATM 3311 O HOH 181 11.075 7.430 -12.404 1.00 39.86 O HETATM 3312 O HOH 182 4.171 30.004 -3.080 1.00 41.41 O HETATM 3313 O HOH 183 28.975 32.904 -8.243 1.00 44.08 O HETATM 3314 O HOH 184 22.171 10.095 -14.707 1.00 36.07 O HETATM 3315 O HOH 185 13.539 31.944 -12.819 1.00 35.29 O HETATM 3316 O HOH 186 14.553 45.156 -2.322 1.00 42.35 O HETATM 3317 O HOH 187 28.706 40.234 0.564 1.00 34.02 O HETATM 3318 O HOH 188 26.219 28.901 -12.781 1.00 40.09 O HETATM 3319 O HOH 189 14.903 29.360 -18.429 1.00 42.98 O HETATM 3320 O HOH 190 11.767 -0.287 5.730 1.00 41.16 O HETATM 3321 O HOH 191 7.959 13.268 -14.882 1.00 37.50 O HETATM 3322 O HOH 192 15.395 12.901 -18.403 1.00 42.64 O HETATM 3323 O HOH 193 6.049 29.491 -8.439 1.00 44.26 O HETATM 3324 O HOH 194 7.333 28.685 -16.217 1.00 49.29 O HETATM 3325 O HOH 195 5.269 14.298 -4.864 1.00 35.42 O HETATM 3326 O HOH 196 22.363 20.886 -17.425 1.00 40.92 O HETATM 3327 O HOH 197 8.296 7.191 -11.427 1.00 47.19 O HETATM 3328 O HOH 198 29.015 16.643 -7.438 1.00 49.40 O HETATM 3329 O HOH 199 21.364 34.778 -14.487 1.00 42.60 O HETATM 3330 O HOH 200 25.011 6.659 -8.477 1.00 45.48 O HETATM 3331 O HOH 201 15.611 14.975 -20.279 1.00 41.94 O HETATM 3332 O HOH 202 12.972 12.388 -18.073 1.00 49.20 O HETATM 3333 O HOH 203 3.572 22.750 -17.866 1.00 54.43 O HETATM 3334 O HOH 204 13.904 42.348 -5.630 1.00 47.88 O HETATM 3335 O HOH 205 16.157 19.361 -22.230 1.00 40.91 O HETATM 3336 O HOH 206 21.409 7.451 -10.465 1.00 38.25 O HETATM 3337 O HOH 207 7.017 11.528 8.539 1.00 45.52 O HETATM 3338 O HOH 208 21.299 11.588 -16.931 1.00 54.50 O HETATM 3339 O HOH 209 5.783 9.830 4.301 1.00 40.76 O HETATM 3340 O HOH 210 11.269 7.131 9.571 1.00 45.33 O HETATM 3341 O HOH 211 16.489 27.144 -20.741 1.00 39.08 O HETATM 3342 O HOH 212 19.587 9.461 -15.485 1.00 42.55 O HETATM 3343 O HOH 213 7.595 33.503 -7.740 1.00 42.89 O HETATM 3344 O HOH 214 30.658 26.282 -13.694 1.00 45.35 O HETATM 3345 O HOH 215 7.281 39.549 3.539 1.00 47.70 O HETATM 3346 O HOH 216 2.397 22.912 -0.962 1.00 56.45 O HETATM 3347 O HOH 217 27.369 21.393 -0.962 1.00 51.08 O HETATM 3348 O HOH 218 27.851 36.874 -6.399 1.00 46.67 O HETATM 3349 O HOH 219 23.081 43.986 5.744 1.00 35.93 O HETATM 3350 O HOH 220 10.282 16.720 -16.235 1.00 38.67 O HETATM 3351 O HOH 221 5.211 20.548 -21.976 1.00 36.30 O HETATM 3352 O49 Q A 50 17.739 14.976 5.816 1.00 -0.39 O HETATM 3353 C48 Q A 50 18.731 15.496 5.387 1.00 0.20 C HETATM 3354 C40 Q A 50 19.020 16.893 5.883 1.00 0.14 C HETATM 3355 N39 Q A 50 17.763 17.672 5.833 1.00 -0.26 N HETATM 3356 C37 Q A 50 17.705 18.964 5.451 1.00 0.20 C HETATM 3357 C31 Q A 50 16.290 19.480 5.332 1.00 0.13 C HETATM 3358 N30 Q A 50 16.185 20.872 5.694 1.00 -0.27 N HETATM 3359 C28 Q A 50 15.046 21.394 6.127 1.00 0.18 C HETATM 3360 C20 Q A 50 15.084 22.880 6.419 1.00 0.06 C HETATM 3361 C19 Q A 50 13.680 23.438 6.334 1.00 -0.00 C HETATM 3362 C17 Q A 50 13.423 23.717 4.857 1.00 0.08 C HETATM 3363 C9 Q A 50 11.907 23.698 4.577 1.00 0.08 C HETATM 3364 C10 Q A 50 11.576 23.906 3.103 1.00 0.01 C HETATM 3365 C11 Q A 50 10.066 23.898 2.866 1.00 -0.04 C HETATM 3366 C16 Q A 50 9.311 22.729 2.978 1.00 -0.06 C HETATM 3367 C15 Q A 50 7.934 22.786 2.765 1.00 -0.07 C HETATM 3368 C14 Q A 50 7.293 23.969 2.479 1.00 -0.07 C HETATM 3369 C13 Q A 50 8.052 25.134 2.373 1.00 -0.07 C HETATM 3370 C12 Q A 50 9.431 25.074 2.561 1.00 -0.06 C HETATM 3371 H45 Q A 50 10.017 25.981 2.464 1.00 0.06 H HETATM 3372 H46 Q A 50 7.572 26.079 2.146 1.00 0.06 H HETATM 3373 H47 Q A 50 6.218 23.995 2.339 1.00 0.06 H HETATM 3374 H48 Q A 50 7.353 21.873 2.826 1.00 0.06 H HETATM 3375 H49 Q A 50 9.789 21.789 3.227 1.00 0.06 H HETATM 3376 H43 Q A 50 12.035 23.098 2.515 1.00 0.04 H HETATM 3377 H44 Q A 50 11.985 24.874 2.777 1.00 0.04 H HETATM 3378 N8 Q A 50 11.236 24.803 5.276 1.00 -0.26 N HETATM 3379 C6 Q A 50 10.719 24.679 6.473 1.00 0.32 C HETATM 3380 O5 Q A 50 10.065 25.883 7.010 1.00 -0.26 O HETATM 3381 C1 Q A 50 9.590 26.117 8.326 1.00 0.09 C HETATM 3382 C2 Q A 50 9.205 27.596 8.410 1.00 -0.03 C HETATM 3383 H40 Q A 50 8.830 27.820 9.419 1.00 0.03 H HETATM 3384 H41 Q A 50 8.420 27.813 7.670 1.00 0.03 H HETATM 3385 H42 Q A 50 10.088 28.217 8.201 1.00 0.03 H HETATM 3386 C3 Q A 50 8.344 25.276 8.585 1.00 -0.03 C HETATM 3387 H37 Q A 50 7.982 25.463 9.607 1.00 0.03 H HETATM 3388 H38 Q A 50 8.591 24.210 8.473 1.00 0.03 H HETATM 3389 H39 Q A 50 7.561 25.549 7.863 1.00 0.03 H HETATM 3390 C4 Q A 50 10.705 25.817 9.302 1.00 -0.03 C HETATM 3391 H34 Q A 50 10.351 25.994 10.328 1.00 0.03 H HETATM 3392 H35 Q A 50 11.563 26.473 9.092 1.00 0.03 H HETATM 3393 H36 Q A 50 11.012 24.766 9.196 1.00 0.03 H HETATM 3394 O7 Q A 50 10.792 23.613 7.074 1.00 -0.38 O HETATM 3395 H33 Q A 50 11.171 25.689 4.817 1.00 0.19 H HETATM 3396 H32 Q A 50 11.500 22.734 4.916 1.00 0.06 H HETATM 3397 O18 Q A 50 14.078 24.953 4.537 1.00 -0.39 O HETATM 3398 H31 Q A 50 13.967 25.139 3.612 1.00 0.21 H HETATM 3399 H30 Q A 50 13.883 22.920 4.254 1.00 0.06 H HETATM 3400 H28 Q A 50 13.603 24.368 6.917 1.00 0.03 H HETATM 3401 H29 Q A 50 12.954 22.705 6.716 1.00 0.03 H HETATM 3402 C21 Q A 50 15.651 23.328 7.735 1.00 0.00 C HETATM 3403 C22 Q A 50 15.526 22.203 8.668 1.00 -0.04 C HETATM 3404 C27 Q A 50 16.644 21.423 8.861 1.00 -0.06 C HETATM 3405 C26 Q A 50 16.589 20.338 9.717 1.00 -0.07 C HETATM 3406 C25 Q A 50 15.418 20.066 10.366 1.00 -0.07 C HETATM 3407 C24 Q A 50 14.270 20.836 10.151 1.00 -0.07 C HETATM 3408 C23 Q A 50 14.309 21.937 9.291 1.00 -0.06 C HETATM 3409 H23 Q A 50 13.435 22.554 9.117 1.00 0.06 H HETATM 3410 H24 Q A 50 13.345 20.577 10.654 1.00 0.06 H HETATM 3411 H25 Q A 50 15.378 19.236 11.062 1.00 0.06 H HETATM 3412 H26 Q A 50 17.461 19.713 9.870 1.00 0.06 H HETATM 3413 H27 Q A 50 17.566 21.659 8.343 1.00 0.06 H HETATM 3414 H21 Q A 50 15.088 24.195 8.112 1.00 0.05 H HETATM 3415 H22 Q A 50 16.709 23.602 7.615 1.00 0.05 H HETATM 3416 H20 Q A 50 15.698 23.340 5.630 1.00 0.06 H HETATM 3417 O29 Q A 50 14.012 20.717 6.218 1.00 -0.40 O HETATM 3418 H19 Q A 50 16.991 21.458 5.616 1.00 0.19 H HETATM 3419 C32 Q A 50 15.794 19.559 3.884 1.00 0.00 C HETATM 3420 C33 Q A 50 15.697 18.230 3.114 1.00 0.04 C HETATM 3421 C34 Q A 50 17.049 17.828 2.583 1.00 0.17 C HETATM 3422 N36 Q A 50 17.361 16.542 2.691 1.00 -0.30 N HETATM 3423 H17 Q A 50 18.244 16.212 2.357 1.00 0.18 H HETATM 3424 H18 Q A 50 16.713 15.903 3.106 1.00 0.18 H HETATM 3425 O35 Q A 50 17.796 18.655 2.074 1.00 -0.40 O HETATM 3426 H15 Q A 50 14.998 18.349 2.273 1.00 0.05 H HETATM 3427 H16 Q A 50 15.326 17.446 3.790 1.00 0.05 H HETATM 3428 H13 Q A 50 16.482 20.215 3.331 1.00 0.03 H HETATM 3429 H14 Q A 50 14.791 20.009 3.899 1.00 0.03 H HETATM 3430 H12 Q A 50 15.630 18.851 5.947 1.00 0.08 H HETATM 3431 O38 Q A 50 18.696 19.690 5.278 1.00 -0.39 O HETATM 3432 H11 Q A 50 16.912 17.217 6.096 1.00 0.19 H HETATM 3433 C41 Q A 50 19.664 16.849 7.262 1.00 0.02 C HETATM 3434 C42 Q A 50 18.846 16.208 8.331 1.00 -0.04 C HETATM 3435 C47 Q A 50 18.960 14.835 8.601 1.00 -0.06 C HETATM 3436 C46 Q A 50 18.174 14.307 9.604 1.00 -0.07 C HETATM 3437 C45 Q A 50 17.302 15.116 10.324 1.00 -0.07 C HETATM 3438 C44 Q A 50 17.194 16.461 10.044 1.00 -0.07 C HETATM 3439 C43 Q A 50 17.998 17.011 9.063 1.00 -0.06 C HETATM 3440 H6 Q A 50 17.961 18.077 8.869 1.00 0.06 H HETATM 3441 H7 Q A 50 16.488 17.080 10.586 1.00 0.06 H HETATM 3442 H8 Q A 50 16.700 14.684 11.115 1.00 0.06 H HETATM 3443 H9 Q A 50 18.237 13.249 9.834 1.00 0.06 H HETATM 3444 H10 Q A 50 19.644 14.210 8.039 1.00 0.06 H HETATM 3445 H4 Q A 50 19.875 17.883 7.571 1.00 0.05 H HETATM 3446 H5 Q A 50 20.608 16.291 7.178 1.00 0.05 H HETATM 3447 H3 Q A 50 19.739 17.366 5.198 1.00 0.08 H HETATM 3448 N50 Q A 50 19.542 14.916 4.473 1.00 -0.30 N HETATM 3449 H1 Q A 50 20.357 15.397 4.151 1.00 0.18 H HETATM 3450 H2 Q A 50 19.326 14.006 4.119 1.00 0.18 H CONECT 3352 3353 CONECT 3353 3352 3354 3448 CONECT 3354 3353 3355 3433 3447 CONECT 3355 3354 3356 3432 CONECT 3356 3355 3357 3431 CONECT 3357 3356 3358 3419 3430 CONECT 3358 3357 3359 3418 CONECT 3359 3358 3360 3417 CONECT 3360 3359 3361 3402 3416 CONECT 3361 3360 3362 3400 3401 CONECT 3362 3361 3363 3397 3399 CONECT 3363 3362 3364 3378 3396 CONECT 3364 3363 3365 3376 3377 CONECT 3365 3364 3366 3370 CONECT 3366 3365 3367 3375 CONECT 3367 3366 3368 3374 CONECT 3368 3367 3369 3373 CONECT 3369 3368 3370 3372 CONECT 3370 3365 3369 3371 CONECT 3371 3370 CONECT 3372 3369 CONECT 3373 3368 CONECT 3374 3367 CONECT 3375 3366 CONECT 3376 3364 CONECT 3377 3364 CONECT 3378 3363 3379 3395 CONECT 3379 3378 3380 3394 CONECT 3380 3379 3381 CONECT 3381 3380 3382 3386 3390 CONECT 3382 3381 3383 3384 3385 CONECT 3383 3382 CONECT 3384 3382 CONECT 3385 3382 CONECT 3386 3381 3387 3388 3389 CONECT 3387 3386 CONECT 3388 3386 CONECT 3389 3386 CONECT 3390 3381 3391 3392 3393 CONECT 3391 3390 CONECT 3392 3390 CONECT 3393 3390 CONECT 3394 3379 CONECT 3395 3378 CONECT 3396 3363 CONECT 3397 3362 3398 CONECT 3398 3397 CONECT 3399 3362 CONECT 3400 3361 CONECT 3401 3361 CONECT 3402 3360 3403 3414 3415 CONECT 3403 3402 3404 3408 CONECT 3404 3403 3405 3413 CONECT 3405 3404 3406 3412 CONECT 3406 3405 3407 3411 CONECT 3407 3406 3408 3410 CONECT 3408 3403 3407 3409 CONECT 3409 3408 CONECT 3410 3407 CONECT 3411 3406 CONECT 3412 3405 CONECT 3413 3404 CONECT 3414 3402 CONECT 3415 3402 CONECT 3416 3360 CONECT 3417 3359 CONECT 3418 3358 CONECT 3419 3357 3420 3428 3429 CONECT 3420 3419 3421 3426 3427 CONECT 3421 3420 3422 3425 CONECT 3422 3421 3423 3424 CONECT 3423 3422 CONECT 3424 3422 CONECT 3425 3421 CONECT 3426 3420 CONECT 3427 3420 CONECT 3428 3419 CONECT 3429 3419 CONECT 3430 3357 CONECT 3431 3356 CONECT 3432 3355 CONECT 3433 3354 3434 3445 3446 CONECT 3434 3433 3435 3439 CONECT 3435 3434 3436 3444 CONECT 3436 3435 3437 3443 CONECT 3437 3436 3438 3442 CONECT 3438 3437 3439 3441 CONECT 3439 3434 3438 3440 CONECT 3440 3439 CONECT 3441 3438 CONECT 3442 3437 CONECT 3443 3436 CONECT 3444 3435 CONECT 3445 3433 CONECT 3446 3433 CONECT 3447 3354 CONECT 3448 3353 3449 3450 CONECT 3449 3448 CONECT 3450 3448 MASTER 0 0 0 0 0 0 0 0 3448 2 99 16 END
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Structure:
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Ligand 3D
Protein
Pocket-Ligand
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Related entries of code: 1izh
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%
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%
1vik
RCSB PDB
PDBbind
99aa, >1VIK_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
1izi
RCSB PDB
PDBbind
Q50
Entry Information
PDB ID
1izh
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
HIV-1 protease
Ligand Name
Q50
EC.Number
E.C.3.4.23.16
Resolution
1.9(Å)
Affinity (Kd/Ki/IC50)
Ki=0.02uM
Release Year
2002
Protein/NA Sequence
Check fasta file
Primary Reference
J.MOL.BIOL. v324 pp. 739-54, 2002
Ligand Properties
Formula
C
3
8
H
4
9
N
5
O
7
Molecular Weight
687.825
Exact Mass
687.363
No. of atoms
99
No. of bonds
101
Polar Surface Area
202.94
LOGP Value
3.45 (
Computed with XLOGP3
)
5.27 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 6
No. of Hydrogen Bond Acceptors: 6
No. of Rotatable Bonds: 24
No. of Nitrogen and Oxygen Atoms: 12
No. of Rings: 3
Canonical SMILES
NC(=O)CC[C@@H](C(=O)N[C@H](C(=O)N)Cc1ccccc1)NC(=O)[C@@H](C[C@@H]([C@@H](NC(=O)OC(C)(C)C)Cc1ccccc1)O)Cc1ccccc1
InChI String
InChI=1S/C38H49N5O7/c1-38(2,3)50-37(49)43-30(22-26-15-9-5-10-16-26)32(44)24-28(21-25-13-7-4-8-14-25)35(47)41-29(19-20-33(39)45)36(48)42-31(34(40)46)23-27-17-11-6-12-18-27/h4-18,28-32,44H,19-24H2,1-3H3,(H2,39,45)(H2,40,46)(H,41,47)(H,42,48)(H,43,49)/t28-,29+,30+,31+,32+/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):
Q90EB9
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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