Browse entries in the PDBbind-CN Database
HEADER 3EL0_COMPLEX COMPND 3EL0_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 99 PRO GLN ILE THR LEU TRP LYS ARG PRO ILE VAL THR ILE SEQRES 2 A 99 ARG 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 LYS TRP LYS PRO LYS MET ILE VAL GLY ILE GLY GLY SEQRES 5 A 99 PHE VAL LYS VAL ARG GLN TYR ASP GLN ILE PRO 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 ALA 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 LYS ARG PRO ILE VAL THR ILE SEQRES 2 B 99 ARG 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 LYS TRP LYS PRO LYS MET ILE VAL GLY ILE GLY GLY SEQRES 5 B 99 PHE VAL LYS VAL ARG GLN TYR ASP GLN ILE PRO 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 ALA ASN ILE ILE GLY ARG ASN LEU LEU THR SEQRES 8 B 99 GLN ILE GLY CYS THR LEU ASN PHE HET UNN A 324 85 ATOM 1 N PRO A 1 28.254 7.119 -3.529 1.00 32.35 N ATOM 2 CA PRO A 1 27.241 6.222 -4.083 1.00 32.08 C ATOM 3 C PRO A 1 25.830 6.522 -3.582 1.00 31.54 C ATOM 4 O PRO A 1 25.640 7.366 -2.702 1.00 31.55 O ATOM 5 CB PRO A 1 27.685 4.853 -3.573 1.00 32.08 C ATOM 6 CG PRO A 1 28.296 5.162 -2.246 1.00 32.68 C ATOM 7 CD PRO A 1 29.000 6.481 -2.427 1.00 32.36 C ATOM 8 HA PRO A 1 27.179 6.312 -5.167 1.00 0.00 H ATOM 9 HD3 PRO A 1 28.944 7.081 -1.519 1.00 0.00 H ATOM 10 HD2 PRO A 1 30.045 6.332 -2.698 1.00 0.00 H ATOM 11 HG3 PRO A 1 29.007 4.386 -1.963 1.00 0.00 H ATOM 12 HG2 PRO A 1 27.525 5.243 -1.480 1.00 0.00 H ATOM 13 HB2 PRO A 1 26.833 4.182 -3.464 1.00 0.00 H ATOM 14 HB3 PRO A 1 28.416 4.404 -4.245 1.00 0.00 H ATOM 15 N GLN A 2 24.852 5.861 -4.189 1.00 31.28 N ATOM 16 CA GLN A 2 23.508 5.778 -3.632 1.00 31.11 C ATOM 17 C GLN A 2 23.245 4.313 -3.300 1.00 30.58 C ATOM 18 O GLN A 2 23.401 3.438 -4.149 1.00 30.35 O ATOM 19 CB GLN A 2 22.459 6.298 -4.614 1.00 30.97 C ATOM 20 CG GLN A 2 21.022 6.180 -4.114 1.00 30.64 C ATOM 21 CD GLN A 2 20.022 6.755 -5.103 1.00 32.63 C ATOM 22 OE1 GLN A 2 19.443 7.827 -4.884 1.00 33.52 O ATOM 23 NE2 GLN A 2 19.830 6.053 -6.210 1.00 30.50 N ATOM 24 HA GLN A 2 23.438 6.401 -2.740 1.00 0.00 H ATOM 25 HB2 GLN A 2 22.667 7.349 -4.812 1.00 0.00 H ATOM 26 HB3 GLN A 2 22.547 5.731 -5.541 1.00 0.00 H ATOM 27 HG2 GLN A 2 20.791 5.127 -3.953 1.00 0.00 H ATOM 28 HG3 GLN A 2 20.933 6.719 -3.171 1.00 0.00 H ATOM 29 HE22 GLN A 2 20.338 5.157 -6.352 1.00 0.00 H ATOM 30 HE21 GLN A 2 19.171 6.398 -6.937 1.00 0.00 H ATOM 31 H GLN A 2 25.052 5.386 -5.093 1.00 0.00 H ATOM 32 N ILE A 3 22.868 4.063 -2.052 1.00 29.98 N ATOM 33 CA ILE A 3 22.664 2.711 -1.551 1.00 29.11 C ATOM 34 C ILE A 3 21.191 2.525 -1.217 1.00 28.21 C ATOM 35 O ILE A 3 20.636 3.241 -0.394 1.00 27.36 O ATOM 36 CB ILE A 3 23.531 2.430 -0.317 1.00 29.04 C ATOM 37 CG1 ILE A 3 25.004 2.676 -0.660 1.00 29.79 C ATOM 38 CG2 ILE A 3 23.301 1.000 0.177 1.00 29.31 C ATOM 39 CD1 ILE A 3 25.985 2.368 0.457 1.00 30.65 C ATOM 40 HA ILE A 3 22.963 2.003 -2.324 1.00 0.00 H ATOM 41 HB ILE A 3 23.250 3.106 0.490 1.00 0.00 H ATOM 42 HG12 ILE A 3 25.260 2.052 -1.517 1.00 0.00 H ATOM 43 HG13 ILE A 3 25.118 3.726 -0.930 1.00 0.00 H ATOM 44 HD11 ILE A 3 25.757 2.992 1.321 1.00 0.00 H ATOM 45 HD12 ILE A 3 25.900 1.317 0.734 1.00 0.00 H ATOM 46 HD13 ILE A 3 26.999 2.574 0.115 1.00 0.00 H ATOM 47 HG21 ILE A 3 22.251 0.873 0.442 1.00 0.00 H ATOM 48 HG22 ILE A 3 23.566 0.297 -0.613 1.00 0.00 H ATOM 49 HG23 ILE A 3 23.923 0.815 1.053 1.00 0.00 H ATOM 50 H ILE A 3 22.712 4.864 -1.407 1.00 0.00 H ATOM 51 N THR A 4 20.562 1.577 -1.898 1.00 27.63 N ATOM 52 CA THR A 4 19.168 1.245 -1.646 1.00 27.82 C ATOM 53 C THR A 4 19.085 0.240 -0.508 1.00 27.29 C ATOM 54 O THR A 4 20.102 -0.270 -0.035 1.00 26.20 O ATOM 55 CB THR A 4 18.481 0.672 -2.907 1.00 28.03 C ATOM 56 OG1 THR A 4 19.248 -0.432 -3.413 1.00 28.25 O ATOM 57 CG2 THR A 4 18.340 1.749 -3.980 1.00 28.35 C ATOM 58 HA THR A 4 18.645 2.161 -1.372 1.00 0.00 H ATOM 59 HB THR A 4 17.483 0.326 -2.637 1.00 0.00 H ATOM 60 HG1 THR A 4 19.306 -1.137 -2.720 1.00 0.00 H ATOM 61 HG23 THR A 4 17.757 2.580 -3.584 1.00 0.00 H ATOM 62 HG21 THR A 4 19.329 2.103 -4.270 1.00 0.00 H ATOM 63 HG22 THR A 4 17.834 1.330 -4.849 1.00 0.00 H ATOM 64 H THR A 4 21.080 1.056 -2.634 1.00 0.00 H ATOM 65 N LEU A 5 17.867 -0.044 -0.063 1.00 27.18 N ATOM 66 CA LEU A 5 17.679 -0.797 1.169 1.00 26.60 C ATOM 67 C LEU A 5 16.896 -2.102 1.018 1.00 26.85 C ATOM 68 O LEU A 5 16.462 -2.684 2.008 1.00 26.87 O ATOM 69 CB LEU A 5 17.034 0.115 2.222 1.00 26.73 C ATOM 70 CG LEU A 5 17.813 1.387 2.572 1.00 24.78 C ATOM 71 CD1 LEU A 5 16.962 2.285 3.467 1.00 25.61 C ATOM 72 CD2 LEU A 5 19.129 1.053 3.245 1.00 25.55 C ATOM 73 HA LEU A 5 18.671 -1.116 1.489 1.00 0.00 H ATOM 74 HB2 LEU A 5 16.054 0.415 1.850 1.00 0.00 H ATOM 75 HB3 LEU A 5 16.912 -0.465 3.137 1.00 0.00 H ATOM 76 HG LEU A 5 18.040 1.920 1.649 1.00 0.00 H ATOM 77 HD21 LEU A 5 18.936 0.498 4.163 1.00 0.00 H ATOM 78 HD22 LEU A 5 19.735 0.446 2.573 1.00 0.00 H ATOM 79 HD23 LEU A 5 19.659 1.976 3.481 1.00 0.00 H ATOM 80 HD11 LEU A 5 16.046 2.556 2.942 1.00 0.00 H ATOM 81 HD12 LEU A 5 16.713 1.751 4.384 1.00 0.00 H ATOM 82 HD13 LEU A 5 17.522 3.187 3.712 1.00 0.00 H ATOM 83 H LEU A 5 17.036 0.275 -0.601 1.00 0.00 H ATOM 84 N TRP A 6 16.753 -2.584 -0.212 1.00 27.38 N ATOM 85 CA TRP A 6 16.186 -3.914 -0.453 1.00 27.57 C ATOM 86 C TRP A 6 17.033 -4.994 0.230 1.00 27.09 C ATOM 87 O TRP A 6 16.529 -6.050 0.640 1.00 26.59 O ATOM 88 CB TRP A 6 16.071 -4.177 -1.959 1.00 27.82 C ATOM 89 CG TRP A 6 15.174 -3.183 -2.611 1.00 29.28 C ATOM 90 CD1 TRP A 6 15.542 -2.165 -3.436 1.00 30.04 C ATOM 91 CD2 TRP A 6 13.758 -3.070 -2.440 1.00 30.29 C ATOM 92 NE1 TRP A 6 14.440 -1.433 -3.805 1.00 32.68 N ATOM 93 CE2 TRP A 6 13.330 -1.975 -3.216 1.00 31.18 C ATOM 94 CE3 TRP A 6 12.806 -3.802 -1.721 1.00 28.98 C ATOM 95 CZ2 TRP A 6 11.998 -1.581 -3.277 1.00 31.91 C ATOM 96 CZ3 TRP A 6 11.484 -3.418 -1.791 1.00 29.53 C ATOM 97 CH2 TRP A 6 11.091 -2.318 -2.563 1.00 30.65 C ATOM 98 HA TRP A 6 15.186 -3.950 -0.022 1.00 0.00 H ATOM 99 HB2 TRP A 6 17.062 -4.111 -2.409 1.00 0.00 H ATOM 100 HB3 TRP A 6 15.668 -5.177 -2.116 1.00 0.00 H ATOM 101 HE1 TRP A 6 14.448 -0.602 -4.430 1.00 0.00 H ATOM 102 HD1 TRP A 6 16.563 -1.960 -3.757 1.00 0.00 H ATOM 103 HZ2 TRP A 6 11.688 -0.720 -3.869 1.00 0.00 H ATOM 104 HH2 TRP A 6 10.037 -2.041 -2.597 1.00 0.00 H ATOM 105 HZ3 TRP A 6 10.732 -3.980 -1.236 1.00 0.00 H ATOM 106 HE3 TRP A 6 13.104 -4.659 -1.117 1.00 0.00 H ATOM 107 H TRP A 6 17.050 -2.004 -1.023 1.00 0.00 H ATOM 108 N LYS A 7 18.315 -4.690 0.384 1.00 26.07 N ATOM 109 CA LYS A 7 19.238 -5.536 1.111 1.00 25.76 C ATOM 110 C LYS A 7 19.944 -4.676 2.152 1.00 25.24 C ATOM 111 O LYS A 7 19.923 -3.453 2.063 1.00 25.09 O ATOM 112 CB LYS A 7 20.243 -6.160 0.145 1.00 25.72 C ATOM 113 HA LYS A 7 18.707 -6.349 1.607 1.00 0.00 H ATOM 114 HB2 LYS A 7 19.711 -6.759 -0.594 1.00 0.00 H ATOM 115 HB3 LYS A 7 20.800 -5.370 -0.359 1.00 0.00 H ATOM 116 H LYS A 7 18.672 -3.807 -0.035 1.00 0.00 H ATOM 117 N ARG A 8 20.538 -5.329 3.147 1.00 24.89 N ATOM 118 CA ARG A 8 21.296 -4.659 4.197 1.00 24.39 C ATOM 119 C ARG A 8 22.391 -3.790 3.578 1.00 23.59 C ATOM 120 O ARG A 8 23.171 -4.282 2.764 1.00 23.72 O ATOM 121 CB ARG A 8 21.949 -5.689 5.120 1.00 24.81 C ATOM 122 CG ARG A 8 20.995 -6.344 6.092 1.00 25.69 C ATOM 123 CD ARG A 8 21.630 -7.525 6.776 1.00 28.42 C ATOM 124 NE ARG A 8 20.681 -8.214 7.651 1.00 31.40 N ATOM 125 CZ ARG A 8 20.942 -9.330 8.321 1.00 34.62 C ATOM 126 NH1 ARG A 8 22.132 -9.914 8.217 1.00 35.87 N ATOM 127 NH2 ARG A 8 20.010 -9.868 9.097 1.00 36.79 N ATOM 128 HA ARG A 8 20.609 -4.037 4.771 1.00 0.00 H ATOM 129 HB2 ARG A 8 22.395 -6.468 4.502 1.00 0.00 H ATOM 130 HB3 ARG A 8 22.730 -5.189 5.692 1.00 0.00 H ATOM 131 HG2 ARG A 8 20.700 -5.614 6.846 1.00 0.00 H ATOM 132 HG3 ARG A 8 20.112 -6.681 5.549 1.00 0.00 H ATOM 133 HD2 ARG A 8 22.474 -7.177 7.372 1.00 0.00 H ATOM 134 HD3 ARG A 8 21.985 -8.224 6.019 1.00 0.00 H ATOM 135 HE ARG A 8 19.733 -7.799 7.756 1.00 0.00 H ATOM 136 HH12 ARG A 8 22.330 -10.788 8.744 1.00 0.00 H ATOM 137 HH11 ARG A 8 22.865 -9.497 7.608 1.00 0.00 H ATOM 138 HH22 ARG A 8 20.212 -10.742 9.623 1.00 0.00 H ATOM 139 HH21 ARG A 8 19.077 -9.416 9.179 1.00 0.00 H ATOM 140 H ARG A 8 20.458 -6.365 3.177 1.00 0.00 H ATOM 141 N PRO A 9 22.454 -2.507 3.961 1.00 22.67 N ATOM 142 CA PRO A 9 23.494 -1.625 3.436 1.00 22.50 C ATOM 143 C PRO A 9 24.880 -1.913 4.026 1.00 22.57 C ATOM 144 O PRO A 9 25.361 -1.215 4.925 1.00 21.81 O ATOM 145 CB PRO A 9 22.978 -0.232 3.793 1.00 22.38 C ATOM 146 CG PRO A 9 22.164 -0.432 5.020 1.00 21.99 C ATOM 147 CD PRO A 9 21.533 -1.793 4.870 1.00 22.94 C ATOM 148 HA PRO A 9 23.654 -1.757 2.366 1.00 0.00 H ATOM 149 HD3 PRO A 9 21.466 -2.299 5.833 1.00 0.00 H ATOM 150 HD2 PRO A 9 20.538 -1.714 4.433 1.00 0.00 H ATOM 151 HG3 PRO A 9 21.396 0.338 5.097 1.00 0.00 H ATOM 152 HG2 PRO A 9 22.797 -0.401 5.907 1.00 0.00 H ATOM 153 HB2 PRO A 9 23.808 0.447 3.989 1.00 0.00 H ATOM 154 HB3 PRO A 9 22.365 0.169 2.986 1.00 0.00 H ATOM 155 N ILE A 10 25.503 -2.962 3.504 1.00 23.15 N ATOM 156 CA ILE A 10 26.823 -3.380 3.962 1.00 23.83 C ATOM 157 C ILE A 10 27.870 -2.968 2.945 1.00 23.41 C ATOM 158 O ILE A 10 27.700 -3.148 1.739 1.00 23.82 O ATOM 159 CB ILE A 10 26.905 -4.884 4.236 1.00 23.49 C ATOM 160 CG1 ILE A 10 25.905 -5.276 5.326 1.00 24.13 C ATOM 161 CG2 ILE A 10 28.326 -5.282 4.676 1.00 24.63 C ATOM 162 CD1 ILE A 10 25.618 -6.733 5.361 1.00 25.56 C ATOM 163 HA ILE A 10 27.013 -2.880 4.912 1.00 0.00 H ATOM 164 HB ILE A 10 26.662 -5.411 3.313 1.00 0.00 H ATOM 165 HG12 ILE A 10 26.312 -4.980 6.293 1.00 0.00 H ATOM 166 HG13 ILE A 10 24.971 -4.743 5.148 1.00 0.00 H ATOM 167 HD11 ILE A 10 25.200 -7.043 4.403 1.00 0.00 H ATOM 168 HD12 ILE A 10 26.542 -7.280 5.549 1.00 0.00 H ATOM 169 HD13 ILE A 10 24.902 -6.942 6.156 1.00 0.00 H ATOM 170 HG21 ILE A 10 29.034 -5.029 3.887 1.00 0.00 H ATOM 171 HG22 ILE A 10 28.587 -4.743 5.587 1.00 0.00 H ATOM 172 HG23 ILE A 10 28.359 -6.355 4.865 1.00 0.00 H ATOM 173 H ILE A 10 25.037 -3.501 2.747 1.00 0.00 H ATOM 174 N VAL A 11 28.931 -2.362 3.463 1.00 23.87 N ATOM 175 CA VAL A 11 30.055 -1.899 2.656 1.00 23.32 C ATOM 176 C VAL A 11 31.353 -2.378 3.306 1.00 23.70 C ATOM 177 O VAL A 11 31.381 -2.733 4.487 1.00 23.40 O ATOM 178 CB VAL A 11 30.072 -0.361 2.533 1.00 23.20 C ATOM 179 CG1 VAL A 11 28.791 0.148 1.897 1.00 23.75 C ATOM 180 CG2 VAL A 11 30.265 0.308 3.881 1.00 22.98 C ATOM 181 HA VAL A 11 29.955 -2.309 1.651 1.00 0.00 H ATOM 182 HB VAL A 11 30.918 -0.105 1.895 1.00 0.00 H ATOM 183 HG11 VAL A 11 28.686 -0.282 0.901 1.00 0.00 H ATOM 184 HG12 VAL A 11 27.940 -0.145 2.512 1.00 0.00 H ATOM 185 HG13 VAL A 11 28.831 1.235 1.823 1.00 0.00 H ATOM 186 HG21 VAL A 11 29.449 0.025 4.546 1.00 0.00 H ATOM 187 HG22 VAL A 11 31.213 -0.013 4.312 1.00 0.00 H ATOM 188 HG23 VAL A 11 30.271 1.390 3.751 1.00 0.00 H ATOM 189 H VAL A 11 28.963 -2.210 4.491 1.00 0.00 H ATOM 190 N THR A 12 32.425 -2.357 2.523 1.00 23.73 N ATOM 191 CA THR A 12 33.746 -2.683 3.007 1.00 23.97 C ATOM 192 C THR A 12 34.374 -1.428 3.632 1.00 24.21 C ATOM 193 O THR A 12 34.269 -0.330 3.087 1.00 23.31 O ATOM 194 CB THR A 12 34.617 -3.254 1.847 1.00 24.21 C ATOM 195 OG1 THR A 12 33.942 -4.374 1.254 1.00 23.74 O ATOM 196 CG2 THR A 12 35.979 -3.703 2.337 1.00 23.60 C ATOM 197 HA THR A 12 33.686 -3.455 3.774 1.00 0.00 H ATOM 198 HB THR A 12 34.763 -2.460 1.115 1.00 0.00 H ATOM 199 HG1 THR A 12 33.802 -5.074 1.940 1.00 0.00 H ATOM 200 HG23 THR A 12 36.498 -2.858 2.789 1.00 0.00 H ATOM 201 HG21 THR A 12 35.855 -4.493 3.078 1.00 0.00 H ATOM 202 HG22 THR A 12 36.560 -4.080 1.496 1.00 0.00 H ATOM 203 H THR A 12 32.309 -2.096 1.523 1.00 0.00 H ATOM 204 N ILE A 13 34.970 -1.601 4.808 1.00 24.19 N ATOM 205 CA ILE A 13 35.717 -0.545 5.462 1.00 24.92 C ATOM 206 C ILE A 13 37.169 -1.003 5.616 1.00 25.77 C ATOM 207 O ILE A 13 37.470 -2.202 5.593 1.00 25.33 O ATOM 208 CB ILE A 13 35.122 -0.162 6.853 1.00 25.31 C ATOM 209 CG1 ILE A 13 35.123 -1.372 7.794 1.00 25.08 C ATOM 210 CG2 ILE A 13 33.680 0.345 6.712 1.00 24.97 C ATOM 211 CD1 ILE A 13 35.179 -1.033 9.247 1.00 26.07 C ATOM 212 HA ILE A 13 35.657 0.350 4.843 1.00 0.00 H ATOM 213 HB ILE A 13 35.748 0.629 7.267 1.00 0.00 H ATOM 214 HG12 ILE A 13 34.213 -1.944 7.613 1.00 0.00 H ATOM 215 HG13 ILE A 13 35.990 -1.987 7.555 1.00 0.00 H ATOM 216 HD11 ILE A 13 36.091 -0.472 9.453 1.00 0.00 H ATOM 217 HD12 ILE A 13 34.311 -0.428 9.511 1.00 0.00 H ATOM 218 HD13 ILE A 13 35.176 -1.952 9.834 1.00 0.00 H ATOM 219 HG21 ILE A 13 33.667 1.226 6.070 1.00 0.00 H ATOM 220 HG22 ILE A 13 33.063 -0.437 6.270 1.00 0.00 H ATOM 221 HG23 ILE A 13 33.290 0.605 7.696 1.00 0.00 H ATOM 222 H ILE A 13 34.898 -2.527 5.275 1.00 0.00 H ATOM 223 N ARG A 14 38.067 -0.032 5.750 1.00 26.16 N ATOM 224 CA ARG A 14 39.484 -0.300 5.989 1.00 26.69 C ATOM 225 C ARG A 14 39.895 0.411 7.272 1.00 26.78 C ATOM 226 O ARG A 14 39.626 1.601 7.444 1.00 26.69 O ATOM 227 CB ARG A 14 40.339 0.162 4.795 1.00 26.74 C ATOM 228 CG ARG A 14 41.850 -0.015 4.983 1.00 27.37 C ATOM 229 CD ARG A 14 42.619 0.288 3.695 1.00 28.36 C ATOM 230 NE ARG A 14 44.065 0.149 3.859 1.00 28.74 N ATOM 231 CZ ARG A 14 44.867 1.082 4.371 1.00 29.83 C ATOM 232 NH1 ARG A 14 44.380 2.248 4.785 1.00 30.52 N ATOM 233 NH2 ARG A 14 46.169 0.845 4.474 1.00 28.98 N ATOM 234 HA ARG A 14 39.647 -1.372 6.098 1.00 0.00 H ATOM 235 HB2 ARG A 14 40.036 -0.411 3.918 1.00 0.00 H ATOM 236 HB3 ARG A 14 40.139 1.220 4.623 1.00 0.00 H ATOM 237 HG2 ARG A 14 42.191 0.662 5.766 1.00 0.00 H ATOM 238 HG3 ARG A 14 42.051 -1.044 5.281 1.00 0.00 H ATOM 239 HD2 ARG A 14 42.399 1.311 3.389 1.00 0.00 H ATOM 240 HD3 ARG A 14 42.287 -0.402 2.919 1.00 0.00 H ATOM 241 HE ARG A 14 44.500 -0.745 3.553 1.00 0.00 H ATOM 242 HH12 ARG A 14 45.018 2.966 5.182 1.00 0.00 H ATOM 243 HH11 ARG A 14 43.361 2.441 4.711 1.00 0.00 H ATOM 244 HH22 ARG A 14 46.799 1.570 4.873 1.00 0.00 H ATOM 245 HH21 ARG A 14 46.559 -0.065 4.156 1.00 0.00 H ATOM 246 H ARG A 14 37.749 0.956 5.682 1.00 0.00 H ATOM 247 N ILE A 15 40.510 -0.336 8.184 1.00 27.31 N ATOM 248 CA ILE A 15 40.926 0.187 9.481 1.00 28.03 C ATOM 249 C ILE A 15 42.171 -0.586 9.950 1.00 28.99 C ATOM 250 O ILE A 15 42.195 -1.813 9.925 1.00 28.86 O ATOM 251 CB ILE A 15 39.757 0.114 10.525 1.00 28.39 C ATOM 252 CG1 ILE A 15 40.167 0.772 11.850 1.00 28.87 C ATOM 253 CG2 ILE A 15 39.274 -1.326 10.737 1.00 29.11 C ATOM 254 CD1 ILE A 15 39.155 0.617 12.978 1.00 28.76 C ATOM 255 HA ILE A 15 41.183 1.242 9.387 1.00 0.00 H ATOM 256 HB ILE A 15 38.915 0.674 10.119 1.00 0.00 H ATOM 257 HG12 ILE A 15 41.108 0.326 12.174 1.00 0.00 H ATOM 258 HG13 ILE A 15 40.314 1.837 11.669 1.00 0.00 H ATOM 259 HD11 ILE A 15 38.209 1.069 12.680 1.00 0.00 H ATOM 260 HD12 ILE A 15 39.003 -0.442 13.185 1.00 0.00 H ATOM 261 HD13 ILE A 15 39.531 1.113 13.873 1.00 0.00 H ATOM 262 HG21 ILE A 15 38.915 -1.731 9.791 1.00 0.00 H ATOM 263 HG22 ILE A 15 40.100 -1.935 11.104 1.00 0.00 H ATOM 264 HG23 ILE A 15 38.464 -1.333 11.467 1.00 0.00 H ATOM 265 H ILE A 15 40.702 -1.334 7.964 1.00 0.00 H ATOM 266 N GLY A 16 43.226 0.138 10.317 1.00 29.73 N ATOM 267 CA GLY A 16 44.465 -0.492 10.781 1.00 30.38 C ATOM 268 C GLY A 16 45.096 -1.435 9.772 1.00 30.64 C ATOM 269 O GLY A 16 45.727 -2.435 10.153 1.00 31.46 O ATOM 270 HA3 GLY A 16 44.244 -1.057 11.687 1.00 0.00 H ATOM 271 HA2 GLY A 16 45.184 0.294 11.011 1.00 0.00 H ATOM 272 H GLY A 16 43.170 1.176 10.273 1.00 0.00 H ATOM 273 N GLY A 17 44.916 -1.125 8.488 1.00 30.68 N ATOM 274 CA GLY A 17 45.329 -2.016 7.406 1.00 30.92 C ATOM 275 C GLY A 17 44.479 -3.264 7.202 1.00 31.09 C ATOM 276 O GLY A 17 44.809 -4.104 6.366 1.00 31.19 O ATOM 277 HA3 GLY A 17 46.350 -2.338 7.611 1.00 0.00 H ATOM 278 HA2 GLY A 17 45.309 -1.444 6.478 1.00 0.00 H ATOM 279 H GLY A 17 44.466 -0.218 8.248 1.00 0.00 H ATOM 280 N GLN A 18 43.387 -3.393 7.956 1.00 31.44 N ATOM 281 CA GLN A 18 42.474 -4.541 7.836 1.00 31.79 C ATOM 282 C GLN A 18 41.224 -4.188 7.025 1.00 30.88 C ATOM 283 O GLN A 18 40.709 -3.087 7.146 1.00 30.61 O ATOM 284 CB GLN A 18 42.013 -4.992 9.224 1.00 32.37 C ATOM 285 CG GLN A 18 43.118 -5.350 10.199 1.00 36.22 C ATOM 286 CD GLN A 18 43.662 -6.737 9.956 1.00 40.17 C ATOM 287 OE1 GLN A 18 43.524 -7.633 10.796 1.00 43.85 O ATOM 288 NE2 GLN A 18 44.270 -6.932 8.793 1.00 41.98 N ATOM 289 HA GLN A 18 43.024 -5.333 7.328 1.00 0.00 H ATOM 290 HB2 GLN A 18 41.428 -4.183 9.662 1.00 0.00 H ATOM 291 HB3 GLN A 18 41.379 -5.870 9.098 1.00 0.00 H ATOM 292 HG2 GLN A 18 43.929 -4.630 10.091 1.00 0.00 H ATOM 293 HG3 GLN A 18 42.722 -5.300 11.213 1.00 0.00 H ATOM 294 HE22 GLN A 18 44.363 -6.147 8.117 1.00 0.00 H ATOM 295 HE21 GLN A 18 44.654 -7.869 8.558 1.00 0.00 H ATOM 296 H GLN A 18 43.172 -2.654 8.656 1.00 0.00 H ATOM 297 N LEU A 19 40.724 -5.140 6.237 1.00 30.06 N ATOM 298 CA LEU A 19 39.464 -4.981 5.497 1.00 29.55 C ATOM 299 C LEU A 19 38.334 -5.718 6.211 1.00 28.70 C ATOM 300 O LEU A 19 38.479 -6.889 6.545 1.00 28.53 O ATOM 301 CB LEU A 19 39.607 -5.518 4.068 1.00 29.87 C ATOM 302 CG LEU A 19 39.840 -4.529 2.917 1.00 30.78 C ATOM 303 CD1 LEU A 19 40.670 -3.330 3.322 1.00 30.62 C ATOM 304 CD2 LEU A 19 40.452 -5.245 1.723 1.00 31.40 C ATOM 305 HA LEU A 19 39.227 -3.918 5.453 1.00 0.00 H ATOM 306 HB2 LEU A 19 40.450 -6.209 4.070 1.00 0.00 H ATOM 307 HB3 LEU A 19 38.692 -6.064 3.839 1.00 0.00 H ATOM 308 HG LEU A 19 38.864 -4.135 2.633 1.00 0.00 H ATOM 309 HD21 LEU A 19 41.406 -5.685 2.014 1.00 0.00 H ATOM 310 HD22 LEU A 19 39.776 -6.031 1.387 1.00 0.00 H ATOM 311 HD23 LEU A 19 40.611 -4.531 0.915 1.00 0.00 H ATOM 312 HD11 LEU A 19 40.162 -2.792 4.122 1.00 0.00 H ATOM 313 HD12 LEU A 19 41.646 -3.667 3.671 1.00 0.00 H ATOM 314 HD13 LEU A 19 40.797 -2.671 2.463 1.00 0.00 H ATOM 315 H LEU A 19 41.248 -6.033 6.142 1.00 0.00 H ATOM 316 N LYS A 20 37.227 -5.018 6.455 1.00 27.60 N ATOM 317 CA LYS A 20 36.039 -5.593 7.102 1.00 27.42 C ATOM 318 C LYS A 20 34.741 -5.114 6.446 1.00 26.40 C ATOM 319 O LYS A 20 34.708 -4.093 5.777 1.00 25.77 O ATOM 320 CB LYS A 20 36.000 -5.220 8.578 1.00 26.93 C ATOM 321 CG LYS A 20 37.093 -5.865 9.411 1.00 28.84 C ATOM 322 CD LYS A 20 37.502 -4.997 10.561 1.00 29.45 C ATOM 323 CE LYS A 20 38.640 -5.651 11.339 1.00 33.20 C ATOM 324 NZ LYS A 20 38.167 -6.800 12.162 1.00 33.00 N ATOM 325 HA LYS A 20 36.113 -6.674 6.987 1.00 0.00 H ATOM 326 HB2 LYS A 20 36.100 -4.138 8.660 1.00 0.00 H ATOM 327 HB3 LYS A 20 35.035 -5.526 8.983 1.00 0.00 H ATOM 328 HG2 LYS A 20 36.727 -6.816 9.799 1.00 0.00 H ATOM 329 HG3 LYS A 20 37.961 -6.043 8.777 1.00 0.00 H ATOM 330 HD2 LYS A 20 37.834 -4.030 10.182 1.00 0.00 H ATOM 331 HD3 LYS A 20 36.649 -4.853 11.224 1.00 0.00 H ATOM 332 HE2 LYS A 20 39.089 -4.908 11.998 1.00 0.00 H ATOM 333 HE3 LYS A 20 39.389 -6.009 10.633 1.00 0.00 H ATOM 334 HZ1 LYS A 20 37.456 -6.467 12.844 1.00 0.00 H ATOM 335 HZ2 LYS A 20 37.743 -7.518 11.541 1.00 0.00 H ATOM 336 HZ3 LYS A 20 38.973 -7.214 12.673 1.00 0.00 H ATOM 337 H LYS A 20 37.202 -4.017 6.174 1.00 0.00 H ATOM 338 N GLU A 21 33.675 -5.871 6.674 1.00 25.59 N ATOM 339 CA GLU A 21 32.338 -5.527 6.199 1.00 25.13 C ATOM 340 C GLU A 21 31.556 -4.915 7.342 1.00 23.95 C ATOM 341 O GLU A 21 31.602 -5.401 8.480 1.00 23.19 O ATOM 342 CB GLU A 21 31.612 -6.773 5.679 1.00 25.50 C ATOM 343 CG GLU A 21 32.355 -7.474 4.564 1.00 27.27 C ATOM 344 CD GLU A 21 32.485 -6.607 3.335 1.00 30.32 C ATOM 345 OE1 GLU A 21 33.598 -6.096 3.073 1.00 31.41 O ATOM 346 OE2 GLU A 21 31.459 -6.414 2.650 1.00 32.41 O ATOM 347 HA GLU A 21 32.420 -4.814 5.379 1.00 0.00 H ATOM 348 HB2 GLU A 21 31.488 -7.472 6.506 1.00 0.00 H ATOM 349 HB3 GLU A 21 30.632 -6.473 5.308 1.00 0.00 H ATOM 350 HG2 GLU A 21 33.353 -7.736 4.917 1.00 0.00 H ATOM 351 HG3 GLU A 21 31.815 -8.382 4.298 1.00 0.00 H ATOM 352 H GLU A 21 33.798 -6.750 7.216 1.00 0.00 H ATOM 353 N ALA A 22 30.843 -3.840 7.046 1.00 22.84 N ATOM 354 CA ALA A 22 30.160 -3.102 8.100 1.00 22.19 C ATOM 355 C ALA A 22 28.852 -2.535 7.600 1.00 21.08 C ATOM 356 O ALA A 22 28.719 -2.193 6.438 1.00 20.59 O ATOM 357 CB ALA A 22 31.046 -1.999 8.652 1.00 22.03 C ATOM 358 HA ALA A 22 29.942 -3.799 8.909 1.00 0.00 H ATOM 359 HB1 ALA A 22 31.956 -2.437 9.063 1.00 0.00 H ATOM 360 HB2 ALA A 22 31.305 -1.307 7.850 1.00 0.00 H ATOM 361 HB3 ALA A 22 30.512 -1.464 9.437 1.00 0.00 H ATOM 362 H ALA A 22 30.770 -3.521 6.059 1.00 0.00 H ATOM 363 N LEU A 23 27.901 -2.440 8.519 1.00 21.06 N ATOM 364 CA LEU A 23 26.533 -2.048 8.232 1.00 20.64 C ATOM 365 C LEU A 23 26.354 -0.549 8.484 1.00 20.16 C ATOM 366 O LEU A 23 26.531 -0.060 9.613 1.00 19.31 O ATOM 367 CB LEU A 23 25.595 -2.848 9.140 1.00 21.01 C ATOM 368 CG LEU A 23 24.082 -2.660 9.058 1.00 20.67 C ATOM 369 CD1 LEU A 23 23.541 -3.334 7.823 1.00 22.12 C ATOM 370 CD2 LEU A 23 23.447 -3.270 10.308 1.00 21.06 C ATOM 371 HA LEU A 23 26.300 -2.252 7.187 1.00 0.00 H ATOM 372 HB2 LEU A 23 25.789 -3.901 8.938 1.00 0.00 H ATOM 373 HB3 LEU A 23 25.882 -2.617 10.166 1.00 0.00 H ATOM 374 HG LEU A 23 23.844 -1.598 9.001 1.00 0.00 H ATOM 375 HD21 LEU A 23 23.688 -4.332 10.355 1.00 0.00 H ATOM 376 HD22 LEU A 23 23.837 -2.768 11.194 1.00 0.00 H ATOM 377 HD23 LEU A 23 22.365 -3.143 10.263 1.00 0.00 H ATOM 378 HD11 LEU A 23 24.004 -2.896 6.939 1.00 0.00 H ATOM 379 HD12 LEU A 23 23.768 -4.399 7.863 1.00 0.00 H ATOM 380 HD13 LEU A 23 22.461 -3.192 7.777 1.00 0.00 H ATOM 381 H LEU A 23 28.150 -2.659 9.505 1.00 0.00 H ATOM 382 N LEU A 24 25.994 0.165 7.421 1.00 19.81 N ATOM 383 CA LEU A 24 25.616 1.572 7.504 1.00 19.85 C ATOM 384 C LEU A 24 24.295 1.725 8.268 1.00 19.63 C ATOM 385 O LEU A 24 23.233 1.302 7.806 1.00 19.52 O ATOM 386 CB LEU A 24 25.506 2.194 6.107 1.00 20.18 C ATOM 387 CG LEU A 24 26.764 2.145 5.223 1.00 21.16 C ATOM 388 CD1 LEU A 24 26.533 2.926 3.965 1.00 22.59 C ATOM 389 CD2 LEU A 24 28.013 2.648 5.942 1.00 23.57 C ATOM 390 HA LEU A 24 26.397 2.103 8.048 1.00 0.00 H ATOM 391 HB2 LEU A 24 24.709 1.673 5.576 1.00 0.00 H ATOM 392 HB3 LEU A 24 25.232 3.242 6.233 1.00 0.00 H ATOM 393 HG LEU A 24 26.946 1.099 4.978 1.00 0.00 H ATOM 394 HD21 LEU A 24 27.862 3.683 6.249 1.00 0.00 H ATOM 395 HD22 LEU A 24 28.199 2.030 6.820 1.00 0.00 H ATOM 396 HD23 LEU A 24 28.867 2.589 5.268 1.00 0.00 H ATOM 397 HD11 LEU A 24 25.693 2.495 3.420 1.00 0.00 H ATOM 398 HD12 LEU A 24 26.310 3.963 4.218 1.00 0.00 H ATOM 399 HD13 LEU A 24 27.428 2.886 3.345 1.00 0.00 H ATOM 400 H LEU A 24 25.981 -0.300 6.491 1.00 0.00 H ATOM 401 N ASP A 25 24.373 2.353 9.435 1.00 19.28 N ATOM 402 CA ASP A 25 23.361 2.180 10.479 1.00 19.75 C ATOM 403 C ASP A 25 22.913 3.527 11.042 1.00 19.02 C ATOM 404 O ASP A 25 23.520 4.058 11.967 1.00 19.09 O ATOM 405 CB ASP A 25 23.930 1.267 11.582 1.00 19.83 C ATOM 406 CG ASP A 25 22.925 0.954 12.683 1.00 20.82 C ATOM 407 OD1 ASP A 25 21.771 1.421 12.600 1.00 19.82 O ATOM 408 OD2 ASP A 25 23.302 0.260 13.660 1.00 22.63 O ATOM 409 HA ASP A 25 22.476 1.710 10.050 1.00 0.00 H ATOM 410 HB2 ASP A 25 24.247 0.329 11.126 1.00 0.00 H ATOM 411 HB3 ASP A 25 24.792 1.761 12.030 1.00 0.00 H ATOM 412 H ASP A 25 25.178 2.987 9.613 1.00 0.00 H ATOM 413 N THR A 26 21.845 4.075 10.469 1.00 18.83 N ATOM 414 CA THR A 26 21.386 5.424 10.791 1.00 18.65 C ATOM 415 C THR A 26 20.753 5.492 12.186 1.00 19.15 C ATOM 416 O THR A 26 20.683 6.562 12.779 1.00 20.52 O ATOM 417 CB THR A 26 20.358 5.956 9.761 1.00 18.50 C ATOM 418 OG1 THR A 26 19.281 5.017 9.603 1.00 17.27 O ATOM 419 CG2 THR A 26 21.022 6.206 8.422 1.00 19.10 C ATOM 420 HA THR A 26 22.277 6.051 10.762 1.00 0.00 H ATOM 421 HB THR A 26 19.958 6.899 10.134 1.00 0.00 H ATOM 422 HG1 THR A 26 18.829 4.885 10.474 1.00 0.00 H ATOM 423 HG23 THR A 26 21.837 6.918 8.549 1.00 0.00 H ATOM 424 HG21 THR A 26 21.416 5.267 8.032 1.00 0.00 H ATOM 425 HG22 THR A 26 20.289 6.611 7.724 1.00 0.00 H ATOM 426 H THR A 26 21.316 3.522 9.765 1.00 0.00 H ATOM 427 N GLY A 27 20.321 4.350 12.707 1.00 19.33 N ATOM 428 CA GLY A 27 19.754 4.279 14.049 1.00 19.88 C ATOM 429 C GLY A 27 20.730 4.108 15.195 1.00 19.50 C ATOM 430 O GLY A 27 20.310 4.022 16.354 1.00 19.72 O ATOM 431 HA3 GLY A 27 19.066 3.434 14.072 1.00 0.00 H ATOM 432 HA2 GLY A 27 19.200 5.201 14.222 1.00 0.00 H ATOM 433 H GLY A 27 20.389 3.480 12.141 1.00 0.00 H ATOM 434 N ALA A 28 22.023 4.057 14.887 1.00 20.07 N ATOM 435 CA ALA A 28 23.057 4.038 15.910 1.00 20.14 C ATOM 436 C ALA A 28 23.799 5.373 16.000 1.00 20.60 C ATOM 437 O ALA A 28 24.165 5.976 14.977 1.00 19.66 O ATOM 438 CB ALA A 28 24.038 2.902 15.653 1.00 20.10 C ATOM 439 HA ALA A 28 22.564 3.873 16.868 1.00 0.00 H ATOM 440 HB1 ALA A 28 23.504 1.952 15.670 1.00 0.00 H ATOM 441 HB2 ALA A 28 24.505 3.041 14.678 1.00 0.00 H ATOM 442 HB3 ALA A 28 24.804 2.903 16.428 1.00 0.00 H ATOM 443 H ALA A 28 22.303 4.030 13.886 1.00 0.00 H ATOM 444 N ASP A 29 24.017 5.827 17.235 1.00 21.11 N ATOM 445 CA ASP A 29 24.728 7.080 17.489 1.00 21.43 C ATOM 446 C ASP A 29 26.219 6.870 17.242 1.00 21.69 C ATOM 447 O ASP A 29 26.936 7.763 16.798 1.00 22.16 O ATOM 448 CB ASP A 29 24.568 7.544 18.943 1.00 21.58 C ATOM 449 CG ASP A 29 23.130 7.779 19.368 1.00 22.12 C ATOM 450 OD1 ASP A 29 22.202 7.873 18.530 1.00 21.37 O ATOM 451 OD2 ASP A 29 22.940 7.863 20.600 1.00 23.41 O ATOM 452 HA ASP A 29 24.307 7.833 16.823 1.00 0.00 H ATOM 453 HB2 ASP A 29 24.997 6.782 19.594 1.00 0.00 H ATOM 454 HB3 ASP A 29 25.118 8.477 19.067 1.00 0.00 H ATOM 455 H ASP A 29 23.670 5.272 18.044 1.00 0.00 H ATOM 456 N ASP A 30 26.671 5.666 17.563 1.00 22.10 N ATOM 457 CA ASP A 30 28.080 5.347 17.590 1.00 22.53 C ATOM 458 C ASP A 30 28.389 4.235 16.601 1.00 22.23 C ATOM 459 O ASP A 30 27.502 3.530 16.125 1.00 22.32 O ATOM 460 CB ASP A 30 28.479 4.887 18.990 1.00 22.76 C ATOM 461 CG ASP A 30 27.963 5.807 20.085 1.00 23.12 C ATOM 462 OD1 ASP A 30 28.509 6.911 20.240 1.00 22.87 O ATOM 463 OD2 ASP A 30 27.048 5.403 20.834 1.00 25.34 O ATOM 464 HA ASP A 30 28.642 6.241 17.318 1.00 0.00 H ATOM 465 HB2 ASP A 30 28.076 3.888 19.156 1.00 0.00 H ATOM 466 HB3 ASP A 30 29.567 4.853 19.048 1.00 0.00 H ATOM 467 H ASP A 30 25.985 4.922 17.805 1.00 0.00 H ATOM 468 N THR A 31 29.676 4.089 16.335 1.00 22.35 N ATOM 469 CA THR A 31 30.218 3.053 15.475 1.00 22.24 C ATOM 470 C THR A 31 30.797 1.948 16.364 1.00 22.31 C ATOM 471 O THR A 31 31.633 2.217 17.224 1.00 21.80 O ATOM 472 CB THR A 31 31.318 3.656 14.575 1.00 22.31 C ATOM 473 OG1 THR A 31 30.713 4.536 13.611 1.00 21.53 O ATOM 474 CG2 THR A 31 32.148 2.563 13.879 1.00 22.23 C ATOM 475 HA THR A 31 29.440 2.637 14.835 1.00 0.00 H ATOM 476 HB THR A 31 32.007 4.224 15.201 1.00 0.00 H ATOM 477 HG1 THR A 31 30.235 5.263 14.084 1.00 0.00 H ATOM 478 HG23 THR A 31 32.594 1.912 14.632 1.00 0.00 H ATOM 479 HG21 THR A 31 31.500 1.976 13.227 1.00 0.00 H ATOM 480 HG22 THR A 31 32.936 3.029 13.287 1.00 0.00 H ATOM 481 H THR A 31 30.342 4.759 16.770 1.00 0.00 H ATOM 482 N VAL A 32 30.337 0.715 16.157 1.00 22.14 N ATOM 483 CA VAL A 32 30.730 -0.416 16.989 1.00 22.42 C ATOM 484 C VAL A 32 31.228 -1.574 16.119 1.00 22.76 C ATOM 485 O VAL A 32 30.483 -2.121 15.307 1.00 21.69 O ATOM 486 CB VAL A 32 29.564 -0.938 17.869 1.00 21.96 C ATOM 487 CG1 VAL A 32 30.106 -1.872 18.952 1.00 22.75 C ATOM 488 CG2 VAL A 32 28.769 0.215 18.495 1.00 21.46 C ATOM 489 HA VAL A 32 31.525 -0.054 17.641 1.00 0.00 H ATOM 490 HB VAL A 32 28.879 -1.494 17.229 1.00 0.00 H ATOM 491 HG11 VAL A 32 30.609 -2.717 18.482 1.00 0.00 H ATOM 492 HG12 VAL A 32 30.814 -1.328 19.578 1.00 0.00 H ATOM 493 HG13 VAL A 32 29.280 -2.233 19.565 1.00 0.00 H ATOM 494 HG21 VAL A 32 29.431 0.814 19.120 1.00 0.00 H ATOM 495 HG22 VAL A 32 28.352 0.838 17.704 1.00 0.00 H ATOM 496 HG23 VAL A 32 27.961 -0.191 19.104 1.00 0.00 H ATOM 497 H VAL A 32 29.673 0.553 15.373 1.00 0.00 H ATOM 498 N LEU A 33 32.479 -1.967 16.315 1.00 23.43 N ATOM 499 CA LEU A 33 33.048 -3.082 15.565 1.00 24.41 C ATOM 500 C LEU A 33 33.312 -4.271 16.485 1.00 25.58 C ATOM 501 O LEU A 33 33.531 -4.091 17.686 1.00 24.61 O ATOM 502 CB LEU A 33 34.349 -2.669 14.866 1.00 24.98 C ATOM 503 CG LEU A 33 34.316 -1.386 14.037 1.00 24.65 C ATOM 504 CD1 LEU A 33 35.714 -1.051 13.552 1.00 26.03 C ATOM 505 CD2 LEU A 33 33.361 -1.504 12.867 1.00 26.16 C ATOM 506 HA LEU A 33 32.323 -3.374 14.806 1.00 0.00 H ATOM 507 HB2 LEU A 33 35.110 -2.543 15.636 1.00 0.00 H ATOM 508 HB3 LEU A 33 34.638 -3.483 14.201 1.00 0.00 H ATOM 509 HG LEU A 33 33.954 -0.579 14.674 1.00 0.00 H ATOM 510 HD21 LEU A 33 33.678 -2.324 12.222 1.00 0.00 H ATOM 511 HD22 LEU A 33 32.355 -1.701 13.239 1.00 0.00 H ATOM 512 HD23 LEU A 33 33.365 -0.572 12.301 1.00 0.00 H ATOM 513 HD11 LEU A 33 36.371 -0.909 14.410 1.00 0.00 H ATOM 514 HD12 LEU A 33 36.089 -1.869 12.937 1.00 0.00 H ATOM 515 HD13 LEU A 33 35.683 -0.135 12.962 1.00 0.00 H ATOM 516 H LEU A 33 33.066 -1.471 17.016 1.00 0.00 H ATOM 517 N GLU A 34 33.271 -5.469 15.900 1.00 26.95 N ATOM 518 CA GLU A 34 33.544 -6.730 16.595 1.00 29.02 C ATOM 519 C GLU A 34 34.932 -6.700 17.216 1.00 29.95 C ATOM 520 O GLU A 34 35.762 -5.856 16.866 1.00 29.79 O ATOM 521 CB GLU A 34 33.463 -7.914 15.625 1.00 29.35 C ATOM 522 CG GLU A 34 32.077 -8.157 15.012 1.00 31.55 C ATOM 523 CD GLU A 34 32.127 -8.964 13.726 1.00 32.58 C ATOM 524 OE1 GLU A 34 31.060 -9.153 13.115 1.00 34.74 O ATOM 525 OE2 GLU A 34 33.225 -9.397 13.308 1.00 36.06 O ATOM 526 HA GLU A 34 32.792 -6.850 17.375 1.00 0.00 H ATOM 527 HB2 GLU A 34 34.166 -7.734 14.812 1.00 0.00 H ATOM 528 HB3 GLU A 34 33.757 -8.814 16.165 1.00 0.00 H ATOM 529 HG2 GLU A 34 31.467 -8.696 15.737 1.00 0.00 H ATOM 530 HG3 GLU A 34 31.618 -7.192 14.799 1.00 0.00 H ATOM 531 H GLU A 34 33.031 -5.511 14.889 1.00 0.00 H ATOM 532 N GLU A 35 35.192 -7.643 18.116 1.00 30.63 N ATOM 533 CA GLU A 35 36.417 -7.617 18.916 1.00 31.31 C ATOM 534 C GLU A 35 37.666 -7.629 18.035 1.00 31.51 C ATOM 535 O GLU A 35 37.785 -8.429 17.112 1.00 31.13 O ATOM 536 CB GLU A 35 36.446 -8.774 19.923 1.00 31.84 C ATOM 537 CG GLU A 35 36.646 -8.331 21.371 1.00 32.10 C ATOM 538 CD GLU A 35 35.740 -9.072 22.339 1.00 33.18 C ATOM 539 OE1 GLU A 35 36.043 -10.242 22.658 1.00 33.81 O ATOM 540 OE2 GLU A 35 34.728 -8.482 22.782 1.00 32.16 O ATOM 541 HA GLU A 35 36.418 -6.682 19.476 1.00 0.00 H ATOM 542 HB2 GLU A 35 35.500 -9.311 19.856 1.00 0.00 H ATOM 543 HB3 GLU A 35 37.263 -9.444 19.653 1.00 0.00 H ATOM 544 HG2 GLU A 35 37.683 -8.515 21.653 1.00 0.00 H ATOM 545 HG3 GLU A 35 36.435 -7.264 21.442 1.00 0.00 H ATOM 546 H GLU A 35 34.510 -8.416 18.255 1.00 0.00 H ATOM 547 N MET A 36 38.574 -6.703 18.321 1.00 32.33 N ATOM 548 CA MET A 36 39.828 -6.565 17.587 1.00 33.51 C ATOM 549 C MET A 36 40.756 -5.675 18.390 1.00 34.23 C ATOM 550 O MET A 36 40.306 -4.925 19.253 1.00 34.55 O ATOM 551 CB MET A 36 39.595 -5.933 16.205 1.00 33.67 C ATOM 552 CG MET A 36 39.094 -4.489 16.240 1.00 34.38 C ATOM 553 SD MET A 36 38.949 -3.730 14.610 1.00 35.98 S ATOM 554 CE MET A 36 40.615 -3.900 13.967 1.00 35.93 C ATOM 555 HA MET A 36 40.264 -7.553 17.441 1.00 0.00 H ATOM 556 HB2 MET A 36 40.538 -5.952 15.659 1.00 0.00 H ATOM 557 HB3 MET A 36 38.857 -6.536 15.675 1.00 0.00 H ATOM 558 HG2 MET A 36 39.790 -3.897 16.834 1.00 0.00 H ATOM 559 HG3 MET A 36 38.112 -4.477 16.714 1.00 0.00 H ATOM 560 HE1 MET A 36 41.311 -3.376 14.622 1.00 0.00 H ATOM 561 HE2 MET A 36 40.880 -4.956 13.924 1.00 0.00 H ATOM 562 HE3 MET A 36 40.662 -3.471 12.966 1.00 0.00 H ATOM 563 H MET A 36 38.383 -6.046 19.104 1.00 0.00 H ATOM 564 N ASN A 37 42.049 -5.745 18.098 1.00 35.50 N ATOM 565 CA ASN A 37 43.018 -4.840 18.716 1.00 36.59 C ATOM 566 C ASN A 37 43.261 -3.634 17.828 1.00 36.80 C ATOM 567 O ASN A 37 43.464 -3.765 16.620 1.00 36.49 O ATOM 568 CB ASN A 37 44.357 -5.541 18.958 1.00 37.19 C ATOM 569 CG ASN A 37 44.228 -6.776 19.817 1.00 38.96 C ATOM 570 OD1 ASN A 37 45.088 -7.651 19.783 1.00 44.44 O ATOM 571 ND2 ASN A 37 43.159 -6.854 20.598 1.00 42.91 N ATOM 572 HA ASN A 37 42.599 -4.523 19.671 1.00 0.00 H ATOM 573 HB2 ASN A 37 44.778 -5.830 17.995 1.00 0.00 H ATOM 574 HB3 ASN A 37 45.031 -4.842 19.453 1.00 0.00 H ATOM 575 HD22 ASN A 37 42.455 -6.088 20.594 1.00 0.00 H ATOM 576 HD21 ASN A 37 43.024 -7.681 21.214 1.00 0.00 H ATOM 577 H ASN A 37 42.380 -6.457 17.416 1.00 0.00 H ATOM 578 N LEU A 38 43.256 -2.458 18.438 1.00 37.56 N ATOM 579 CA LEU A 38 43.598 -1.231 17.737 1.00 38.36 C ATOM 580 C LEU A 38 44.776 -0.581 18.451 1.00 39.17 C ATOM 581 O LEU A 38 45.000 -0.844 19.631 1.00 39.56 O ATOM 582 CB LEU A 38 42.390 -0.287 17.697 1.00 38.49 C ATOM 583 CG LEU A 38 41.236 -0.725 16.789 1.00 37.45 C ATOM 584 CD1 LEU A 38 39.976 0.054 17.113 1.00 37.89 C ATOM 585 CD2 LEU A 38 41.604 -0.546 15.332 1.00 37.17 C ATOM 586 HA LEU A 38 43.876 -1.452 16.706 1.00 0.00 H ATOM 587 HB2 LEU A 38 42.002 -0.195 18.712 1.00 0.00 H ATOM 588 HB3 LEU A 38 42.737 0.687 17.352 1.00 0.00 H ATOM 589 HG LEU A 38 41.045 -1.783 16.969 1.00 0.00 H ATOM 590 HD21 LEU A 38 41.825 0.504 15.141 1.00 0.00 H ATOM 591 HD22 LEU A 38 42.482 -1.150 15.103 1.00 0.00 H ATOM 592 HD23 LEU A 38 40.770 -0.863 14.706 1.00 0.00 H ATOM 593 HD11 LEU A 38 39.697 -0.125 18.151 1.00 0.00 H ATOM 594 HD12 LEU A 38 40.160 1.118 16.963 1.00 0.00 H ATOM 595 HD13 LEU A 38 39.169 -0.273 16.457 1.00 0.00 H ATOM 596 H LEU A 38 43.001 -2.411 19.445 1.00 0.00 H ATOM 597 N PRO A 39 45.566 0.231 17.729 1.00 40.18 N ATOM 598 CA PRO A 39 46.640 0.955 18.397 1.00 40.64 C ATOM 599 C PRO A 39 46.144 2.062 19.327 1.00 41.06 C ATOM 600 O PRO A 39 45.267 2.848 18.959 1.00 40.97 O ATOM 601 CB PRO A 39 47.438 1.558 17.231 1.00 40.80 C ATOM 602 CG PRO A 39 47.004 0.804 16.015 1.00 40.64 C ATOM 603 CD PRO A 39 45.572 0.480 16.278 1.00 40.21 C ATOM 604 HA PRO A 39 47.217 0.295 19.045 1.00 0.00 H ATOM 605 HD3 PRO A 39 44.924 1.317 16.018 1.00 0.00 H ATOM 606 HD2 PRO A 39 45.259 -0.405 15.724 1.00 0.00 H ATOM 607 HG3 PRO A 39 47.591 -0.106 15.894 1.00 0.00 H ATOM 608 HG2 PRO A 39 47.104 1.420 15.121 1.00 0.00 H ATOM 609 HB2 PRO A 39 47.211 2.619 17.123 1.00 0.00 H ATOM 610 HB3 PRO A 39 48.508 1.431 17.396 1.00 0.00 H ATOM 611 N GLY A 40 46.713 2.110 20.527 1.00 41.35 N ATOM 612 CA GLY A 40 46.574 3.277 21.393 1.00 41.11 C ATOM 613 C GLY A 40 45.786 3.028 22.660 1.00 40.77 C ATOM 614 O GLY A 40 45.299 1.925 22.908 1.00 40.88 O ATOM 615 HA3 GLY A 40 46.072 4.062 20.828 1.00 0.00 H ATOM 616 HA2 GLY A 40 47.572 3.614 21.673 1.00 0.00 H ATOM 617 H GLY A 40 47.271 1.297 20.857 1.00 0.00 H ATOM 618 N LYS A 41 45.699 4.070 23.477 1.00 40.55 N ATOM 619 CA LYS A 41 44.967 4.010 24.730 1.00 40.27 C ATOM 620 C LYS A 41 43.486 3.968 24.406 1.00 40.03 C ATOM 621 O LYS A 41 43.030 4.605 23.446 1.00 40.44 O ATOM 622 CB LYS A 41 45.286 5.218 25.600 1.00 40.40 C ATOM 623 HA LYS A 41 45.257 3.119 25.287 1.00 0.00 H ATOM 624 HB2 LYS A 41 46.354 5.236 25.817 1.00 0.00 H ATOM 625 HB3 LYS A 41 45.005 6.129 25.071 1.00 0.00 H ATOM 626 H LYS A 41 46.170 4.958 23.212 1.00 0.00 H ATOM 627 N TRP A 42 42.749 3.187 25.188 1.00 39.20 N ATOM 628 CA TRP A 42 41.303 3.117 25.073 1.00 38.46 C ATOM 629 C TRP A 42 40.692 3.273 26.460 1.00 38.05 C ATOM 630 O TRP A 42 41.341 2.984 27.475 1.00 38.44 O ATOM 631 CB TRP A 42 40.868 1.787 24.450 1.00 38.36 C ATOM 632 CG TRP A 42 41.377 0.596 25.184 1.00 37.73 C ATOM 633 CD1 TRP A 42 42.561 -0.044 24.975 1.00 36.77 C ATOM 634 CD2 TRP A 42 40.733 -0.094 26.267 1.00 36.53 C ATOM 635 NE1 TRP A 42 42.686 -1.100 25.842 1.00 36.56 N ATOM 636 CE2 TRP A 42 41.584 -1.145 26.655 1.00 36.47 C ATOM 637 CE3 TRP A 42 39.518 0.072 26.940 1.00 36.63 C ATOM 638 CZ2 TRP A 42 41.256 -2.034 27.683 1.00 36.88 C ATOM 639 CZ3 TRP A 42 39.199 -0.804 27.966 1.00 37.01 C ATOM 640 CH2 TRP A 42 40.066 -1.846 28.326 1.00 36.04 C ATOM 641 HA TRP A 42 40.956 3.919 24.422 1.00 0.00 H ATOM 642 HB2 TRP A 42 39.779 1.749 24.442 1.00 0.00 H ATOM 643 HB3 TRP A 42 41.239 1.747 23.426 1.00 0.00 H ATOM 644 HE1 TRP A 42 43.489 -1.760 25.877 1.00 0.00 H ATOM 645 HD1 TRP A 42 43.301 0.241 24.228 1.00 0.00 H ATOM 646 HZ2 TRP A 42 41.926 -2.848 27.961 1.00 0.00 H ATOM 647 HH2 TRP A 42 39.784 -2.519 29.135 1.00 0.00 H ATOM 648 HZ3 TRP A 42 38.258 -0.681 28.502 1.00 0.00 H ATOM 649 HE3 TRP A 42 38.835 0.875 26.663 1.00 0.00 H ATOM 650 H TRP A 42 43.224 2.605 25.908 1.00 0.00 H ATOM 651 N LYS A 43 39.450 3.744 26.496 1.00 36.90 N ATOM 652 CA LYS A 43 38.714 3.858 27.742 1.00 36.40 C ATOM 653 C LYS A 43 37.584 2.827 27.757 1.00 36.10 C ATOM 654 O LYS A 43 36.993 2.538 26.716 1.00 35.72 O ATOM 655 CB LYS A 43 38.165 5.261 27.897 1.00 36.51 C ATOM 656 HA LYS A 43 39.382 3.663 28.581 1.00 0.00 H ATOM 657 HB2 LYS A 43 38.989 5.974 27.902 1.00 0.00 H ATOM 658 HB3 LYS A 43 37.497 5.482 27.065 1.00 0.00 H ATOM 659 H LYS A 43 38.994 4.038 25.609 1.00 0.00 H ATOM 660 N PRO A 44 37.311 2.230 28.929 1.00 35.78 N ATOM 661 CA PRO A 44 36.102 1.425 29.098 1.00 35.35 C ATOM 662 C PRO A 44 34.856 2.265 28.867 1.00 34.72 C ATOM 663 O PRO A 44 34.831 3.434 29.256 1.00 34.21 O ATOM 664 CB PRO A 44 36.180 0.988 30.562 1.00 35.46 C ATOM 665 CG PRO A 44 37.633 1.073 30.903 1.00 35.52 C ATOM 666 CD PRO A 44 38.135 2.241 30.151 1.00 35.58 C ATOM 667 HA PRO A 44 36.043 0.593 28.396 1.00 0.00 H ATOM 668 HD3 PRO A 44 37.988 3.162 30.714 1.00 0.00 H ATOM 669 HD2 PRO A 44 39.192 2.128 29.912 1.00 0.00 H ATOM 670 HG3 PRO A 44 38.153 0.166 30.594 1.00 0.00 H ATOM 671 HG2 PRO A 44 37.767 1.220 31.975 1.00 0.00 H ATOM 672 HB2 PRO A 44 35.596 1.656 31.195 1.00 0.00 H ATOM 673 HB3 PRO A 44 35.816 -0.033 30.679 1.00 0.00 H ATOM 674 N LYS A 45 33.860 1.680 28.202 1.00 34.56 N ATOM 675 CA LYS A 45 32.569 2.342 27.968 1.00 34.26 C ATOM 676 C LYS A 45 31.410 1.339 27.973 1.00 34.07 C ATOM 677 O LYS A 45 31.568 0.181 27.599 1.00 33.15 O ATOM 678 CB LYS A 45 32.580 3.121 26.643 1.00 34.37 C ATOM 679 CG LYS A 45 31.353 4.026 26.460 1.00 35.36 C ATOM 680 CD LYS A 45 31.393 4.831 25.170 1.00 35.88 C ATOM 681 CE LYS A 45 30.039 5.482 24.861 1.00 36.48 C ATOM 682 NZ LYS A 45 29.688 6.619 25.771 1.00 35.81 N ATOM 683 HA LYS A 45 32.417 3.043 28.788 1.00 0.00 H ATOM 684 HB2 LYS A 45 33.476 3.742 26.614 1.00 0.00 H ATOM 685 HB3 LYS A 45 32.608 2.406 25.821 1.00 0.00 H ATOM 686 HG2 LYS A 45 30.459 3.402 26.452 1.00 0.00 H ATOM 687 HG3 LYS A 45 31.304 4.719 27.300 1.00 0.00 H ATOM 688 HD2 LYS A 45 32.147 5.613 25.265 1.00 0.00 H ATOM 689 HD3 LYS A 45 31.661 4.167 24.348 1.00 0.00 H ATOM 690 HE2 LYS A 45 29.264 4.720 24.949 1.00 0.00 H ATOM 691 HE3 LYS A 45 30.064 5.857 23.838 1.00 0.00 H ATOM 692 HZ1 LYS A 45 29.648 6.276 26.752 1.00 0.00 H ATOM 693 HZ2 LYS A 45 30.412 7.362 25.691 1.00 0.00 H ATOM 694 HZ3 LYS A 45 28.762 7.006 25.499 1.00 0.00 H ATOM 695 H LYS A 45 34.002 0.718 27.834 1.00 0.00 H ATOM 696 N MET A 46 30.247 1.808 28.407 1.00 33.87 N ATOM 697 CA MET A 46 29.016 1.023 28.391 1.00 33.88 C ATOM 698 C MET A 46 28.040 1.638 27.400 1.00 33.48 C ATOM 699 O MET A 46 27.776 2.838 27.462 1.00 33.14 O ATOM 700 CB MET A 46 28.367 1.027 29.775 1.00 34.15 C ATOM 701 CG MET A 46 29.307 0.667 30.906 1.00 36.42 C ATOM 702 SD MET A 46 30.102 -0.926 30.646 1.00 40.79 S ATOM 703 CE MET A 46 28.711 -2.033 30.842 1.00 41.16 C ATOM 704 HA MET A 46 29.258 -0.000 28.104 1.00 0.00 H ATOM 705 HB2 MET A 46 27.972 2.025 29.964 1.00 0.00 H ATOM 706 HB3 MET A 46 27.548 0.308 29.770 1.00 0.00 H ATOM 707 HG2 MET A 46 28.740 0.629 31.836 1.00 0.00 H ATOM 708 HG3 MET A 46 30.076 1.436 30.982 1.00 0.00 H ATOM 709 HE1 MET A 46 28.290 -1.913 31.840 1.00 0.00 H ATOM 710 HE2 MET A 46 27.952 -1.797 30.096 1.00 0.00 H ATOM 711 HE3 MET A 46 29.045 -3.062 30.709 1.00 0.00 H ATOM 712 H MET A 46 30.211 2.780 28.776 1.00 0.00 H ATOM 713 N ILE A 47 27.522 0.824 26.482 1.00 33.02 N ATOM 714 CA ILE A 47 26.464 1.262 25.564 1.00 32.56 C ATOM 715 C ILE A 47 25.161 0.490 25.828 1.00 32.56 C ATOM 716 O ILE A 47 25.173 -0.643 26.303 1.00 30.73 O ATOM 717 CB ILE A 47 26.892 1.175 24.059 1.00 32.72 C ATOM 718 CG1 ILE A 47 27.397 -0.219 23.692 1.00 32.83 C ATOM 719 CG2 ILE A 47 27.981 2.202 23.765 1.00 32.58 C ATOM 720 CD1 ILE A 47 27.679 -0.413 22.199 1.00 33.22 C ATOM 721 HA ILE A 47 26.283 2.318 25.765 1.00 0.00 H ATOM 722 HB ILE A 47 26.009 1.385 23.455 1.00 0.00 H ATOM 723 HG12 ILE A 47 28.320 -0.404 24.241 1.00 0.00 H ATOM 724 HG13 ILE A 47 26.644 -0.946 23.995 1.00 0.00 H ATOM 725 HD11 ILE A 47 26.763 -0.245 21.633 1.00 0.00 H ATOM 726 HD12 ILE A 47 28.441 0.298 21.879 1.00 0.00 H ATOM 727 HD13 ILE A 47 28.033 -1.429 22.027 1.00 0.00 H ATOM 728 HG21 ILE A 47 27.601 3.202 23.973 1.00 0.00 H ATOM 729 HG22 ILE A 47 28.847 2.002 24.396 1.00 0.00 H ATOM 730 HG23 ILE A 47 28.271 2.133 22.716 1.00 0.00 H ATOM 731 H ILE A 47 27.878 -0.151 26.414 1.00 0.00 H ATOM 732 N VAL A 48 24.035 1.137 25.557 1.00 33.21 N ATOM 733 CA VAL A 48 22.732 0.579 25.907 1.00 34.33 C ATOM 734 C VAL A 48 22.361 -0.541 24.942 1.00 34.98 C ATOM 735 O VAL A 48 22.193 -0.291 23.746 1.00 36.24 O ATOM 736 CB VAL A 48 21.664 1.674 25.891 1.00 34.44 C ATOM 737 HA VAL A 48 22.788 0.165 26.914 1.00 0.00 H ATOM 738 HB VAL A 48 21.927 2.447 26.614 1.00 0.00 H ATOM 739 H VAL A 48 24.081 2.062 25.085 1.00 0.00 H ATOM 740 N GLY A 49 22.219 -1.760 25.471 1.00 34.85 N ATOM 741 CA GLY A 49 21.881 -2.942 24.676 1.00 34.53 C ATOM 742 C GLY A 49 20.594 -3.642 25.092 1.00 34.72 C ATOM 743 O GLY A 49 19.867 -3.189 25.977 1.00 34.39 O ATOM 744 HA3 GLY A 49 22.700 -3.656 24.764 1.00 0.00 H ATOM 745 HA2 GLY A 49 21.779 -2.634 23.635 1.00 0.00 H ATOM 746 H GLY A 49 22.355 -1.874 26.496 1.00 0.00 H ATOM 747 N ILE A 50 20.312 -4.767 24.447 1.00 34.65 N ATOM 748 CA ILE A 50 19.090 -5.513 24.721 1.00 34.38 C ATOM 749 C ILE A 50 19.284 -6.348 25.979 1.00 34.25 C ATOM 750 O ILE A 50 20.174 -7.202 26.047 1.00 34.27 O ATOM 751 CB ILE A 50 18.692 -6.406 23.530 1.00 34.66 C ATOM 752 CG1 ILE A 50 18.608 -5.578 22.238 1.00 35.34 C ATOM 753 CG2 ILE A 50 17.375 -7.112 23.798 1.00 34.77 C ATOM 754 CD1 ILE A 50 17.781 -4.297 22.348 1.00 36.06 C ATOM 755 HA ILE A 50 18.276 -4.804 24.876 1.00 0.00 H ATOM 756 HB ILE A 50 19.464 -7.165 23.404 1.00 0.00 H ATOM 757 HG12 ILE A 50 19.621 -5.303 21.945 1.00 0.00 H ATOM 758 HG13 ILE A 50 18.164 -6.203 21.463 1.00 0.00 H ATOM 759 HD11 ILE A 50 16.758 -4.549 22.626 1.00 0.00 H ATOM 760 HD12 ILE A 50 18.217 -3.649 23.109 1.00 0.00 H ATOM 761 HD13 ILE A 50 17.781 -3.782 21.387 1.00 0.00 H ATOM 762 HG21 ILE A 50 17.473 -7.735 24.687 1.00 0.00 H ATOM 763 HG22 ILE A 50 16.592 -6.370 23.957 1.00 0.00 H ATOM 764 HG23 ILE A 50 17.118 -7.735 22.942 1.00 0.00 H ATOM 765 H ILE A 50 20.977 -5.124 23.731 1.00 0.00 H ATOM 766 N GLY A 51 18.441 -6.085 26.974 1.00 33.99 N ATOM 767 CA GLY A 51 18.503 -6.774 28.255 1.00 33.81 C ATOM 768 C GLY A 51 19.567 -6.219 29.185 1.00 33.53 C ATOM 769 O GLY A 51 19.859 -6.826 30.209 1.00 33.92 O ATOM 770 HA3 GLY A 51 18.718 -7.827 28.072 1.00 0.00 H ATOM 771 HA2 GLY A 51 17.533 -6.683 28.745 1.00 0.00 H ATOM 772 H GLY A 51 17.710 -5.359 26.831 1.00 0.00 H ATOM 773 N GLY A 52 20.144 -5.069 28.839 1.00 33.39 N ATOM 774 CA GLY A 52 21.168 -4.431 29.675 1.00 33.32 C ATOM 775 C GLY A 52 22.290 -3.771 28.888 1.00 33.34 C ATOM 776 O GLY A 52 22.329 -3.836 27.657 1.00 33.94 O ATOM 777 HA3 GLY A 52 21.605 -5.192 30.322 1.00 0.00 H ATOM 778 HA2 GLY A 52 20.685 -3.669 30.287 1.00 0.00 H ATOM 779 H GLY A 52 19.860 -4.610 27.950 1.00 0.00 H ATOM 780 N PHE A 53 23.196 -3.119 29.615 1.00 33.11 N ATOM 781 CA PHE A 53 24.337 -2.419 29.020 1.00 32.45 C ATOM 782 C PHE A 53 25.367 -3.406 28.477 1.00 32.45 C ATOM 783 O PHE A 53 25.541 -4.498 29.016 1.00 32.96 O ATOM 784 CB PHE A 53 24.994 -1.488 30.046 1.00 32.11 C ATOM 785 CG PHE A 53 24.356 -0.122 30.128 1.00 32.50 C ATOM 786 CD1 PHE A 53 23.322 0.131 31.017 1.00 33.45 C ATOM 787 CD2 PHE A 53 24.797 0.912 29.317 1.00 32.70 C ATOM 788 CE1 PHE A 53 22.738 1.388 31.091 1.00 32.86 C ATOM 789 CE2 PHE A 53 24.223 2.171 29.386 1.00 33.66 C ATOM 790 CZ PHE A 53 23.188 2.410 30.276 1.00 33.52 C ATOM 791 HA PHE A 53 23.962 -1.822 28.189 1.00 0.00 H ATOM 792 HB2 PHE A 53 24.928 -1.957 31.028 1.00 0.00 H ATOM 793 HB3 PHE A 53 26.042 -1.362 29.774 1.00 0.00 H ATOM 794 HD2 PHE A 53 25.609 0.731 28.613 1.00 0.00 H ATOM 795 HE2 PHE A 53 24.585 2.972 28.741 1.00 0.00 H ATOM 796 HZ PHE A 53 22.731 3.398 30.333 1.00 0.00 H ATOM 797 HE1 PHE A 53 21.924 1.570 31.792 1.00 0.00 H ATOM 798 HD1 PHE A 53 22.963 -0.668 31.666 1.00 0.00 H ATOM 799 H PHE A 53 23.089 -3.106 30.649 1.00 0.00 H ATOM 800 N VAL A 54 26.029 -3.015 27.394 1.00 31.58 N ATOM 801 CA VAL A 54 27.100 -3.809 26.798 1.00 30.85 C ATOM 802 C VAL A 54 28.431 -3.089 26.985 1.00 29.88 C ATOM 803 O VAL A 54 28.550 -1.911 26.665 1.00 30.49 O ATOM 804 CB VAL A 54 26.835 -4.044 25.300 1.00 30.48 C ATOM 805 CG1 VAL A 54 28.031 -4.713 24.627 1.00 30.23 C ATOM 806 CG2 VAL A 54 25.581 -4.890 25.133 1.00 30.96 C ATOM 807 HA VAL A 54 27.137 -4.778 27.295 1.00 0.00 H ATOM 808 HB VAL A 54 26.684 -3.079 24.815 1.00 0.00 H ATOM 809 HG11 VAL A 54 28.908 -4.074 24.730 1.00 0.00 H ATOM 810 HG12 VAL A 54 28.223 -5.675 25.102 1.00 0.00 H ATOM 811 HG13 VAL A 54 27.813 -4.866 23.570 1.00 0.00 H ATOM 812 HG21 VAL A 54 25.722 -5.849 25.632 1.00 0.00 H ATOM 813 HG22 VAL A 54 24.732 -4.370 25.576 1.00 0.00 H ATOM 814 HG23 VAL A 54 25.395 -5.056 24.072 1.00 0.00 H ATOM 815 H VAL A 54 25.775 -2.108 26.953 1.00 0.00 H ATOM 816 N LYS A 55 29.416 -3.809 27.507 1.00 29.45 N ATOM 817 CA LYS A 55 30.763 -3.283 27.716 1.00 29.11 C ATOM 818 C LYS A 55 31.557 -3.253 26.413 1.00 28.32 C ATOM 819 O LYS A 55 31.693 -4.273 25.734 1.00 28.02 O ATOM 820 CB LYS A 55 31.521 -4.140 28.739 1.00 29.85 C ATOM 821 CG LYS A 55 33.019 -3.821 28.843 1.00 30.46 C ATOM 822 CD LYS A 55 33.313 -2.686 29.803 1.00 31.95 C ATOM 823 CE LYS A 55 34.306 -1.697 29.213 1.00 33.13 C ATOM 824 NZ LYS A 55 35.595 -2.302 28.737 1.00 35.83 N ATOM 825 HA LYS A 55 30.658 -2.265 28.090 1.00 0.00 H ATOM 826 HB2 LYS A 55 31.069 -3.983 29.718 1.00 0.00 H ATOM 827 HB3 LYS A 55 31.413 -5.187 28.455 1.00 0.00 H ATOM 828 HG2 LYS A 55 33.542 -4.713 29.187 1.00 0.00 H ATOM 829 HG3 LYS A 55 33.386 -3.545 27.854 1.00 0.00 H ATOM 830 HD2 LYS A 55 32.384 -2.163 30.028 1.00 0.00 H ATOM 831 HD3 LYS A 55 33.728 -3.099 30.723 1.00 0.00 H ATOM 832 HE2 LYS A 55 34.541 -0.956 29.977 1.00 0.00 H ATOM 833 HE3 LYS A 55 33.830 -1.204 28.365 1.00 0.00 H ATOM 834 HZ1 LYS A 55 36.074 -2.767 29.535 1.00 0.00 H ATOM 835 HZ2 LYS A 55 35.394 -3.003 27.995 1.00 0.00 H ATOM 836 HZ3 LYS A 55 36.206 -1.554 28.352 1.00 0.00 H ATOM 837 H LYS A 55 29.220 -4.793 27.780 1.00 0.00 H ATOM 838 N VAL A 56 32.123 -2.091 26.103 1.00 27.63 N ATOM 839 CA VAL A 56 32.971 -1.928 24.920 1.00 27.37 C ATOM 840 C VAL A 56 34.243 -1.147 25.277 1.00 27.29 C ATOM 841 O VAL A 56 34.368 -0.620 26.379 1.00 26.89 O ATOM 842 CB VAL A 56 32.222 -1.203 23.761 1.00 27.16 C ATOM 843 CG1 VAL A 56 30.928 -1.942 23.378 1.00 27.16 C ATOM 844 CG2 VAL A 56 31.920 0.238 24.114 1.00 26.87 C ATOM 845 HA VAL A 56 33.238 -2.927 24.576 1.00 0.00 H ATOM 846 HB VAL A 56 32.887 -1.211 22.897 1.00 0.00 H ATOM 847 HG11 VAL A 56 31.171 -2.954 23.053 1.00 0.00 H ATOM 848 HG12 VAL A 56 30.267 -1.986 24.243 1.00 0.00 H ATOM 849 HG13 VAL A 56 30.433 -1.408 22.567 1.00 0.00 H ATOM 850 HG21 VAL A 56 31.292 0.269 25.005 1.00 0.00 H ATOM 851 HG22 VAL A 56 32.853 0.767 24.307 1.00 0.00 H ATOM 852 HG23 VAL A 56 31.398 0.712 23.283 1.00 0.00 H ATOM 853 H VAL A 56 31.958 -1.271 26.721 1.00 0.00 H ATOM 854 N ARG A 57 35.176 -1.092 24.331 1.00 27.39 N ATOM 855 CA ARG A 57 36.386 -0.280 24.455 1.00 27.66 C ATOM 856 C ARG A 57 36.317 0.866 23.447 1.00 27.62 C ATOM 857 O ARG A 57 36.057 0.641 22.263 1.00 27.94 O ATOM 858 CB ARG A 57 37.637 -1.129 24.206 1.00 27.72 C ATOM 859 CG ARG A 57 37.640 -2.457 24.953 1.00 28.33 C ATOM 860 CD ARG A 57 39.014 -3.116 24.983 1.00 28.61 C ATOM 861 NE ARG A 57 39.503 -3.499 23.660 1.00 29.69 N ATOM 862 CZ ARG A 57 39.345 -4.694 23.091 1.00 31.23 C ATOM 863 NH1 ARG A 57 38.688 -5.676 23.704 1.00 32.35 N ATOM 864 NH2 ARG A 57 39.851 -4.911 21.885 1.00 31.35 N ATOM 865 HA ARG A 57 36.449 0.121 25.467 1.00 0.00 H ATOM 866 HB2 ARG A 57 37.705 -1.335 23.138 1.00 0.00 H ATOM 867 HB3 ARG A 57 38.509 -0.556 24.520 1.00 0.00 H ATOM 868 HG2 ARG A 57 37.316 -2.281 25.979 1.00 0.00 H ATOM 869 HG3 ARG A 57 36.940 -3.134 24.463 1.00 0.00 H ATOM 870 HD2 ARG A 57 38.955 -4.011 25.602 1.00 0.00 H ATOM 871 HD3 ARG A 57 39.724 -2.416 25.425 1.00 0.00 H ATOM 872 HE ARG A 57 40.018 -2.778 23.116 1.00 0.00 H ATOM 873 HH12 ARG A 57 38.579 -6.599 23.238 1.00 0.00 H ATOM 874 HH11 ARG A 57 38.284 -5.520 24.649 1.00 0.00 H ATOM 875 HH22 ARG A 57 39.734 -5.839 21.431 1.00 0.00 H ATOM 876 HH21 ARG A 57 40.365 -4.153 21.393 1.00 0.00 H ATOM 877 H ARG A 57 35.039 -1.651 23.465 1.00 0.00 H ATOM 878 N GLN A 58 36.536 2.086 23.930 1.00 27.79 N ATOM 879 CA GLN A 58 36.465 3.297 23.107 1.00 28.07 C ATOM 880 C GLN A 58 37.863 3.694 22.638 1.00 28.13 C ATOM 881 O GLN A 58 38.767 3.871 23.452 1.00 28.34 O ATOM 882 CB GLN A 58 35.834 4.443 23.918 1.00 27.92 C ATOM 883 CG GLN A 58 35.729 5.796 23.190 1.00 29.08 C ATOM 884 CD GLN A 58 35.016 6.879 24.012 1.00 30.37 C ATOM 885 OE1 GLN A 58 34.136 6.591 24.823 1.00 31.26 O ATOM 886 NE2 GLN A 58 35.404 8.128 23.801 1.00 31.80 N ATOM 887 HA GLN A 58 35.845 3.097 22.233 1.00 0.00 H ATOM 888 HB2 GLN A 58 34.828 4.137 24.204 1.00 0.00 H ATOM 889 HB3 GLN A 58 36.436 4.590 24.815 1.00 0.00 H ATOM 890 HG2 GLN A 58 36.736 6.144 22.960 1.00 0.00 H ATOM 891 HG3 GLN A 58 35.177 5.647 22.262 1.00 0.00 H ATOM 892 HE22 GLN A 58 36.151 8.330 23.107 1.00 0.00 H ATOM 893 HE21 GLN A 58 34.961 8.906 24.330 1.00 0.00 H ATOM 894 H GLN A 58 36.768 2.185 24.939 1.00 0.00 H ATOM 895 N TYR A 59 38.030 3.805 21.326 1.00 28.46 N ATOM 896 CA TYR A 59 39.244 4.348 20.720 1.00 28.69 C ATOM 897 C TYR A 59 38.866 5.640 20.023 1.00 28.76 C ATOM 898 O TYR A 59 37.903 5.671 19.261 1.00 27.31 O ATOM 899 CB TYR A 59 39.839 3.379 19.697 1.00 28.76 C ATOM 900 CG TYR A 59 40.386 2.114 20.305 1.00 29.85 C ATOM 901 CD1 TYR A 59 39.568 1.005 20.507 1.00 30.18 C ATOM 902 CD2 TYR A 59 41.721 2.028 20.692 1.00 31.74 C ATOM 903 CE1 TYR A 59 40.061 -0.146 21.092 1.00 31.23 C ATOM 904 CE2 TYR A 59 42.228 0.870 21.262 1.00 32.62 C ATOM 905 CZ TYR A 59 41.390 -0.207 21.462 1.00 31.90 C ATOM 906 OH TYR A 59 41.890 -1.349 22.035 1.00 36.07 O ATOM 907 HA TYR A 59 39.993 4.514 21.494 1.00 0.00 H ATOM 908 HB3 TYR A 59 40.649 3.887 19.173 1.00 0.00 H ATOM 909 HB2 TYR A 59 39.059 3.109 18.985 1.00 0.00 H ATOM 910 HD2 TYR A 59 42.378 2.885 20.544 1.00 0.00 H ATOM 911 HE2 TYR A 59 43.278 0.812 21.549 1.00 0.00 H ATOM 912 HE1 TYR A 59 39.405 -1.000 21.260 1.00 0.00 H ATOM 913 HD1 TYR A 59 38.523 1.045 20.199 1.00 0.00 H ATOM 914 HH TYR A 59 41.169 -2.023 22.109 1.00 0.00 H ATOM 915 H TYR A 59 37.261 3.491 20.700 1.00 0.00 H ATOM 916 N ASP A 60 39.633 6.695 20.280 1.00 28.73 N ATOM 917 CA ASP A 60 39.335 8.015 19.745 1.00 29.41 C ATOM 918 C ASP A 60 40.289 8.370 18.617 1.00 29.61 C ATOM 919 O ASP A 60 41.410 7.861 18.558 1.00 29.88 O ATOM 920 CB ASP A 60 39.401 9.065 20.851 1.00 29.40 C ATOM 921 CG ASP A 60 38.295 8.901 21.886 1.00 29.86 C ATOM 922 OD1 ASP A 60 37.136 8.621 21.511 1.00 30.58 O ATOM 923 OD2 ASP A 60 38.575 9.089 23.087 1.00 33.03 O ATOM 924 HA ASP A 60 38.323 7.998 19.341 1.00 0.00 H ATOM 925 HB2 ASP A 60 40.364 8.982 21.354 1.00 0.00 H ATOM 926 HB3 ASP A 60 39.312 10.053 20.400 1.00 0.00 H ATOM 927 H ASP A 60 40.472 6.573 20.882 1.00 0.00 H ATOM 928 N GLN A 61 39.811 9.209 17.703 1.00 29.55 N ATOM 929 CA GLN A 61 40.621 9.729 16.598 1.00 30.28 C ATOM 930 C GLN A 61 41.305 8.633 15.789 1.00 29.30 C ATOM 931 O GLN A 61 42.504 8.691 15.508 1.00 28.96 O ATOM 932 CB GLN A 61 41.632 10.771 17.100 1.00 30.95 C ATOM 933 CG GLN A 61 41.107 12.211 17.019 1.00 32.67 C ATOM 934 CD GLN A 61 40.298 12.598 18.229 1.00 36.51 C ATOM 935 OE1 GLN A 61 40.617 12.197 19.351 1.00 40.40 O ATOM 936 NE2 GLN A 61 39.240 13.387 18.019 1.00 37.24 N ATOM 937 HA GLN A 61 39.931 10.222 15.913 1.00 0.00 H ATOM 938 HB2 GLN A 61 41.873 10.548 18.139 1.00 0.00 H ATOM 939 HB3 GLN A 61 42.536 10.697 16.495 1.00 0.00 H ATOM 940 HG2 GLN A 61 41.956 12.889 16.934 1.00 0.00 H ATOM 941 HG3 GLN A 61 40.479 12.305 16.133 1.00 0.00 H ATOM 942 HE22 GLN A 61 39.009 13.701 17.055 1.00 0.00 H ATOM 943 HE21 GLN A 61 38.648 13.687 18.820 1.00 0.00 H ATOM 944 H GLN A 61 38.818 9.510 17.775 1.00 0.00 H ATOM 945 N ILE A 62 40.510 7.643 15.401 1.00 28.58 N ATOM 946 CA ILE A 62 40.982 6.510 14.616 1.00 27.95 C ATOM 947 C ILE A 62 40.658 6.763 13.151 1.00 27.11 C ATOM 948 O ILE A 62 39.500 6.980 12.817 1.00 26.47 O ATOM 949 CB ILE A 62 40.284 5.196 15.048 1.00 27.56 C ATOM 950 CG1 ILE A 62 40.566 4.889 16.523 1.00 28.62 C ATOM 951 CG2 ILE A 62 40.735 4.034 14.183 1.00 28.10 C ATOM 952 CD1 ILE A 62 42.054 4.693 16.870 1.00 28.34 C ATOM 953 HA ILE A 62 42.055 6.406 14.774 1.00 0.00 H ATOM 954 HB ILE A 62 39.210 5.332 14.917 1.00 0.00 H ATOM 955 HG12 ILE A 62 40.184 5.717 17.121 1.00 0.00 H ATOM 956 HG13 ILE A 62 40.033 3.976 16.787 1.00 0.00 H ATOM 957 HD11 ILE A 62 42.453 3.859 16.293 1.00 0.00 H ATOM 958 HD12 ILE A 62 42.605 5.601 16.627 1.00 0.00 H ATOM 959 HD13 ILE A 62 42.153 4.481 17.935 1.00 0.00 H ATOM 960 HG21 ILE A 62 40.485 4.239 13.142 1.00 0.00 H ATOM 961 HG22 ILE A 62 41.813 3.907 14.280 1.00 0.00 H ATOM 962 HG23 ILE A 62 40.230 3.124 14.507 1.00 0.00 H ATOM 963 H ILE A 62 39.506 7.678 15.669 1.00 0.00 H ATOM 964 N PRO A 63 41.676 6.718 12.268 1.00 26.62 N ATOM 965 CA PRO A 63 41.422 6.772 10.836 1.00 25.86 C ATOM 966 C PRO A 63 40.724 5.518 10.321 1.00 24.93 C ATOM 967 O PRO A 63 41.150 4.399 10.618 1.00 23.87 O ATOM 968 CB PRO A 63 42.823 6.896 10.230 1.00 25.63 C ATOM 969 CG PRO A 63 43.691 7.324 11.330 1.00 27.47 C ATOM 970 CD PRO A 63 43.122 6.690 12.546 1.00 26.87 C ATOM 971 HA PRO A 63 40.756 7.593 10.572 1.00 0.00 H ATOM 972 HD3 PRO A 63 43.482 5.668 12.664 1.00 0.00 H ATOM 973 HD2 PRO A 63 43.363 7.264 13.441 1.00 0.00 H ATOM 974 HG3 PRO A 63 43.681 8.410 11.425 1.00 0.00 H ATOM 975 HG2 PRO A 63 44.713 6.984 11.165 1.00 0.00 H ATOM 976 HB2 PRO A 63 43.154 5.935 9.835 1.00 0.00 H ATOM 977 HB3 PRO A 63 42.828 7.637 9.430 1.00 0.00 H ATOM 978 N ILE A 64 39.658 5.718 9.554 1.00 24.43 N ATOM 979 CA ILE A 64 38.877 4.612 9.025 1.00 24.59 C ATOM 980 C ILE A 64 38.289 4.989 7.657 1.00 24.76 C ATOM 981 O ILE A 64 37.793 6.097 7.462 1.00 24.76 O ATOM 982 CB ILE A 64 37.799 4.130 10.049 1.00 24.45 C ATOM 983 CG1 ILE A 64 36.864 3.103 9.414 1.00 24.29 C ATOM 984 CG2 ILE A 64 37.010 5.307 10.642 1.00 25.71 C ATOM 985 CD1 ILE A 64 36.018 2.339 10.429 1.00 26.41 C ATOM 986 HA ILE A 64 39.533 3.756 8.867 1.00 0.00 H ATOM 987 HB ILE A 64 38.324 3.646 10.873 1.00 0.00 H ATOM 988 HG12 ILE A 64 36.195 3.623 8.729 1.00 0.00 H ATOM 989 HG13 ILE A 64 37.467 2.385 8.857 1.00 0.00 H ATOM 990 HD11 ILE A 64 36.673 1.803 11.116 1.00 0.00 H ATOM 991 HD12 ILE A 64 35.400 3.042 10.988 1.00 0.00 H ATOM 992 HD13 ILE A 64 35.379 1.628 9.906 1.00 0.00 H ATOM 993 HG21 ILE A 64 37.696 5.980 11.157 1.00 0.00 H ATOM 994 HG22 ILE A 64 36.505 5.845 9.840 1.00 0.00 H ATOM 995 HG23 ILE A 64 36.271 4.928 11.349 1.00 0.00 H ATOM 996 H ILE A 64 39.375 6.692 9.326 1.00 0.00 H ATOM 997 N GLU A 65 38.402 4.085 6.693 1.00 24.99 N ATOM 998 CA GLU A 65 37.950 4.384 5.341 1.00 25.85 C ATOM 999 C GLU A 65 36.699 3.578 5.024 1.00 25.69 C ATOM 1000 O GLU A 65 36.686 2.352 5.130 1.00 24.63 O ATOM 1001 CB GLU A 65 39.051 4.122 4.316 1.00 26.12 C ATOM 1002 CG GLU A 65 38.771 4.790 2.977 1.00 27.38 C ATOM 1003 CD GLU A 65 39.899 4.626 1.986 1.00 30.81 C ATOM 1004 OE1 GLU A 65 39.812 5.212 0.888 1.00 35.58 O ATOM 1005 OE2 GLU A 65 40.863 3.909 2.294 1.00 33.09 O ATOM 1006 HA GLU A 65 37.705 5.445 5.284 1.00 0.00 H ATOM 1007 HB2 GLU A 65 39.993 4.506 4.708 1.00 0.00 H ATOM 1008 HB3 GLU A 65 39.135 3.047 4.160 1.00 0.00 H ATOM 1009 HG2 GLU A 65 37.869 4.351 2.552 1.00 0.00 H ATOM 1010 HG3 GLU A 65 38.610 5.855 3.147 1.00 0.00 H ATOM 1011 H GLU A 65 38.817 3.155 6.904 1.00 0.00 H ATOM 1012 N ILE A 66 35.646 4.293 4.643 1.00 26.50 N ATOM 1013 CA ILE A 66 34.324 3.708 4.523 1.00 26.86 C ATOM 1014 C ILE A 66 33.859 3.862 3.090 1.00 27.39 C ATOM 1015 O ILE A 66 33.576 4.970 2.628 1.00 26.82 O ATOM 1016 CB ILE A 66 33.305 4.363 5.480 1.00 26.95 C ATOM 1017 CG1 ILE A 66 33.717 4.116 6.940 1.00 27.21 C ATOM 1018 CG2 ILE A 66 31.902 3.793 5.213 1.00 26.23 C ATOM 1019 CD1 ILE A 66 33.259 5.167 7.898 1.00 27.83 C ATOM 1020 HA ILE A 66 34.387 2.655 4.799 1.00 0.00 H ATOM 1021 HB ILE A 66 33.287 5.439 5.304 1.00 0.00 H ATOM 1022 HG12 ILE A 66 33.298 3.161 7.256 1.00 0.00 H ATOM 1023 HG13 ILE A 66 34.805 4.066 6.983 1.00 0.00 H ATOM 1024 HD11 ILE A 66 33.679 6.130 7.607 1.00 0.00 H ATOM 1025 HD12 ILE A 66 32.171 5.224 7.880 1.00 0.00 H ATOM 1026 HD13 ILE A 66 33.594 4.911 8.903 1.00 0.00 H ATOM 1027 HG21 ILE A 66 31.616 4.002 4.182 1.00 0.00 H ATOM 1028 HG22 ILE A 66 31.912 2.715 5.377 1.00 0.00 H ATOM 1029 HG23 ILE A 66 31.187 4.259 5.891 1.00 0.00 H ATOM 1030 H ILE A 66 35.773 5.302 4.424 1.00 0.00 H ATOM 1031 N CYS A 67 33.811 2.737 2.386 1.00 28.23 N ATOM 1032 CA CYS A 67 33.447 2.735 0.979 1.00 28.97 C ATOM 1033 C CYS A 67 34.244 3.811 0.234 1.00 28.63 C ATOM 1034 O CYS A 67 33.713 4.529 -0.615 1.00 29.61 O ATOM 1035 CB CYS A 67 31.934 2.956 0.841 1.00 28.84 C ATOM 1036 SG CYS A 67 31.231 2.195 -0.621 1.00 31.82 S ATOM 1037 HA CYS A 67 33.691 1.771 0.533 1.00 0.00 H ATOM 1038 HB2 CYS A 67 31.744 4.028 0.797 1.00 0.00 H ATOM 1039 HB3 CYS A 67 31.442 2.537 1.719 1.00 0.00 H ATOM 1040 HG CYS A 67 29.874 2.445 -0.661 1.00 0.00 H ATOM 1041 H CYS A 67 34.039 1.836 2.853 1.00 0.00 H ATOM 1042 N GLY A 68 35.522 3.930 0.577 1.00 28.06 N ATOM 1043 CA GLY A 68 36.420 4.870 -0.086 1.00 27.61 C ATOM 1044 C GLY A 68 36.355 6.309 0.395 1.00 27.56 C ATOM 1045 O GLY A 68 36.990 7.187 -0.203 1.00 27.56 O ATOM 1046 HA3 GLY A 68 36.183 4.863 -1.150 1.00 0.00 H ATOM 1047 HA2 GLY A 68 37.440 4.516 0.060 1.00 0.00 H ATOM 1048 H GLY A 68 35.895 3.334 1.343 1.00 0.00 H ATOM 1049 N HIS A 69 35.588 6.565 1.456 1.00 26.62 N ATOM 1050 CA HIS A 69 35.544 7.894 2.082 1.00 26.22 C ATOM 1051 C HIS A 69 36.238 7.856 3.449 1.00 26.00 C ATOM 1052 O HIS A 69 35.946 6.994 4.294 1.00 24.92 O ATOM 1053 CB HIS A 69 34.106 8.407 2.229 1.00 25.81 C ATOM 1054 CG HIS A 69 33.418 8.654 0.923 1.00 26.79 C ATOM 1055 ND1 HIS A 69 33.041 9.914 0.506 1.00 28.99 N ATOM 1056 CD2 HIS A 69 33.055 7.805 -0.066 1.00 24.72 C ATOM 1057 CE1 HIS A 69 32.468 9.826 -0.681 1.00 30.55 C ATOM 1058 NE2 HIS A 69 32.471 8.559 -1.052 1.00 27.98 N ATOM 1059 HA HIS A 69 36.074 8.587 1.428 1.00 0.00 H ATOM 1060 HB2 HIS A 69 33.532 7.667 2.786 1.00 0.00 H ATOM 1061 HB3 HIS A 69 34.130 9.342 2.788 1.00 0.00 H ATOM 1062 HD2 HIS A 69 33.199 6.725 -0.077 1.00 0.00 H ATOM 1063 HE1 HIS A 69 32.062 10.658 -1.256 1.00 0.00 H ATOM 1064 H HIS A 69 35.004 5.801 1.852 1.00 0.00 H ATOM 1065 N LYS A 70 37.157 8.800 3.645 1.00 25.83 N ATOM 1066 CA LYS A 70 38.008 8.858 4.839 1.00 25.89 C ATOM 1067 C LYS A 70 37.310 9.529 6.000 1.00 24.90 C ATOM 1068 O LYS A 70 36.668 10.562 5.840 1.00 26.21 O ATOM 1069 CB LYS A 70 39.307 9.615 4.532 1.00 26.40 C ATOM 1070 CG LYS A 70 40.311 8.820 3.724 1.00 27.19 C ATOM 1071 CD LYS A 70 41.679 9.486 3.704 1.00 29.11 C ATOM 1072 CE LYS A 70 42.736 8.566 3.117 1.00 28.29 C ATOM 1073 NZ LYS A 70 44.092 9.176 3.163 1.00 28.22 N ATOM 1074 HA LYS A 70 38.232 7.829 5.121 1.00 0.00 H ATOM 1075 HB2 LYS A 70 39.054 10.516 3.973 1.00 0.00 H ATOM 1076 HB3 LYS A 70 39.772 9.894 5.477 1.00 0.00 H ATOM 1077 HG2 LYS A 70 40.409 7.827 4.162 1.00 0.00 H ATOM 1078 HG3 LYS A 70 39.948 8.730 2.700 1.00 0.00 H ATOM 1079 HD2 LYS A 70 41.623 10.393 3.101 1.00 0.00 H ATOM 1080 HD3 LYS A 70 41.962 9.746 4.724 1.00 0.00 H ATOM 1081 HE2 LYS A 70 42.481 8.353 2.079 1.00 0.00 H ATOM 1082 HE3 LYS A 70 42.749 7.636 3.685 1.00 0.00 H ATOM 1083 HZ1 LYS A 70 44.091 10.061 2.617 1.00 0.00 H ATOM 1084 HZ2 LYS A 70 44.347 9.377 4.151 1.00 0.00 H ATOM 1085 HZ3 LYS A 70 44.782 8.515 2.753 1.00 0.00 H ATOM 1086 H LYS A 70 37.277 9.532 2.916 1.00 0.00 H ATOM 1087 N ALA A 71 37.452 8.930 7.174 1.00 24.77 N ATOM 1088 CA ALA A 71 36.947 9.487 8.427 1.00 23.48 C ATOM 1089 C ALA A 71 38.027 9.347 9.487 1.00 22.76 C ATOM 1090 O ALA A 71 38.917 8.506 9.377 1.00 22.39 O ATOM 1091 CB ALA A 71 35.684 8.747 8.870 1.00 23.60 C ATOM 1092 HA ALA A 71 36.694 10.538 8.285 1.00 0.00 H ATOM 1093 HB1 ALA A 71 34.917 8.848 8.102 1.00 0.00 H ATOM 1094 HB2 ALA A 71 35.915 7.692 9.018 1.00 0.00 H ATOM 1095 HB3 ALA A 71 35.322 9.176 9.805 1.00 0.00 H ATOM 1096 H ALA A 71 37.948 8.017 7.205 1.00 0.00 H ATOM 1097 N ILE A 72 37.947 10.183 10.508 1.00 22.19 N ATOM 1098 CA ILE A 72 38.806 10.055 11.678 1.00 22.20 C ATOM 1099 C ILE A 72 37.955 10.354 12.891 1.00 22.73 C ATOM 1100 O ILE A 72 37.576 11.497 13.137 1.00 22.85 O ATOM 1101 CB ILE A 72 40.004 11.032 11.655 1.00 22.03 C ATOM 1102 CG1 ILE A 72 40.745 10.957 10.313 1.00 22.33 C ATOM 1103 CG2 ILE A 72 40.940 10.722 12.815 1.00 20.89 C ATOM 1104 CD1 ILE A 72 41.845 12.002 10.161 1.00 22.65 C ATOM 1105 HA ILE A 72 39.221 9.047 11.695 1.00 0.00 H ATOM 1106 HB ILE A 72 39.632 12.051 11.767 1.00 0.00 H ATOM 1107 HG12 ILE A 72 41.194 9.968 10.223 1.00 0.00 H ATOM 1108 HG13 ILE A 72 40.021 11.100 9.511 1.00 0.00 H ATOM 1109 HD11 ILE A 72 41.411 12.999 10.237 1.00 0.00 H ATOM 1110 HD12 ILE A 72 42.585 11.866 10.949 1.00 0.00 H ATOM 1111 HD13 ILE A 72 42.323 11.886 9.188 1.00 0.00 H ATOM 1112 HG21 ILE A 72 40.400 10.833 13.755 1.00 0.00 H ATOM 1113 HG22 ILE A 72 41.305 9.699 12.722 1.00 0.00 H ATOM 1114 HG23 ILE A 72 41.783 11.413 12.795 1.00 0.00 H ATOM 1115 H ILE A 72 37.251 10.955 10.475 1.00 0.00 H ATOM 1116 N GLY A 73 37.644 9.315 13.647 1.00 22.73 N ATOM 1117 CA GLY A 73 36.723 9.465 14.739 1.00 22.50 C ATOM 1118 C GLY A 73 36.738 8.302 15.697 1.00 22.24 C ATOM 1119 O GLY A 73 37.653 7.471 15.710 1.00 22.43 O ATOM 1120 HA3 GLY A 73 35.717 9.565 14.332 1.00 0.00 H ATOM 1121 HA2 GLY A 73 36.983 10.370 15.289 1.00 0.00 H ATOM 1122 H GLY A 73 38.068 8.386 13.450 1.00 0.00 H ATOM 1123 N THR A 74 35.702 8.275 16.518 1.00 22.42 N ATOM 1124 CA THR A 74 35.601 7.335 17.623 1.00 22.34 C ATOM 1125 C THR A 74 35.052 6.004 17.149 1.00 22.41 C ATOM 1126 O THR A 74 34.059 5.946 16.424 1.00 21.91 O ATOM 1127 CB THR A 74 34.728 7.920 18.738 1.00 22.18 C ATOM 1128 OG1 THR A 74 35.351 9.115 19.223 1.00 20.90 O ATOM 1129 CG2 THR A 74 34.550 6.932 19.893 1.00 22.81 C ATOM 1130 HA THR A 74 36.600 7.161 18.022 1.00 0.00 H ATOM 1131 HB THR A 74 33.740 8.135 18.331 1.00 0.00 H ATOM 1132 HG1 THR A 74 36.250 8.897 19.576 1.00 0.00 H ATOM 1133 HG23 THR A 74 34.076 6.023 19.522 1.00 0.00 H ATOM 1134 HG21 THR A 74 35.525 6.688 20.315 1.00 0.00 H ATOM 1135 HG22 THR A 74 33.923 7.383 20.662 1.00 0.00 H ATOM 1136 H THR A 74 34.928 8.953 16.368 1.00 0.00 H ATOM 1137 N VAL A 75 35.745 4.947 17.553 1.00 22.62 N ATOM 1138 CA VAL A 75 35.392 3.573 17.231 1.00 23.64 C ATOM 1139 C VAL A 75 35.259 2.807 18.539 1.00 24.12 C ATOM 1140 O VAL A 75 36.167 2.822 19.390 1.00 23.64 O ATOM 1141 CB VAL A 75 36.460 2.925 16.322 1.00 24.30 C ATOM 1142 CG1 VAL A 75 36.133 1.458 16.030 1.00 24.11 C ATOM 1143 CG2 VAL A 75 36.574 3.716 15.022 1.00 23.84 C ATOM 1144 HA VAL A 75 34.450 3.549 16.683 1.00 0.00 H ATOM 1145 HB VAL A 75 37.416 2.948 16.845 1.00 0.00 H ATOM 1146 HG11 VAL A 75 36.093 0.902 16.967 1.00 0.00 H ATOM 1147 HG12 VAL A 75 35.168 1.395 15.528 1.00 0.00 H ATOM 1148 HG13 VAL A 75 36.906 1.036 15.388 1.00 0.00 H ATOM 1149 HG21 VAL A 75 35.612 3.712 14.510 1.00 0.00 H ATOM 1150 HG22 VAL A 75 36.863 4.742 15.247 1.00 0.00 H ATOM 1151 HG23 VAL A 75 37.328 3.256 14.383 1.00 0.00 H ATOM 1152 H VAL A 75 36.591 5.111 18.135 1.00 0.00 H ATOM 1153 N LEU A 76 34.096 2.180 18.711 1.00 24.00 N ATOM 1154 CA LEU A 76 33.849 1.307 19.841 1.00 23.51 C ATOM 1155 C LEU A 76 34.087 -0.142 19.430 1.00 24.00 C ATOM 1156 O LEU A 76 33.678 -0.575 18.349 1.00 24.16 O ATOM 1157 CB LEU A 76 32.433 1.507 20.379 1.00 23.62 C ATOM 1158 CG LEU A 76 32.013 2.952 20.658 1.00 22.68 C ATOM 1159 CD1 LEU A 76 30.612 2.985 21.269 1.00 23.53 C ATOM 1160 CD2 LEU A 76 33.022 3.677 21.551 1.00 22.50 C ATOM 1161 HA LEU A 76 34.541 1.557 20.645 1.00 0.00 H ATOM 1162 HB2 LEU A 76 31.738 1.094 19.648 1.00 0.00 H ATOM 1163 HB3 LEU A 76 32.350 0.950 21.312 1.00 0.00 H ATOM 1164 HG LEU A 76 31.992 3.485 19.707 1.00 0.00 H ATOM 1165 HD21 LEU A 76 33.103 3.154 22.504 1.00 0.00 H ATOM 1166 HD22 LEU A 76 33.995 3.692 21.060 1.00 0.00 H ATOM 1167 HD23 LEU A 76 32.684 4.699 21.723 1.00 0.00 H ATOM 1168 HD11 LEU A 76 29.903 2.534 20.574 1.00 0.00 H ATOM 1169 HD12 LEU A 76 30.612 2.425 22.204 1.00 0.00 H ATOM 1170 HD13 LEU A 76 30.326 4.019 21.462 1.00 0.00 H ATOM 1171 H LEU A 76 33.340 2.322 18.011 1.00 0.00 H ATOM 1172 N VAL A 77 34.794 -0.877 20.284 1.00 23.54 N ATOM 1173 CA VAL A 77 35.108 -2.273 20.029 1.00 23.17 C ATOM 1174 C VAL A 77 34.538 -3.179 21.131 1.00 23.15 C ATOM 1175 O VAL A 77 34.746 -2.954 22.335 1.00 21.77 O ATOM 1176 CB VAL A 77 36.620 -2.481 19.882 1.00 23.29 C ATOM 1177 CG1 VAL A 77 36.952 -3.960 19.824 1.00 24.45 C ATOM 1178 CG2 VAL A 77 37.121 -1.762 18.633 1.00 23.97 C ATOM 1179 HA VAL A 77 34.636 -2.551 19.087 1.00 0.00 H ATOM 1180 HB VAL A 77 37.122 -2.060 20.753 1.00 0.00 H ATOM 1181 HG11 VAL A 77 36.616 -4.443 20.742 1.00 0.00 H ATOM 1182 HG12 VAL A 77 36.448 -4.411 18.969 1.00 0.00 H ATOM 1183 HG13 VAL A 77 38.030 -4.085 19.720 1.00 0.00 H ATOM 1184 HG21 VAL A 77 36.614 -2.164 17.756 1.00 0.00 H ATOM 1185 HG22 VAL A 77 36.910 -0.696 18.720 1.00 0.00 H ATOM 1186 HG23 VAL A 77 38.196 -1.914 18.534 1.00 0.00 H ATOM 1187 H VAL A 77 35.133 -0.438 21.164 1.00 0.00 H ATOM 1188 N GLY A 78 33.816 -4.210 20.698 1.00 22.64 N ATOM 1189 CA GLY A 78 33.165 -5.103 21.624 1.00 22.44 C ATOM 1190 C GLY A 78 32.351 -6.195 20.965 1.00 22.13 C ATOM 1191 O GLY A 78 32.346 -6.327 19.739 1.00 21.60 O ATOM 1192 HA3 GLY A 78 32.500 -4.515 22.256 1.00 0.00 H ATOM 1193 HA2 GLY A 78 33.930 -5.573 22.242 1.00 0.00 H ATOM 1194 H GLY A 78 33.720 -4.374 19.676 1.00 0.00 H ATOM 1195 N PRO A 79 31.633 -6.972 21.789 1.00 22.29 N ATOM 1196 CA PRO A 79 30.835 -8.113 21.364 1.00 22.87 C ATOM 1197 C PRO A 79 29.501 -7.721 20.731 1.00 23.49 C ATOM 1198 O PRO A 79 28.438 -8.056 21.246 1.00 23.40 O ATOM 1199 CB PRO A 79 30.623 -8.876 22.666 1.00 22.88 C ATOM 1200 CG PRO A 79 30.579 -7.832 23.687 1.00 22.92 C ATOM 1201 CD PRO A 79 31.579 -6.795 23.248 1.00 22.21 C ATOM 1202 HA PRO A 79 31.331 -8.689 20.583 1.00 0.00 H ATOM 1203 HD3 PRO A 79 31.241 -5.792 23.508 1.00 0.00 H ATOM 1204 HD2 PRO A 79 32.554 -6.977 23.700 1.00 0.00 H ATOM 1205 HG3 PRO A 79 30.854 -8.239 24.660 1.00 0.00 H ATOM 1206 HG2 PRO A 79 29.581 -7.398 23.745 1.00 0.00 H ATOM 1207 HB2 PRO A 79 29.686 -9.433 22.641 1.00 0.00 H ATOM 1208 HB3 PRO A 79 31.448 -9.564 22.851 1.00 0.00 H ATOM 1209 N THR A 80 29.580 -7.014 19.611 1.00 24.47 N ATOM 1210 CA THR A 80 28.414 -6.736 18.776 1.00 24.58 C ATOM 1211 C THR A 80 28.203 -7.931 17.844 1.00 24.92 C ATOM 1212 O THR A 80 29.168 -8.586 17.430 1.00 25.01 O ATOM 1213 CB THR A 80 28.571 -5.413 17.954 1.00 24.89 C ATOM 1214 OG1 THR A 80 27.436 -5.233 17.086 1.00 24.24 O ATOM 1215 CG2 THR A 80 29.866 -5.408 17.121 1.00 25.07 C ATOM 1216 HA THR A 80 27.545 -6.592 19.419 1.00 0.00 H ATOM 1217 HB THR A 80 28.625 -4.589 18.665 1.00 0.00 H ATOM 1218 HG1 THR A 80 27.545 -4.394 16.571 1.00 0.00 H ATOM 1219 HG23 THR A 80 30.722 -5.544 17.782 1.00 0.00 H ATOM 1220 HG21 THR A 80 29.833 -6.220 16.395 1.00 0.00 H ATOM 1221 HG22 THR A 80 29.957 -4.456 16.599 1.00 0.00 H ATOM 1222 H THR A 80 30.506 -6.644 19.317 1.00 0.00 H ATOM 1223 N PRO A 81 26.938 -8.258 17.544 1.00 24.55 N ATOM 1224 CA PRO A 81 26.663 -9.291 16.548 1.00 24.41 C ATOM 1225 C PRO A 81 26.973 -8.888 15.108 1.00 24.23 C ATOM 1226 O PRO A 81 26.926 -9.732 14.206 1.00 24.63 O ATOM 1227 CB PRO A 81 25.158 -9.550 16.713 1.00 24.53 C ATOM 1228 CG PRO A 81 24.752 -8.871 17.975 1.00 24.04 C ATOM 1229 CD PRO A 81 25.697 -7.732 18.134 1.00 25.14 C ATOM 1230 HA PRO A 81 27.300 -10.160 16.715 1.00 0.00 H ATOM 1231 HD3 PRO A 81 25.347 -6.852 17.595 1.00 0.00 H ATOM 1232 HD2 PRO A 81 25.837 -7.480 19.185 1.00 0.00 H ATOM 1233 HG3 PRO A 81 24.834 -9.555 18.820 1.00 0.00 H ATOM 1234 HG2 PRO A 81 23.727 -8.509 17.900 1.00 0.00 H ATOM 1235 HB2 PRO A 81 24.609 -9.136 15.868 1.00 0.00 H ATOM 1236 HB3 PRO A 81 24.964 -10.620 16.781 1.00 0.00 H ATOM 1237 N ALA A 82 27.257 -7.603 14.893 1.00 23.59 N ATOM 1238 CA ALA A 82 27.562 -7.086 13.561 1.00 22.44 C ATOM 1239 C ALA A 82 28.379 -5.798 13.655 1.00 21.59 C ATOM 1240 O ALA A 82 28.171 -4.994 14.567 1.00 21.32 O ATOM 1241 CB ALA A 82 26.277 -6.850 12.786 1.00 22.68 C ATOM 1242 HA ALA A 82 28.160 -7.826 13.029 1.00 0.00 H ATOM 1243 HB1 ALA A 82 25.734 -7.790 12.690 1.00 0.00 H ATOM 1244 HB2 ALA A 82 25.661 -6.126 13.319 1.00 0.00 H ATOM 1245 HB3 ALA A 82 26.517 -6.465 11.795 1.00 0.00 H ATOM 1246 H ALA A 82 27.262 -6.947 15.700 1.00 0.00 H ATOM 1247 N ASN A 83 29.335 -5.631 12.741 1.00 20.93 N ATOM 1248 CA ASN A 83 30.042 -4.357 12.592 1.00 20.61 C ATOM 1249 C ASN A 83 29.030 -3.319 12.123 1.00 20.18 C ATOM 1250 O ASN A 83 28.293 -3.553 11.156 1.00 19.98 O ATOM 1251 CB ASN A 83 31.192 -4.452 11.575 1.00 20.34 C ATOM 1252 CG ASN A 83 32.319 -5.391 12.021 1.00 21.24 C ATOM 1253 OD1 ASN A 83 32.636 -5.490 13.205 1.00 22.07 O ATOM 1254 ND2 ASN A 83 32.942 -6.061 11.058 1.00 18.94 N ATOM 1255 HA ASN A 83 30.483 -4.081 13.550 1.00 0.00 H ATOM 1256 HB2 ASN A 83 30.790 -4.818 10.630 1.00 0.00 H ATOM 1257 HB3 ASN A 83 31.609 -3.455 11.429 1.00 0.00 H ATOM 1258 HD22 ASN A 83 32.642 -5.949 10.069 1.00 0.00 H ATOM 1259 HD21 ASN A 83 33.730 -6.698 11.293 1.00 0.00 H ATOM 1260 H ASN A 83 29.585 -6.425 12.118 1.00 0.00 H ATOM 1261 N ILE A 84 28.963 -2.194 12.822 1.00 19.21 N ATOM 1262 CA ILE A 84 28.026 -1.135 12.453 1.00 19.03 C ATOM 1263 C ILE A 84 28.727 0.217 12.386 1.00 19.32 C ATOM 1264 O ILE A 84 29.576 0.527 13.216 1.00 18.95 O ATOM 1265 CB ILE A 84 26.799 -1.081 13.388 1.00 19.07 C ATOM 1266 CG1 ILE A 84 27.203 -0.828 14.841 1.00 19.10 C ATOM 1267 CG2 ILE A 84 25.983 -2.379 13.277 1.00 18.51 C ATOM 1268 CD1 ILE A 84 26.020 -0.509 15.755 1.00 20.43 C ATOM 1269 HA ILE A 84 27.652 -1.376 11.458 1.00 0.00 H ATOM 1270 HB ILE A 84 26.179 -0.243 13.069 1.00 0.00 H ATOM 1271 HG12 ILE A 84 27.703 -1.719 15.221 1.00 0.00 H ATOM 1272 HG13 ILE A 84 27.895 0.014 14.866 1.00 0.00 H ATOM 1273 HD11 ILE A 84 25.515 0.387 15.395 1.00 0.00 H ATOM 1274 HD12 ILE A 84 25.323 -1.347 15.750 1.00 0.00 H ATOM 1275 HD13 ILE A 84 26.381 -0.341 16.770 1.00 0.00 H ATOM 1276 HG21 ILE A 84 25.642 -2.505 12.250 1.00 0.00 H ATOM 1277 HG22 ILE A 84 26.609 -3.225 13.560 1.00 0.00 H ATOM 1278 HG23 ILE A 84 25.122 -2.323 13.943 1.00 0.00 H ATOM 1279 H ILE A 84 29.586 -2.064 13.644 1.00 0.00 H ATOM 1280 N ILE A 85 28.402 0.978 11.346 1.00 19.76 N ATOM 1281 CA ILE A 85 28.860 2.354 11.183 1.00 19.34 C ATOM 1282 C ILE A 85 27.719 3.305 11.524 1.00 19.41 C ATOM 1283 O ILE A 85 26.700 3.364 10.828 1.00 18.58 O ATOM 1284 CB ILE A 85 29.300 2.661 9.741 1.00 19.48 C ATOM 1285 CG1 ILE A 85 30.244 1.559 9.204 1.00 17.82 C ATOM 1286 CG2 ILE A 85 29.928 4.068 9.681 1.00 20.30 C ATOM 1287 CD1 ILE A 85 31.534 1.383 9.983 1.00 16.83 C ATOM 1288 HA ILE A 85 29.715 2.485 11.846 1.00 0.00 H ATOM 1289 HB ILE A 85 28.430 2.660 9.085 1.00 0.00 H ATOM 1290 HG12 ILE A 85 29.705 0.612 9.224 1.00 0.00 H ATOM 1291 HG13 ILE A 85 30.502 1.807 8.174 1.00 0.00 H ATOM 1292 HD11 ILE A 85 32.099 2.315 9.964 1.00 0.00 H ATOM 1293 HD12 ILE A 85 31.301 1.119 11.015 1.00 0.00 H ATOM 1294 HD13 ILE A 85 32.126 0.589 9.529 1.00 0.00 H ATOM 1295 HG21 ILE A 85 29.193 4.806 10.001 1.00 0.00 H ATOM 1296 HG22 ILE A 85 30.795 4.106 10.341 1.00 0.00 H ATOM 1297 HG23 ILE A 85 30.239 4.283 8.658 1.00 0.00 H ATOM 1298 H ILE A 85 27.790 0.572 10.610 1.00 0.00 H ATOM 1299 N GLY A 86 27.928 4.067 12.585 1.00 19.31 N ATOM 1300 CA GLY A 86 26.894 4.924 13.148 1.00 19.67 C ATOM 1301 C GLY A 86 27.047 6.360 12.712 1.00 19.46 C ATOM 1302 O GLY A 86 27.961 6.710 11.958 1.00 17.55 O ATOM 1303 HA3 GLY A 86 26.953 4.878 14.235 1.00 0.00 H ATOM 1304 HA2 GLY A 86 25.920 4.560 12.823 1.00 0.00 H ATOM 1305 H GLY A 86 28.866 4.053 13.034 1.00 0.00 H ATOM 1306 N ARG A 87 26.141 7.190 13.220 1.00 19.53 N ATOM 1307 CA ARG A 87 26.048 8.573 12.812 1.00 20.23 C ATOM 1308 C ARG A 87 27.334 9.383 13.030 1.00 20.30 C ATOM 1309 O ARG A 87 27.638 10.270 12.231 1.00 20.26 O ATOM 1310 CB ARG A 87 24.851 9.249 13.485 1.00 20.53 C ATOM 1311 CG ARG A 87 23.504 8.797 12.922 1.00 19.77 C ATOM 1312 CD ARG A 87 22.326 9.579 13.517 1.00 19.93 C ATOM 1313 NE ARG A 87 22.309 9.542 14.985 1.00 20.08 N ATOM 1314 CZ ARG A 87 22.772 10.494 15.796 1.00 19.77 C ATOM 1315 NH1 ARG A 87 23.287 11.619 15.325 1.00 19.70 N ATOM 1316 NH2 ARG A 87 22.709 10.316 17.108 1.00 20.00 N ATOM 1317 HA ARG A 87 25.898 8.558 11.732 1.00 0.00 H ATOM 1318 HB2 ARG A 87 24.876 9.017 14.550 1.00 0.00 H ATOM 1319 HB3 ARG A 87 24.940 10.327 13.347 1.00 0.00 H ATOM 1320 HG2 ARG A 87 23.510 8.942 11.842 1.00 0.00 H ATOM 1321 HG3 ARG A 87 23.369 7.739 13.145 1.00 0.00 H ATOM 1322 HD2 ARG A 87 21.397 9.147 13.146 1.00 0.00 H ATOM 1323 HD3 ARG A 87 22.397 10.618 13.194 1.00 0.00 H ATOM 1324 HE ARG A 87 21.899 8.697 15.432 1.00 0.00 H ATOM 1325 HH12 ARG A 87 23.640 12.344 15.982 1.00 0.00 H ATOM 1326 HH11 ARG A 87 23.338 11.778 14.298 1.00 0.00 H ATOM 1327 HH22 ARG A 87 23.067 11.051 17.750 1.00 0.00 H ATOM 1328 HH21 ARG A 87 22.302 9.441 17.495 1.00 0.00 H ATOM 1329 H ARG A 87 25.477 6.832 13.935 1.00 0.00 H ATOM 1330 N ASN A 88 28.106 9.068 14.071 1.00 20.48 N ATOM 1331 CA ASN A 88 29.360 9.790 14.307 1.00 20.24 C ATOM 1332 C ASN A 88 30.272 9.807 13.069 1.00 20.25 C ATOM 1333 O ASN A 88 30.935 10.810 12.817 1.00 20.38 O ATOM 1334 CB ASN A 88 30.095 9.273 15.560 1.00 20.31 C ATOM 1335 CG ASN A 88 30.751 7.923 15.357 1.00 19.46 C ATOM 1336 OD1 ASN A 88 30.146 6.993 14.817 1.00 20.69 O ATOM 1337 ND2 ASN A 88 31.996 7.801 15.818 1.00 17.45 N ATOM 1338 HA ASN A 88 29.088 10.827 14.502 1.00 0.00 H ATOM 1339 HB2 ASN A 88 30.865 9.995 15.832 1.00 0.00 H ATOM 1340 HB3 ASN A 88 29.375 9.189 16.374 1.00 0.00 H ATOM 1341 HD22 ASN A 88 32.466 8.613 16.266 1.00 0.00 H ATOM 1342 HD21 ASN A 88 32.497 6.894 15.729 1.00 0.00 H ATOM 1343 H ASN A 88 27.817 8.307 14.718 1.00 0.00 H ATOM 1344 N LEU A 89 30.284 8.709 12.299 1.00 19.81 N ATOM 1345 CA LEU A 89 31.083 8.604 11.073 1.00 19.65 C ATOM 1346 C LEU A 89 30.280 8.773 9.779 1.00 19.73 C ATOM 1347 O LEU A 89 30.832 9.152 8.736 1.00 19.21 O ATOM 1348 CB LEU A 89 31.837 7.264 11.026 1.00 20.01 C ATOM 1349 CG LEU A 89 32.799 6.953 12.184 1.00 20.14 C ATOM 1350 CD1 LEU A 89 33.547 5.679 11.897 1.00 21.72 C ATOM 1351 CD2 LEU A 89 33.777 8.101 12.398 1.00 22.45 C ATOM 1352 HA LEU A 89 31.783 9.438 11.121 1.00 0.00 H ATOM 1353 HB2 LEU A 89 31.091 6.470 10.998 1.00 0.00 H ATOM 1354 HB3 LEU A 89 32.418 7.248 10.104 1.00 0.00 H ATOM 1355 HG LEU A 89 32.216 6.829 13.097 1.00 0.00 H ATOM 1356 HD21 LEU A 89 34.359 8.255 11.489 1.00 0.00 H ATOM 1357 HD22 LEU A 89 33.223 9.009 12.635 1.00 0.00 H ATOM 1358 HD23 LEU A 89 34.447 7.857 13.222 1.00 0.00 H ATOM 1359 HD11 LEU A 89 32.837 4.859 11.787 1.00 0.00 H ATOM 1360 HD12 LEU A 89 34.117 5.794 10.975 1.00 0.00 H ATOM 1361 HD13 LEU A 89 34.227 5.465 12.722 1.00 0.00 H ATOM 1362 H LEU A 89 29.701 7.896 12.584 1.00 0.00 H ATOM 1363 N LEU A 90 28.991 8.456 9.810 1.00 20.17 N ATOM 1364 CA LEU A 90 28.166 8.678 8.617 1.00 21.12 C ATOM 1365 C LEU A 90 28.139 10.174 8.252 1.00 21.48 C ATOM 1366 O LEU A 90 28.197 10.526 7.074 1.00 22.46 O ATOM 1367 CB LEU A 90 26.757 8.125 8.800 1.00 20.83 C ATOM 1368 CG LEU A 90 26.647 6.616 8.971 1.00 20.31 C ATOM 1369 CD1 LEU A 90 25.211 6.246 9.316 1.00 17.30 C ATOM 1370 CD2 LEU A 90 27.147 5.890 7.693 1.00 17.45 C ATOM 1371 HA LEU A 90 28.618 8.133 7.788 1.00 0.00 H ATOM 1372 HB2 LEU A 90 26.328 8.593 9.686 1.00 0.00 H ATOM 1373 HB3 LEU A 90 26.173 8.405 7.923 1.00 0.00 H ATOM 1374 HG LEU A 90 27.284 6.291 9.794 1.00 0.00 H ATOM 1375 HD21 LEU A 90 26.540 6.197 6.841 1.00 0.00 H ATOM 1376 HD22 LEU A 90 28.189 6.153 7.512 1.00 0.00 H ATOM 1377 HD23 LEU A 90 27.062 4.812 7.832 1.00 0.00 H ATOM 1378 HD11 LEU A 90 24.923 6.739 10.245 1.00 0.00 H ATOM 1379 HD12 LEU A 90 24.550 6.570 8.512 1.00 0.00 H ATOM 1380 HD13 LEU A 90 25.135 5.166 9.438 1.00 0.00 H ATOM 1381 H LEU A 90 28.570 8.054 10.672 1.00 0.00 H ATOM 1382 N THR A 91 28.083 11.042 9.263 1.00 21.56 N ATOM 1383 CA THR A 91 28.187 12.493 9.048 1.00 21.66 C ATOM 1384 C THR A 91 29.529 12.920 8.458 1.00 21.34 C ATOM 1385 O THR A 91 29.563 13.765 7.575 1.00 20.45 O ATOM 1386 CB THR A 91 27.937 13.309 10.336 1.00 21.46 C ATOM 1387 OG1 THR A 91 28.772 12.817 11.389 1.00 20.46 O ATOM 1388 CG2 THR A 91 26.472 13.216 10.746 1.00 22.27 C ATOM 1389 HA THR A 91 27.400 12.711 8.326 1.00 0.00 H ATOM 1390 HB THR A 91 28.179 14.354 10.144 1.00 0.00 H ATOM 1391 HG1 THR A 91 28.608 13.343 12.212 1.00 0.00 H ATOM 1392 HG23 THR A 91 25.845 13.593 9.938 1.00 0.00 H ATOM 1393 HG21 THR A 91 26.218 12.176 10.949 1.00 0.00 H ATOM 1394 HG22 THR A 91 26.308 13.813 11.643 1.00 0.00 H ATOM 1395 H THR A 91 27.962 10.682 10.231 1.00 0.00 H ATOM 1396 N GLN A 92 30.622 12.306 8.901 1.00 21.58 N ATOM 1397 CA GLN A 92 31.955 12.651 8.378 1.00 22.19 C ATOM 1398 C GLN A 92 32.138 12.366 6.879 1.00 22.70 C ATOM 1399 O GLN A 92 32.879 13.083 6.191 1.00 22.62 O ATOM 1400 CB GLN A 92 33.054 11.938 9.158 1.00 21.82 C ATOM 1401 CG GLN A 92 33.280 12.487 10.555 1.00 20.64 C ATOM 1402 CD GLN A 92 34.618 12.049 11.126 1.00 21.04 C ATOM 1403 OE1 GLN A 92 35.539 11.726 10.371 1.00 17.17 O ATOM 1404 NE2 GLN A 92 34.743 12.060 12.462 1.00 17.43 N ATOM 1405 HA GLN A 92 32.034 13.730 8.510 1.00 0.00 H ATOM 1406 HB2 GLN A 92 32.785 10.885 9.243 1.00 0.00 H ATOM 1407 HB3 GLN A 92 33.985 12.030 8.599 1.00 0.00 H ATOM 1408 HG2 GLN A 92 33.253 13.576 10.515 1.00 0.00 H ATOM 1409 HG3 GLN A 92 32.484 12.129 11.208 1.00 0.00 H ATOM 1410 HE22 GLN A 92 33.938 12.340 13.057 1.00 0.00 H ATOM 1411 HE21 GLN A 92 35.645 11.789 12.902 1.00 0.00 H ATOM 1412 H GLN A 92 30.534 11.569 9.630 1.00 0.00 H ATOM 1413 N ILE A 93 31.461 11.333 6.381 1.00 22.29 N ATOM 1414 CA ILE A 93 31.550 10.963 4.970 1.00 23.42 C ATOM 1415 C ILE A 93 30.429 11.579 4.131 1.00 23.39 C ATOM 1416 O ILE A 93 30.303 11.279 2.948 1.00 25.01 O ATOM 1417 CB ILE A 93 31.580 9.425 4.782 1.00 23.38 C ATOM 1418 CG1 ILE A 93 30.272 8.793 5.277 1.00 23.97 C ATOM 1419 CG2 ILE A 93 32.793 8.835 5.516 1.00 23.56 C ATOM 1420 CD1 ILE A 93 30.167 7.308 4.999 1.00 25.46 C ATOM 1421 HA ILE A 93 32.493 11.373 4.610 1.00 0.00 H ATOM 1422 HB ILE A 93 31.674 9.199 3.720 1.00 0.00 H ATOM 1423 HG12 ILE A 93 30.201 8.947 6.354 1.00 0.00 H ATOM 1424 HG13 ILE A 93 29.439 9.295 4.784 1.00 0.00 H ATOM 1425 HD11 ILE A 93 30.224 7.136 3.924 1.00 0.00 H ATOM 1426 HD12 ILE A 93 30.986 6.788 5.495 1.00 0.00 H ATOM 1427 HD13 ILE A 93 29.216 6.935 5.378 1.00 0.00 H ATOM 1428 HG21 ILE A 93 33.707 9.266 5.109 1.00 0.00 H ATOM 1429 HG22 ILE A 93 32.722 9.068 6.578 1.00 0.00 H ATOM 1430 HG23 ILE A 93 32.808 7.754 5.380 1.00 0.00 H ATOM 1431 H ILE A 93 30.853 10.775 7.013 1.00 0.00 H ATOM 1432 N GLY A 94 29.607 12.414 4.755 1.00 24.15 N ATOM 1433 CA GLY A 94 28.576 13.188 4.053 1.00 24.31 C ATOM 1434 C GLY A 94 27.324 12.406 3.710 1.00 24.51 C ATOM 1435 O GLY A 94 26.630 12.719 2.747 1.00 23.83 O ATOM 1436 HA3 GLY A 94 29.006 13.565 3.125 1.00 0.00 H ATOM 1437 HA2 GLY A 94 28.290 14.027 4.687 1.00 0.00 H ATOM 1438 H GLY A 94 29.697 12.525 5.785 1.00 0.00 H ATOM 1439 N CYS A 95 27.024 11.400 4.521 1.00 25.21 N ATOM 1440 CA CYS A 95 25.917 10.491 4.254 1.00 25.89 C ATOM 1441 C CYS A 95 24.589 11.116 4.699 1.00 25.69 C ATOM 1442 O CYS A 95 24.476 11.624 5.815 1.00 26.17 O ATOM 1443 CB CYS A 95 26.159 9.158 4.970 1.00 25.91 C ATOM 1444 SG CYS A 95 25.042 7.848 4.509 1.00 29.24 S ATOM 1445 HA CYS A 95 25.858 10.307 3.181 1.00 0.00 H ATOM 1446 HB2 CYS A 95 26.061 9.326 6.042 1.00 0.00 H ATOM 1447 HB3 CYS A 95 27.175 8.832 4.746 1.00 0.00 H ATOM 1448 HG CYS A 95 25.358 6.706 5.216 1.00 0.00 H ATOM 1449 H CYS A 95 27.598 11.255 5.376 1.00 0.00 H ATOM 1450 N THR A 96 23.613 11.115 3.796 1.00 25.11 N ATOM 1451 CA THR A 96 22.251 11.529 4.108 1.00 25.41 C ATOM 1452 C THR A 96 21.236 10.412 3.808 1.00 25.24 C ATOM 1453 O THR A 96 21.504 9.487 3.034 1.00 25.29 O ATOM 1454 CB THR A 96 21.834 12.788 3.296 1.00 25.00 C ATOM 1455 OG1 THR A 96 21.908 12.497 1.890 1.00 26.47 O ATOM 1456 CG2 THR A 96 22.733 13.970 3.627 1.00 25.61 C ATOM 1457 HA THR A 96 22.243 11.758 5.174 1.00 0.00 H ATOM 1458 HB THR A 96 20.811 13.052 3.564 1.00 0.00 H ATOM 1459 HG1 THR A 96 22.836 12.244 1.655 1.00 0.00 H ATOM 1460 HG23 THR A 96 22.671 14.184 4.694 1.00 0.00 H ATOM 1461 HG21 THR A 96 23.762 13.727 3.363 1.00 0.00 H ATOM 1462 HG22 THR A 96 22.407 14.842 3.061 1.00 0.00 H ATOM 1463 H THR A 96 23.831 10.806 2.827 1.00 0.00 H ATOM 1464 N LEU A 97 20.072 10.523 4.434 1.00 25.46 N ATOM 1465 CA LEU A 97 18.887 9.775 4.028 1.00 25.78 C ATOM 1466 C LEU A 97 18.031 10.633 3.103 1.00 25.83 C ATOM 1467 O LEU A 97 17.855 11.833 3.341 1.00 25.81 O ATOM 1468 CB LEU A 97 18.056 9.395 5.245 1.00 26.09 C ATOM 1469 CG LEU A 97 18.528 8.226 6.091 1.00 26.97 C ATOM 1470 CD1 LEU A 97 17.834 8.270 7.443 1.00 29.11 C ATOM 1471 CD2 LEU A 97 18.280 6.909 5.379 1.00 27.33 C ATOM 1472 HA LEU A 97 19.210 8.871 3.512 1.00 0.00 H ATOM 1473 HB2 LEU A 97 18.012 10.269 5.894 1.00 0.00 H ATOM 1474 HB3 LEU A 97 17.053 9.156 4.892 1.00 0.00 H ATOM 1475 HG LEU A 97 19.603 8.306 6.249 1.00 0.00 H ATOM 1476 HD21 LEU A 97 17.213 6.796 5.188 1.00 0.00 H ATOM 1477 HD22 LEU A 97 18.823 6.901 4.434 1.00 0.00 H ATOM 1478 HD23 LEU A 97 18.627 6.088 6.006 1.00 0.00 H ATOM 1479 HD11 LEU A 97 18.078 9.206 7.945 1.00 0.00 H ATOM 1480 HD12 LEU A 97 16.756 8.204 7.299 1.00 0.00 H ATOM 1481 HD13 LEU A 97 18.172 7.431 8.051 1.00 0.00 H ATOM 1482 H LEU A 97 20.001 11.169 5.246 1.00 0.00 H ATOM 1483 N ASN A 98 17.497 10.026 2.048 1.00 25.45 N ATOM 1484 CA ASN A 98 16.743 10.779 1.053 1.00 26.13 C ATOM 1485 C ASN A 98 15.562 9.966 0.557 1.00 26.20 C ATOM 1486 O ASN A 98 15.705 8.782 0.277 1.00 25.93 O ATOM 1487 CB ASN A 98 17.621 11.149 -0.154 1.00 26.51 C ATOM 1488 CG ASN A 98 18.826 12.014 0.211 1.00 26.95 C ATOM 1489 OD1 ASN A 98 18.845 13.223 -0.049 1.00 28.99 O ATOM 1490 ND2 ASN A 98 19.856 11.389 0.752 1.00 27.58 N ATOM 1491 HA ASN A 98 16.395 11.692 1.536 1.00 0.00 H ATOM 1492 HB2 ASN A 98 17.983 10.229 -0.613 1.00 0.00 H ATOM 1493 HB3 ASN A 98 17.009 11.695 -0.872 1.00 0.00 H ATOM 1494 HD22 ASN A 98 19.798 10.371 0.955 1.00 0.00 H ATOM 1495 HD21 ASN A 98 20.725 11.915 0.975 1.00 0.00 H ATOM 1496 H ASN A 98 17.619 9.000 1.931 1.00 0.00 H ATOM 1497 N PHE A 99 14.401 10.604 0.450 1.00 26.60 N ATOM 1498 CA PHE A 99 13.233 9.987 -0.186 1.00 26.95 C ATOM 1499 C PHE A 99 12.245 11.066 -0.646 1.00 27.04 C ATOM 1500 O PHE A 99 12.538 12.264 -0.589 1.00 27.07 O ATOM 1501 CB PHE A 99 12.544 8.994 0.764 1.00 27.21 C ATOM 1502 CG PHE A 99 12.009 9.617 2.023 1.00 28.14 C ATOM 1503 CD1 PHE A 99 12.809 9.737 3.148 1.00 30.37 C ATOM 1504 CD2 PHE A 99 10.700 10.065 2.090 1.00 29.95 C ATOM 1505 CE1 PHE A 99 12.321 10.305 4.313 1.00 30.99 C ATOM 1506 CE2 PHE A 99 10.204 10.636 3.250 1.00 30.71 C ATOM 1507 CZ PHE A 99 11.021 10.757 4.364 1.00 32.02 C ATOM 1508 HA PHE A 99 13.576 9.432 -1.059 1.00 0.00 H ATOM 1509 OXT PHE A 99 11.135 10.772 -1.083 1.00 26.32 O ATOM 1510 HB2 PHE A 99 11.713 8.531 0.231 1.00 0.00 H ATOM 1511 HB3 PHE A 99 13.268 8.228 1.042 1.00 0.00 H ATOM 1512 HD2 PHE A 99 10.052 9.967 1.219 1.00 0.00 H ATOM 1513 HE2 PHE A 99 9.174 10.990 3.287 1.00 0.00 H ATOM 1514 HZ PHE A 99 10.635 11.209 5.278 1.00 0.00 H ATOM 1515 HE1 PHE A 99 12.965 10.394 5.188 1.00 0.00 H ATOM 1516 HD1 PHE A 99 13.838 9.379 3.116 1.00 0.00 H ATOM 1517 H PHE A 99 14.319 11.569 0.829 1.00 0.00 H TER 1518 PHE A 99 ATOM 1519 N PRO B 1 12.311 14.536 0.865 1.00 31.83 N ATOM 1520 CA PRO B 1 13.157 15.246 1.817 1.00 31.38 C ATOM 1521 C PRO B 1 14.561 14.671 1.885 1.00 30.90 C ATOM 1522 O PRO B 1 14.746 13.480 1.622 1.00 29.85 O ATOM 1523 CB PRO B 1 12.443 15.021 3.163 1.00 31.22 C ATOM 1524 CG PRO B 1 11.147 14.278 2.841 1.00 31.87 C ATOM 1525 CD PRO B 1 10.937 14.417 1.371 1.00 32.19 C ATOM 1526 HA PRO B 1 13.281 16.293 1.542 1.00 0.00 H ATOM 1527 HD3 PRO B 1 10.439 13.539 0.959 1.00 0.00 H ATOM 1528 HD2 PRO B 1 10.352 15.307 1.138 1.00 0.00 H ATOM 1529 HG3 PRO B 1 10.313 14.721 3.385 1.00 0.00 H ATOM 1530 HG2 PRO B 1 11.238 13.226 3.112 1.00 0.00 H ATOM 1531 HB2 PRO B 1 13.067 14.422 3.826 1.00 0.00 H ATOM 1532 HB3 PRO B 1 12.223 15.977 3.638 1.00 0.00 H ATOM 1533 N GLN B 2 15.528 15.526 2.220 1.00 30.32 N ATOM 1534 CA GLN B 2 16.836 15.086 2.688 1.00 30.28 C ATOM 1535 C GLN B 2 16.841 15.126 4.211 1.00 30.22 C ATOM 1536 O GLN B 2 16.447 16.130 4.821 1.00 30.39 O ATOM 1537 CB GLN B 2 17.957 15.981 2.154 1.00 30.56 C ATOM 1538 CG GLN B 2 19.363 15.479 2.524 1.00 31.05 C ATOM 1539 CD GLN B 2 20.460 16.081 1.659 1.00 32.44 C ATOM 1540 OE1 GLN B 2 21.056 17.099 2.016 1.00 33.87 O ATOM 1541 NE2 GLN B 2 20.749 15.439 0.526 1.00 32.86 N ATOM 1542 HA GLN B 2 17.015 14.075 2.323 1.00 0.00 H ATOM 1543 HB2 GLN B 2 17.879 16.023 1.068 1.00 0.00 H ATOM 1544 HB3 GLN B 2 17.827 16.982 2.566 1.00 0.00 H ATOM 1545 HG2 GLN B 2 19.561 15.737 3.564 1.00 0.00 H ATOM 1546 HG3 GLN B 2 19.386 14.395 2.409 1.00 0.00 H ATOM 1547 HE22 GLN B 2 20.220 14.583 0.264 1.00 0.00 H ATOM 1548 HE21 GLN B 2 21.503 15.795 -0.095 1.00 0.00 H ATOM 1549 H GLN B 2 15.341 16.546 2.144 1.00 0.00 H ATOM 1550 N ILE B 3 17.282 14.034 4.824 1.00 29.65 N ATOM 1551 CA ILE B 3 17.446 13.997 6.272 1.00 29.05 C ATOM 1552 C ILE B 3 18.927 13.821 6.597 1.00 28.34 C ATOM 1553 O ILE B 3 19.549 12.838 6.203 1.00 28.25 O ATOM 1554 CB ILE B 3 16.520 12.928 6.918 1.00 29.11 C ATOM 1555 CG1 ILE B 3 15.064 13.304 6.629 1.00 29.61 C ATOM 1556 CG2 ILE B 3 16.774 12.834 8.410 1.00 29.67 C ATOM 1557 CD1 ILE B 3 13.994 12.395 7.238 1.00 30.59 C ATOM 1558 HA ILE B 3 17.128 14.941 6.715 1.00 0.00 H ATOM 1559 HB ILE B 3 16.731 11.948 6.491 1.00 0.00 H ATOM 1560 HG12 ILE B 3 14.899 14.312 7.010 1.00 0.00 H ATOM 1561 HG13 ILE B 3 14.928 13.299 5.548 1.00 0.00 H ATOM 1562 HD11 ILE B 3 14.123 11.381 6.860 1.00 0.00 H ATOM 1563 HD12 ILE B 3 14.094 12.395 8.323 1.00 0.00 H ATOM 1564 HD13 ILE B 3 13.006 12.764 6.963 1.00 0.00 H ATOM 1565 HG21 ILE B 3 17.813 12.554 8.583 1.00 0.00 H ATOM 1566 HG22 ILE B 3 16.575 13.801 8.873 1.00 0.00 H ATOM 1567 HG23 ILE B 3 16.116 12.080 8.843 1.00 0.00 H ATOM 1568 H ILE B 3 17.514 13.191 4.262 1.00 0.00 H ATOM 1569 N THR B 4 19.499 14.821 7.266 1.00 27.64 N ATOM 1570 CA THR B 4 20.885 14.752 7.725 1.00 27.18 C ATOM 1571 C THR B 4 20.960 13.914 8.995 1.00 26.73 C ATOM 1572 O THR B 4 19.933 13.593 9.594 1.00 25.92 O ATOM 1573 CB THR B 4 21.492 16.158 7.954 1.00 26.78 C ATOM 1574 OG1 THR B 4 20.699 16.900 8.893 1.00 26.70 O ATOM 1575 CG2 THR B 4 21.581 16.923 6.634 1.00 27.58 C ATOM 1576 HA THR B 4 21.479 14.278 6.943 1.00 0.00 H ATOM 1577 HB THR B 4 22.496 16.034 8.359 1.00 0.00 H ATOM 1578 HG1 THR B 4 21.100 17.795 9.028 1.00 0.00 H ATOM 1579 HG23 THR B 4 22.184 16.355 5.926 1.00 0.00 H ATOM 1580 HG21 THR B 4 20.579 17.064 6.229 1.00 0.00 H ATOM 1581 HG22 THR B 4 22.043 17.894 6.809 1.00 0.00 H ATOM 1582 H THR B 4 18.943 15.676 7.468 1.00 0.00 H ATOM 1583 N LEU B 5 22.182 13.579 9.406 1.00 26.33 N ATOM 1584 CA LEU B 5 22.405 12.628 10.494 1.00 25.69 C ATOM 1585 C LEU B 5 23.175 13.224 11.681 1.00 25.52 C ATOM 1586 O LEU B 5 23.739 12.493 12.482 1.00 24.71 O ATOM 1587 CB LEU B 5 23.097 11.372 9.957 1.00 25.45 C ATOM 1588 CG LEU B 5 22.293 10.592 8.892 1.00 25.88 C ATOM 1589 CD1 LEU B 5 23.170 9.557 8.201 1.00 26.09 C ATOM 1590 CD2 LEU B 5 21.035 9.931 9.494 1.00 25.80 C ATOM 1591 HA LEU B 5 21.424 12.361 10.888 1.00 0.00 H ATOM 1592 HB2 LEU B 5 24.046 11.672 9.513 1.00 0.00 H ATOM 1593 HB3 LEU B 5 23.285 10.703 10.797 1.00 0.00 H ATOM 1594 HG LEU B 5 21.958 11.312 8.146 1.00 0.00 H ATOM 1595 HD21 LEU B 5 21.332 9.234 10.278 1.00 0.00 H ATOM 1596 HD22 LEU B 5 20.389 10.700 9.916 1.00 0.00 H ATOM 1597 HD23 LEU B 5 20.499 9.393 8.712 1.00 0.00 H ATOM 1598 HD11 LEU B 5 24.006 10.058 7.713 1.00 0.00 H ATOM 1599 HD12 LEU B 5 23.550 8.852 8.941 1.00 0.00 H ATOM 1600 HD13 LEU B 5 22.581 9.022 7.456 1.00 0.00 H ATOM 1601 H LEU B 5 23.005 14.008 8.937 1.00 0.00 H ATOM 1602 N TRP B 6 23.145 14.552 11.807 1.00 26.04 N ATOM 1603 CA TRP B 6 23.741 15.266 12.951 1.00 25.77 C ATOM 1604 C TRP B 6 23.019 14.953 14.255 1.00 26.00 C ATOM 1605 O TRP B 6 23.618 14.953 15.347 1.00 26.25 O ATOM 1606 CB TRP B 6 23.700 16.771 12.706 1.00 26.44 C ATOM 1607 CG TRP B 6 24.358 17.167 11.429 1.00 26.18 C ATOM 1608 CD1 TRP B 6 23.754 17.634 10.305 1.00 27.78 C ATOM 1609 CD2 TRP B 6 25.756 17.083 11.134 1.00 26.18 C ATOM 1610 NE1 TRP B 6 24.694 17.860 9.319 1.00 28.12 N ATOM 1611 CE2 TRP B 6 25.934 17.545 9.815 1.00 28.11 C ATOM 1612 CE3 TRP B 6 26.878 16.681 11.869 1.00 26.43 C ATOM 1613 CZ2 TRP B 6 27.195 17.607 9.207 1.00 27.50 C ATOM 1614 CZ3 TRP B 6 28.128 16.739 11.266 1.00 25.73 C ATOM 1615 CH2 TRP B 6 28.274 17.193 9.946 1.00 26.13 C ATOM 1616 HA TRP B 6 24.773 14.928 13.043 1.00 0.00 H ATOM 1617 HB2 TRP B 6 22.658 17.091 12.675 1.00 0.00 H ATOM 1618 HB3 TRP B 6 24.208 17.272 13.530 1.00 0.00 H ATOM 1619 HE1 TRP B 6 24.495 18.211 8.360 1.00 0.00 H ATOM 1620 HD1 TRP B 6 22.683 17.805 10.197 1.00 0.00 H ATOM 1621 HZ2 TRP B 6 27.314 17.970 8.186 1.00 0.00 H ATOM 1622 HH2 TRP B 6 29.267 17.217 9.498 1.00 0.00 H ATOM 1623 HZ3 TRP B 6 29.009 16.427 11.827 1.00 0.00 H ATOM 1624 HE3 TRP B 6 26.772 16.329 12.895 1.00 0.00 H ATOM 1625 H TRP B 6 22.679 15.110 11.063 1.00 0.00 H ATOM 1626 N LYS B 7 21.723 14.693 14.136 1.00 25.97 N ATOM 1627 CA LYS B 7 20.934 14.139 15.229 1.00 25.85 C ATOM 1628 C LYS B 7 20.184 12.896 14.766 1.00 24.83 C ATOM 1629 O LYS B 7 20.161 12.587 13.580 1.00 24.23 O ATOM 1630 CB LYS B 7 19.972 15.195 15.793 1.00 26.47 C ATOM 1631 CG LYS B 7 18.867 15.654 14.866 1.00 28.05 C ATOM 1632 CD LYS B 7 18.203 16.896 15.446 1.00 29.34 C ATOM 1633 CE LYS B 7 16.979 17.314 14.662 1.00 30.55 C ATOM 1634 NZ LYS B 7 15.786 16.479 15.003 1.00 33.47 N ATOM 1635 HA LYS B 7 21.609 13.844 16.032 1.00 0.00 H ATOM 1636 HB2 LYS B 7 19.506 14.778 16.686 1.00 0.00 H ATOM 1637 HB3 LYS B 7 20.561 16.070 16.067 1.00 0.00 H ATOM 1638 HG2 LYS B 7 19.287 15.889 13.888 1.00 0.00 H ATOM 1639 HG3 LYS B 7 18.127 14.861 14.761 1.00 0.00 H ATOM 1640 HD2 LYS B 7 17.906 16.687 16.474 1.00 0.00 H ATOM 1641 HD3 LYS B 7 18.922 17.715 15.436 1.00 0.00 H ATOM 1642 HE2 LYS B 7 17.190 17.210 13.598 1.00 0.00 H ATOM 1643 HE3 LYS B 7 16.755 18.357 14.887 1.00 0.00 H ATOM 1644 HZ1 LYS B 7 15.988 15.482 14.785 1.00 0.00 H ATOM 1645 HZ2 LYS B 7 15.574 16.577 16.016 1.00 0.00 H ATOM 1646 HZ3 LYS B 7 14.969 16.799 14.444 1.00 0.00 H ATOM 1647 H LYS B 7 21.253 14.892 13.230 1.00 0.00 H ATOM 1648 N ARG B 8 19.601 12.176 15.718 1.00 24.37 N ATOM 1649 CA ARG B 8 18.800 10.987 15.417 1.00 24.64 C ATOM 1650 C ARG B 8 17.734 11.328 14.370 1.00 24.88 C ATOM 1651 O ARG B 8 17.072 12.370 14.483 1.00 24.65 O ATOM 1652 CB ARG B 8 18.158 10.453 16.697 1.00 24.30 C ATOM 1653 CG ARG B 8 19.170 9.841 17.658 1.00 24.47 C ATOM 1654 CD ARG B 8 18.564 9.512 19.011 1.00 26.11 C ATOM 1655 NE ARG B 8 19.508 8.747 19.813 1.00 29.02 N ATOM 1656 CZ ARG B 8 19.257 8.234 21.016 1.00 29.73 C ATOM 1657 NH1 ARG B 8 18.073 8.403 21.594 1.00 28.79 N ATOM 1658 NH2 ARG B 8 20.205 7.557 21.647 1.00 29.39 N ATOM 1659 HA ARG B 8 19.446 10.210 15.008 1.00 0.00 H ATOM 1660 HB2 ARG B 8 17.652 11.276 17.202 1.00 0.00 H ATOM 1661 HB3 ARG B 8 17.428 9.690 16.428 1.00 0.00 H ATOM 1662 HG2 ARG B 8 19.560 8.924 17.217 1.00 0.00 H ATOM 1663 HG3 ARG B 8 19.986 10.549 17.803 1.00 0.00 H ATOM 1664 HD2 ARG B 8 17.656 8.926 18.866 1.00 0.00 H ATOM 1665 HD3 ARG B 8 18.318 10.438 19.530 1.00 0.00 H ATOM 1666 HE ARG B 8 20.455 8.588 19.414 1.00 0.00 H ATOM 1667 HH12 ARG B 8 17.890 7.997 22.534 1.00 0.00 H ATOM 1668 HH11 ARG B 8 17.329 8.941 21.107 1.00 0.00 H ATOM 1669 HH22 ARG B 8 20.018 7.153 22.587 1.00 0.00 H ATOM 1670 HH21 ARG B 8 21.137 7.430 21.203 1.00 0.00 H ATOM 1671 H ARG B 8 19.717 12.466 16.710 1.00 0.00 H ATOM 1672 N PRO B 9 17.621 10.504 13.306 1.00 24.77 N ATOM 1673 CA PRO B 9 16.625 10.754 12.267 1.00 25.30 C ATOM 1674 C PRO B 9 15.218 10.335 12.716 1.00 26.15 C ATOM 1675 O PRO B 9 14.697 9.294 12.317 1.00 24.84 O ATOM 1676 CB PRO B 9 17.140 9.925 11.091 1.00 24.98 C ATOM 1677 CG PRO B 9 17.859 8.784 11.735 1.00 25.54 C ATOM 1678 CD PRO B 9 18.456 9.331 12.992 1.00 25.51 C ATOM 1679 HA PRO B 9 16.516 11.809 12.017 1.00 0.00 H ATOM 1680 HD3 PRO B 9 18.408 8.596 13.795 1.00 0.00 H ATOM 1681 HD2 PRO B 9 19.493 9.626 12.832 1.00 0.00 H ATOM 1682 HG3 PRO B 9 18.642 8.408 11.076 1.00 0.00 H ATOM 1683 HG2 PRO B 9 17.162 7.978 11.966 1.00 0.00 H ATOM 1684 HB2 PRO B 9 16.313 9.565 10.479 1.00 0.00 H ATOM 1685 HB3 PRO B 9 17.820 10.511 10.472 1.00 0.00 H ATOM 1686 N ILE B 10 14.637 11.150 13.586 1.00 27.43 N ATOM 1687 CA ILE B 10 13.334 10.861 14.151 1.00 28.44 C ATOM 1688 C ILE B 10 12.267 11.624 13.394 1.00 29.00 C ATOM 1689 O ILE B 10 12.434 12.805 13.097 1.00 28.93 O ATOM 1690 CB ILE B 10 13.295 11.200 15.640 1.00 29.13 C ATOM 1691 CG1 ILE B 10 14.146 10.184 16.404 1.00 29.48 C ATOM 1692 CG2 ILE B 10 11.856 11.172 16.169 1.00 28.55 C ATOM 1693 CD1 ILE B 10 14.502 10.611 17.792 1.00 30.79 C ATOM 1694 HA ILE B 10 13.139 9.793 14.053 1.00 0.00 H ATOM 1695 HB ILE B 10 13.691 12.205 15.785 1.00 0.00 H ATOM 1696 HG12 ILE B 10 13.591 9.248 16.465 1.00 0.00 H ATOM 1697 HG13 ILE B 10 15.069 10.022 15.847 1.00 0.00 H ATOM 1698 HD11 ILE B 10 15.069 11.541 17.750 1.00 0.00 H ATOM 1699 HD12 ILE B 10 13.590 10.766 18.368 1.00 0.00 H ATOM 1700 HD13 ILE B 10 15.105 9.836 18.266 1.00 0.00 H ATOM 1701 HG21 ILE B 10 11.256 11.903 15.626 1.00 0.00 H ATOM 1702 HG22 ILE B 10 11.436 10.177 16.024 1.00 0.00 H ATOM 1703 HG23 ILE B 10 11.856 11.417 17.231 1.00 0.00 H ATOM 1704 H ILE B 10 15.130 12.020 13.871 1.00 0.00 H ATOM 1705 N VAL B 11 11.191 10.920 13.060 1.00 29.92 N ATOM 1706 CA VAL B 11 10.071 11.480 12.313 1.00 30.35 C ATOM 1707 C VAL B 11 8.752 11.043 12.959 1.00 31.04 C ATOM 1708 O VAL B 11 8.702 10.077 13.720 1.00 30.90 O ATOM 1709 CB VAL B 11 10.076 11.017 10.829 1.00 30.48 C ATOM 1710 CG1 VAL B 11 11.391 11.378 10.148 1.00 31.16 C ATOM 1711 CG2 VAL B 11 9.799 9.510 10.703 1.00 30.07 C ATOM 1712 HA VAL B 11 10.171 12.565 12.336 1.00 0.00 H ATOM 1713 HB VAL B 11 9.269 11.546 10.323 1.00 0.00 H ATOM 1714 HG11 VAL B 11 11.529 12.459 10.178 1.00 0.00 H ATOM 1715 HG12 VAL B 11 12.215 10.890 10.670 1.00 0.00 H ATOM 1716 HG13 VAL B 11 11.366 11.042 9.111 1.00 0.00 H ATOM 1717 HG21 VAL B 11 10.568 8.954 11.239 1.00 0.00 H ATOM 1718 HG22 VAL B 11 8.822 9.285 11.130 1.00 0.00 H ATOM 1719 HG23 VAL B 11 9.811 9.226 9.651 1.00 0.00 H ATOM 1720 H VAL B 11 11.145 9.921 13.345 1.00 0.00 H ATOM 1721 N THR B 12 7.682 11.755 12.637 1.00 31.66 N ATOM 1722 CA THR B 12 6.361 11.409 13.141 1.00 31.97 C ATOM 1723 C THR B 12 5.747 10.298 12.297 1.00 31.41 C ATOM 1724 O THR B 12 5.774 10.332 11.062 1.00 31.78 O ATOM 1725 CB THR B 12 5.437 12.640 13.181 1.00 32.49 C ATOM 1726 OG1 THR B 12 5.776 13.432 14.323 1.00 33.59 O ATOM 1727 CG2 THR B 12 3.966 12.233 13.275 1.00 33.04 C ATOM 1728 HA THR B 12 6.473 11.048 14.163 1.00 0.00 H ATOM 1729 HB THR B 12 5.575 13.206 12.260 1.00 0.00 H ATOM 1730 HG1 THR B 12 5.187 14.227 14.358 1.00 0.00 H ATOM 1731 HG23 THR B 12 3.701 11.629 12.407 1.00 0.00 H ATOM 1732 HG21 THR B 12 3.808 11.653 14.185 1.00 0.00 H ATOM 1733 HG22 THR B 12 3.344 13.128 13.300 1.00 0.00 H ATOM 1734 H THR B 12 7.788 12.579 12.011 1.00 0.00 H ATOM 1735 N ILE B 13 5.244 9.278 12.979 1.00 31.38 N ATOM 1736 CA ILE B 13 4.514 8.216 12.305 1.00 31.21 C ATOM 1737 C ILE B 13 3.086 8.219 12.816 1.00 31.50 C ATOM 1738 O ILE B 13 2.830 8.580 13.962 1.00 30.88 O ATOM 1739 CB ILE B 13 5.155 6.818 12.498 1.00 30.71 C ATOM 1740 CG1 ILE B 13 5.196 6.414 13.974 1.00 30.90 C ATOM 1741 CG2 ILE B 13 6.549 6.791 11.869 1.00 31.54 C ATOM 1742 CD1 ILE B 13 5.321 4.925 14.203 1.00 30.31 C ATOM 1743 HA ILE B 13 4.544 8.413 11.233 1.00 0.00 H ATOM 1744 HB ILE B 13 4.532 6.082 11.990 1.00 0.00 H ATOM 1745 HG12 ILE B 13 6.050 6.905 14.440 1.00 0.00 H ATOM 1746 HG13 ILE B 13 4.277 6.758 14.449 1.00 0.00 H ATOM 1747 HD11 ILE B 13 4.468 4.417 13.754 1.00 0.00 H ATOM 1748 HD12 ILE B 13 6.242 4.564 13.745 1.00 0.00 H ATOM 1749 HD13 ILE B 13 5.343 4.724 15.274 1.00 0.00 H ATOM 1750 HG21 ILE B 13 6.470 7.006 10.803 1.00 0.00 H ATOM 1751 HG22 ILE B 13 7.177 7.543 12.347 1.00 0.00 H ATOM 1752 HG23 ILE B 13 6.991 5.805 12.010 1.00 0.00 H ATOM 1753 H ILE B 13 5.373 9.237 14.010 1.00 0.00 H ATOM 1754 N ARG B 14 2.169 7.839 11.939 1.00 31.86 N ATOM 1755 CA ARG B 14 0.793 7.590 12.318 1.00 32.76 C ATOM 1756 C ARG B 14 0.451 6.126 12.066 1.00 32.95 C ATOM 1757 O ARG B 14 0.728 5.577 10.998 1.00 31.86 O ATOM 1758 CB ARG B 14 -0.166 8.487 11.527 1.00 33.18 C ATOM 1759 CG ARG B 14 -1.628 8.153 11.814 1.00 34.54 C ATOM 1760 CD ARG B 14 -2.623 9.122 11.194 1.00 35.88 C ATOM 1761 NE ARG B 14 -3.020 8.753 9.840 1.00 36.84 N ATOM 1762 CZ ARG B 14 -3.752 7.692 9.529 1.00 36.35 C ATOM 1763 NH1 ARG B 14 -4.163 6.869 10.486 1.00 36.25 N ATOM 1764 NH2 ARG B 14 -4.056 7.459 8.257 1.00 36.30 N ATOM 1765 HA ARG B 14 0.681 7.819 13.378 1.00 0.00 H ATOM 1766 HB2 ARG B 14 0.018 9.526 11.799 1.00 0.00 H ATOM 1767 HB3 ARG B 14 0.024 8.353 10.462 1.00 0.00 H ATOM 1768 HG2 ARG B 14 -1.834 7.156 11.425 1.00 0.00 H ATOM 1769 HG3 ARG B 14 -1.774 8.157 12.894 1.00 0.00 H ATOM 1770 HD2 ARG B 14 -2.169 10.113 11.164 1.00 0.00 H ATOM 1771 HD3 ARG B 14 -3.514 9.151 11.821 1.00 0.00 H ATOM 1772 HE ARG B 14 -2.706 9.367 9.061 1.00 0.00 H ATOM 1773 HH12 ARG B 14 -4.737 6.036 10.244 1.00 0.00 H ATOM 1774 HH11 ARG B 14 -3.911 7.057 11.477 1.00 0.00 H ATOM 1775 HH22 ARG B 14 -4.630 6.630 8.003 1.00 0.00 H ATOM 1776 HH21 ARG B 14 -3.720 8.106 7.515 1.00 0.00 H ATOM 1777 H ARG B 14 2.446 7.715 10.944 1.00 0.00 H ATOM 1778 N ILE B 15 -0.147 5.490 13.062 1.00 34.00 N ATOM 1779 CA ILE B 15 -0.749 4.188 12.850 1.00 34.94 C ATOM 1780 C ILE B 15 -2.106 4.152 13.544 1.00 35.36 C ATOM 1781 O ILE B 15 -2.207 4.336 14.757 1.00 35.07 O ATOM 1782 CB ILE B 15 0.208 3.018 13.236 1.00 35.37 C ATOM 1783 CG1 ILE B 15 -0.555 1.830 13.812 1.00 36.26 C ATOM 1784 CG2 ILE B 15 1.341 3.495 14.150 1.00 35.95 C ATOM 1785 HA ILE B 15 -0.923 4.032 11.785 1.00 0.00 H ATOM 1786 HB ILE B 15 0.680 2.662 12.320 1.00 0.00 H ATOM 1787 HG12 ILE B 15 -1.092 2.144 14.707 1.00 0.00 H ATOM 1788 HG13 ILE B 15 -1.265 1.462 13.071 1.00 0.00 H ATOM 1789 HG21 ILE B 15 1.922 4.261 13.637 1.00 0.00 H ATOM 1790 HG22 ILE B 15 0.918 3.910 15.065 1.00 0.00 H ATOM 1791 HG23 ILE B 15 1.986 2.652 14.397 1.00 0.00 H ATOM 1792 H ILE B 15 -0.185 5.928 14.004 1.00 0.00 H ATOM 1793 N GLY B 16 -3.149 4.015 12.728 1.00 36.06 N ATOM 1794 CA GLY B 16 -4.510 3.749 13.193 1.00 36.94 C ATOM 1795 C GLY B 16 -5.011 4.691 14.269 1.00 37.55 C ATOM 1796 O GLY B 16 -5.582 4.250 15.273 1.00 38.70 O ATOM 1797 HA3 GLY B 16 -4.541 2.734 13.590 1.00 0.00 H ATOM 1798 HA2 GLY B 16 -5.181 3.824 12.338 1.00 0.00 H ATOM 1799 H GLY B 16 -2.987 4.102 11.704 1.00 0.00 H ATOM 1800 N GLY B 17 -4.781 5.984 14.078 1.00 37.58 N ATOM 1801 CA GLY B 17 -5.194 6.977 15.068 1.00 38.10 C ATOM 1802 C GLY B 17 -4.172 7.268 16.156 1.00 38.37 C ATOM 1803 O GLY B 17 -4.391 8.147 16.980 1.00 38.42 O ATOM 1804 HA3 GLY B 17 -6.105 6.618 15.547 1.00 0.00 H ATOM 1805 HA2 GLY B 17 -5.404 7.909 14.544 1.00 0.00 H ATOM 1806 H GLY B 17 -4.299 6.296 13.210 1.00 0.00 H ATOM 1807 N GLN B 18 -3.067 6.524 16.180 1.00 39.07 N ATOM 1808 CA GLN B 18 -1.950 6.821 17.085 1.00 39.58 C ATOM 1809 C GLN B 18 -0.858 7.622 16.362 1.00 39.51 C ATOM 1810 O GLN B 18 -0.527 7.350 15.211 1.00 39.23 O ATOM 1811 CB GLN B 18 -1.336 5.540 17.647 1.00 40.32 C ATOM 1812 CG GLN B 18 -2.100 4.919 18.799 1.00 41.84 C ATOM 1813 CD GLN B 18 -1.205 4.630 19.995 1.00 44.26 C ATOM 1814 OE1 GLN B 18 -1.078 5.462 20.898 1.00 45.94 O ATOM 1815 NE2 GLN B 18 -0.571 3.459 20.003 1.00 43.93 N ATOM 1816 HA GLN B 18 -2.352 7.414 17.907 1.00 0.00 H ATOM 1817 HB2 GLN B 18 -1.283 4.808 16.841 1.00 0.00 H ATOM 1818 HB3 GLN B 18 -0.329 5.771 17.993 1.00 0.00 H ATOM 1819 HG2 GLN B 18 -2.888 5.606 19.108 1.00 0.00 H ATOM 1820 HG3 GLN B 18 -2.546 3.984 18.461 1.00 0.00 H ATOM 1821 HE22 GLN B 18 -0.708 2.788 19.220 1.00 0.00 H ATOM 1822 HE21 GLN B 18 0.061 3.215 20.792 1.00 0.00 H ATOM 1823 H GLN B 18 -2.994 5.709 15.539 1.00 0.00 H ATOM 1824 N LEU B 19 -0.295 8.598 17.063 1.00 39.33 N ATOM 1825 CA LEU B 19 0.695 9.505 16.499 1.00 39.09 C ATOM 1826 C LEU B 19 1.962 9.417 17.342 1.00 38.80 C ATOM 1827 O LEU B 19 2.002 9.950 18.453 1.00 38.76 O ATOM 1828 CB LEU B 19 0.154 10.920 16.489 1.00 39.25 C ATOM 1829 HA LEU B 19 0.922 9.226 15.470 1.00 0.00 H ATOM 1830 HB2 LEU B 19 -0.753 10.957 15.885 1.00 0.00 H ATOM 1831 HB3 LEU B 19 -0.075 11.227 17.509 1.00 0.00 H ATOM 1832 H LEU B 19 -0.573 8.720 18.058 1.00 0.00 H ATOM 1833 N LYS B 20 2.968 8.704 16.825 1.00 38.12 N ATOM 1834 CA LYS B 20 4.212 8.422 17.550 1.00 37.50 C ATOM 1835 C LYS B 20 5.432 9.015 16.858 1.00 36.68 C ATOM 1836 O LYS B 20 5.336 9.590 15.775 1.00 36.41 O ATOM 1837 CB LYS B 20 4.437 6.915 17.677 1.00 37.79 C ATOM 1838 CG LYS B 20 3.339 6.164 18.390 1.00 39.29 C ATOM 1839 CD LYS B 20 3.815 4.786 18.805 1.00 39.46 C ATOM 1840 CE LYS B 20 2.753 4.063 19.613 1.00 40.15 C ATOM 1841 NZ LYS B 20 3.264 2.786 20.170 1.00 39.64 N ATOM 1842 HA LYS B 20 4.098 8.881 18.532 1.00 0.00 H ATOM 1843 HB2 LYS B 20 4.533 6.501 16.673 1.00 0.00 H ATOM 1844 HB3 LYS B 20 5.366 6.756 18.224 1.00 0.00 H ATOM 1845 HG2 LYS B 20 3.041 6.722 19.277 1.00 0.00 H ATOM 1846 HG3 LYS B 20 2.483 6.061 17.723 1.00 0.00 H ATOM 1847 HD2 LYS B 20 4.042 4.203 17.912 1.00 0.00 H ATOM 1848 HD3 LYS B 20 4.716 4.887 19.410 1.00 0.00 H ATOM 1849 HE2 LYS B 20 1.900 3.852 18.968 1.00 0.00 H ATOM 1850 HE3 LYS B 20 2.435 4.705 20.434 1.00 0.00 H ATOM 1851 HZ1 LYS B 20 3.564 2.165 19.392 1.00 0.00 H ATOM 1852 HZ2 LYS B 20 4.075 2.980 20.792 1.00 0.00 H ATOM 1853 HZ3 LYS B 20 2.510 2.321 20.715 1.00 0.00 H ATOM 1854 H LYS B 20 2.863 8.330 15.860 1.00 0.00 H ATOM 1855 N GLU B 21 6.578 8.863 17.510 1.00 35.70 N ATOM 1856 CA GLU B 21 7.861 9.225 16.932 1.00 35.32 C ATOM 1857 C GLU B 21 8.709 7.967 16.795 1.00 33.92 C ATOM 1858 O GLU B 21 8.616 7.068 17.623 1.00 34.19 O ATOM 1859 CB GLU B 21 8.569 10.268 17.791 1.00 35.37 C ATOM 1860 CG GLU B 21 7.851 11.619 17.772 1.00 38.02 C ATOM 1861 CD GLU B 21 8.795 12.789 17.573 1.00 40.17 C ATOM 1862 OE1 GLU B 21 8.590 13.571 16.614 1.00 42.08 O ATOM 1863 OE2 GLU B 21 9.749 12.918 18.373 1.00 43.38 O ATOM 1864 HA GLU B 21 7.705 9.667 15.948 1.00 0.00 H ATOM 1865 HB2 GLU B 21 8.610 9.907 18.819 1.00 0.00 H ATOM 1866 HB3 GLU B 21 9.583 10.404 17.414 1.00 0.00 H ATOM 1867 HG2 GLU B 21 7.125 11.616 16.959 1.00 0.00 H ATOM 1868 HG3 GLU B 21 7.331 11.750 18.721 1.00 0.00 H ATOM 1869 H GLU B 21 6.557 8.469 18.472 1.00 0.00 H ATOM 1870 N ALA B 22 9.526 7.920 15.746 1.00 32.05 N ATOM 1871 CA ALA B 22 10.288 6.725 15.395 1.00 30.26 C ATOM 1872 C ALA B 22 11.536 7.077 14.589 1.00 28.54 C ATOM 1873 O ALA B 22 11.549 8.058 13.855 1.00 28.48 O ATOM 1874 CB ALA B 22 9.417 5.760 14.605 1.00 30.30 C ATOM 1875 HA ALA B 22 10.606 6.249 16.322 1.00 0.00 H ATOM 1876 HB1 ALA B 22 8.557 5.471 15.209 1.00 0.00 H ATOM 1877 HB2 ALA B 22 9.074 6.246 13.692 1.00 0.00 H ATOM 1878 HB3 ALA B 22 9.998 4.874 14.350 1.00 0.00 H ATOM 1879 H ALA B 22 9.626 8.768 15.152 1.00 0.00 H ATOM 1880 N LEU B 23 12.578 6.265 14.759 1.00 27.10 N ATOM 1881 CA LEU B 23 13.841 6.387 14.016 1.00 26.21 C ATOM 1882 C LEU B 23 13.727 5.758 12.632 1.00 24.64 C ATOM 1883 O LEU B 23 13.281 4.625 12.510 1.00 24.03 O ATOM 1884 CB LEU B 23 14.966 5.626 14.729 1.00 26.30 C ATOM 1885 CG LEU B 23 15.850 6.253 15.798 1.00 27.86 C ATOM 1886 CD1 LEU B 23 16.717 5.165 16.419 1.00 27.69 C ATOM 1887 CD2 LEU B 23 16.719 7.321 15.211 1.00 28.32 C ATOM 1888 HA LEU B 23 14.056 7.453 13.949 1.00 0.00 H ATOM 1889 HB2 LEU B 23 14.493 4.764 15.199 1.00 0.00 H ATOM 1890 HB3 LEU B 23 15.641 5.285 13.944 1.00 0.00 H ATOM 1891 HG LEU B 23 15.219 6.711 16.560 1.00 0.00 H ATOM 1892 HD21 LEU B 23 17.355 6.887 14.439 1.00 0.00 H ATOM 1893 HD22 LEU B 23 16.092 8.098 14.773 1.00 0.00 H ATOM 1894 HD23 LEU B 23 17.341 7.753 15.995 1.00 0.00 H ATOM 1895 HD11 LEU B 23 16.078 4.404 16.867 1.00 0.00 H ATOM 1896 HD12 LEU B 23 17.337 4.711 15.646 1.00 0.00 H ATOM 1897 HD13 LEU B 23 17.354 5.604 17.187 1.00 0.00 H ATOM 1898 H LEU B 23 12.493 5.500 15.458 1.00 0.00 H ATOM 1899 N LEU B 24 14.148 6.494 11.612 1.00 23.88 N ATOM 1900 CA LEU B 24 14.409 5.934 10.286 1.00 23.60 C ATOM 1901 C LEU B 24 15.746 5.194 10.336 1.00 23.13 C ATOM 1902 O LEU B 24 16.813 5.813 10.397 1.00 23.31 O ATOM 1903 CB LEU B 24 14.463 7.036 9.228 1.00 23.64 C ATOM 1904 CG LEU B 24 13.219 7.917 9.063 1.00 23.33 C ATOM 1905 CD1 LEU B 24 13.488 8.976 8.022 1.00 24.18 C ATOM 1906 CD2 LEU B 24 12.003 7.110 8.679 1.00 24.04 C ATOM 1907 HA LEU B 24 13.604 5.252 10.014 1.00 0.00 H ATOM 1908 HB2 LEU B 24 15.297 7.691 9.480 1.00 0.00 H ATOM 1909 HB3 LEU B 24 14.655 6.558 8.267 1.00 0.00 H ATOM 1910 HG LEU B 24 13.008 8.385 10.024 1.00 0.00 H ATOM 1911 HD21 LEU B 24 12.190 6.602 7.733 1.00 0.00 H ATOM 1912 HD22 LEU B 24 11.798 6.372 9.455 1.00 0.00 H ATOM 1913 HD23 LEU B 24 11.146 7.775 8.573 1.00 0.00 H ATOM 1914 HD11 LEU B 24 14.330 9.591 8.340 1.00 0.00 H ATOM 1915 HD12 LEU B 24 13.724 8.498 7.072 1.00 0.00 H ATOM 1916 HD13 LEU B 24 12.603 9.602 7.905 1.00 0.00 H ATOM 1917 H LEU B 24 14.299 7.512 11.761 1.00 0.00 H ATOM 1918 N ASP B 25 15.689 3.868 10.334 1.00 22.76 N ATOM 1919 CA ASP B 25 16.869 3.065 10.686 1.00 22.30 C ATOM 1920 C ASP B 25 17.294 2.036 9.630 1.00 21.50 C ATOM 1921 O ASP B 25 16.728 0.950 9.527 1.00 21.31 O ATOM 1922 CB ASP B 25 16.643 2.387 12.036 1.00 22.51 C ATOM 1923 CG ASP B 25 17.905 1.759 12.590 1.00 22.88 C ATOM 1924 OD1 ASP B 25 18.941 1.774 11.898 1.00 24.29 O ATOM 1925 OD2 ASP B 25 17.869 1.269 13.731 1.00 22.86 O ATOM 1926 HA ASP B 25 17.701 3.767 10.740 1.00 0.00 H ATOM 1927 HB2 ASP B 25 16.283 3.132 12.745 1.00 0.00 H ATOM 1928 HB3 ASP B 25 15.890 1.609 11.915 1.00 0.00 H ATOM 1929 H ASP B 25 14.800 3.392 10.081 1.00 0.00 H ATOM 1930 N THR B 26 18.349 2.373 8.902 1.00 20.99 N ATOM 1931 CA THR B 26 18.894 1.527 7.837 1.00 20.72 C ATOM 1932 C THR B 26 19.570 0.253 8.359 1.00 21.06 C ATOM 1933 O THR B 26 19.794 -0.692 7.602 1.00 21.28 O ATOM 1934 CB THR B 26 19.918 2.328 6.996 1.00 20.17 C ATOM 1935 OG1 THR B 26 20.963 2.825 7.847 1.00 21.56 O ATOM 1936 CG2 THR B 26 19.232 3.494 6.297 1.00 18.56 C ATOM 1937 HA THR B 26 18.044 1.220 7.227 1.00 0.00 H ATOM 1938 HB THR B 26 20.346 1.666 6.243 1.00 0.00 H ATOM 1939 HG1 THR B 26 21.421 2.064 8.284 1.00 0.00 H ATOM 1940 HG23 THR B 26 18.440 3.114 5.652 1.00 0.00 H ATOM 1941 HG21 THR B 26 18.805 4.163 7.044 1.00 0.00 H ATOM 1942 HG22 THR B 26 19.962 4.036 5.697 1.00 0.00 H ATOM 1943 H THR B 26 18.813 3.283 9.096 1.00 0.00 H ATOM 1944 N GLY B 27 19.912 0.261 9.645 1.00 21.12 N ATOM 1945 CA GLY B 27 20.487 -0.885 10.335 1.00 21.53 C ATOM 1946 C GLY B 27 19.464 -1.906 10.811 1.00 22.02 C ATOM 1947 O GLY B 27 19.833 -2.983 11.247 1.00 22.16 O ATOM 1948 HA3 GLY B 27 21.036 -0.521 11.203 1.00 0.00 H ATOM 1949 HA2 GLY B 27 21.176 -1.384 9.654 1.00 0.00 H ATOM 1950 H GLY B 27 19.760 1.135 10.188 1.00 0.00 H ATOM 1951 N ALA B 28 18.179 -1.569 10.721 1.00 22.55 N ATOM 1952 CA ALA B 28 17.108 -2.459 11.140 1.00 22.95 C ATOM 1953 C ALA B 28 16.464 -3.137 9.929 1.00 23.69 C ATOM 1954 O ALA B 28 15.968 -2.459 9.022 1.00 23.53 O ATOM 1955 CB ALA B 28 16.072 -1.680 11.906 1.00 23.10 C ATOM 1956 HA ALA B 28 17.528 -3.232 11.783 1.00 0.00 H ATOM 1957 HB1 ALA B 28 16.534 -1.230 12.785 1.00 0.00 H ATOM 1958 HB2 ALA B 28 15.663 -0.897 11.268 1.00 0.00 H ATOM 1959 HB3 ALA B 28 15.272 -2.351 12.218 1.00 0.00 H ATOM 1960 H ALA B 28 17.932 -0.635 10.337 1.00 0.00 H ATOM 1961 N ASP B 29 16.452 -4.469 9.934 1.00 24.40 N ATOM 1962 CA ASP B 29 15.775 -5.246 8.885 1.00 25.16 C ATOM 1963 C ASP B 29 14.280 -4.952 8.877 1.00 25.94 C ATOM 1964 O ASP B 29 13.655 -4.832 7.820 1.00 26.11 O ATOM 1965 CB ASP B 29 15.928 -6.746 9.132 1.00 24.99 C ATOM 1966 CG ASP B 29 17.335 -7.242 8.919 1.00 25.62 C ATOM 1967 OD1 ASP B 29 18.211 -6.454 8.489 1.00 20.24 O ATOM 1968 OD2 ASP B 29 17.546 -8.448 9.175 1.00 24.60 O ATOM 1969 HA ASP B 29 16.233 -4.962 7.938 1.00 0.00 H ATOM 1970 HB2 ASP B 29 15.637 -6.960 10.161 1.00 0.00 H ATOM 1971 HB3 ASP B 29 15.265 -7.279 8.450 1.00 0.00 H ATOM 1972 H ASP B 29 16.936 -4.975 10.703 1.00 0.00 H ATOM 1973 N ASP B 30 13.717 -4.864 10.077 1.00 26.26 N ATOM 1974 CA ASP B 30 12.276 -4.800 10.237 1.00 26.49 C ATOM 1975 C ASP B 30 11.860 -3.692 11.191 1.00 25.58 C ATOM 1976 O ASP B 30 12.663 -3.129 11.933 1.00 26.02 O ATOM 1977 CB ASP B 30 11.732 -6.156 10.688 1.00 26.87 C ATOM 1978 CG ASP B 30 11.503 -7.130 9.520 1.00 29.03 C ATOM 1979 OD1 ASP B 30 10.470 -7.019 8.807 1.00 30.11 O ATOM 1980 OD2 ASP B 30 12.335 -8.050 9.348 1.00 29.97 O ATOM 1981 HA ASP B 30 11.842 -4.559 9.267 1.00 0.00 H ATOM 1982 HB2 ASP B 30 12.445 -6.604 11.380 1.00 0.00 H ATOM 1983 HB3 ASP B 30 10.783 -5.997 11.199 1.00 0.00 H ATOM 1984 H ASP B 30 14.323 -4.840 10.922 1.00 0.00 H ATOM 1985 N THR B 31 10.587 -3.355 11.115 1.00 25.30 N ATOM 1986 CA THR B 31 10.024 -2.238 11.848 1.00 25.28 C ATOM 1987 C THR B 31 9.540 -2.741 13.201 1.00 25.02 C ATOM 1988 O THR B 31 8.815 -3.744 13.279 1.00 24.08 O ATOM 1989 CB THR B 31 8.882 -1.591 11.039 1.00 24.84 C ATOM 1990 OG1 THR B 31 9.447 -0.942 9.898 1.00 25.61 O ATOM 1991 CG2 THR B 31 8.091 -0.574 11.882 1.00 24.57 C ATOM 1992 HA THR B 31 10.780 -1.469 12.008 1.00 0.00 H ATOM 1993 HB THR B 31 8.184 -2.370 10.732 1.00 0.00 H ATOM 1994 HG1 THR B 31 9.921 -1.609 9.341 1.00 0.00 H ATOM 1995 HG23 THR B 31 7.664 -1.077 12.749 1.00 0.00 H ATOM 1996 HG21 THR B 31 8.760 0.220 12.214 1.00 0.00 H ATOM 1997 HG22 THR B 31 7.291 -0.147 11.277 1.00 0.00 H ATOM 1998 H THR B 31 9.960 -3.915 10.503 1.00 0.00 H ATOM 1999 N VAL B 32 9.960 -2.041 14.251 1.00 24.95 N ATOM 2000 CA VAL B 32 9.690 -2.451 15.616 1.00 26.25 C ATOM 2001 C VAL B 32 9.109 -1.292 16.409 1.00 26.38 C ATOM 2002 O VAL B 32 9.755 -0.273 16.616 1.00 25.72 O ATOM 2003 CB VAL B 32 10.966 -2.964 16.324 1.00 26.03 C ATOM 2004 CG1 VAL B 32 10.600 -3.651 17.626 1.00 28.05 C ATOM 2005 CG2 VAL B 32 11.735 -3.931 15.417 1.00 27.64 C ATOM 2006 HA VAL B 32 8.970 -3.268 15.572 1.00 0.00 H ATOM 2007 HB VAL B 32 11.607 -2.110 16.541 1.00 0.00 H ATOM 2008 HG11 VAL B 32 10.089 -2.943 18.278 1.00 0.00 H ATOM 2009 HG12 VAL B 32 9.942 -4.495 17.418 1.00 0.00 H ATOM 2010 HG13 VAL B 32 11.507 -4.008 18.115 1.00 0.00 H ATOM 2011 HG21 VAL B 32 11.099 -4.782 15.174 1.00 0.00 H ATOM 2012 HG22 VAL B 32 12.022 -3.416 14.500 1.00 0.00 H ATOM 2013 HG23 VAL B 32 12.629 -4.280 15.935 1.00 0.00 H ATOM 2014 H VAL B 32 10.501 -1.168 14.088 1.00 0.00 H ATOM 2015 N LEU B 33 7.892 -1.470 16.889 1.00 28.06 N ATOM 2016 CA LEU B 33 7.221 -0.427 17.637 1.00 29.98 C ATOM 2017 C LEU B 33 7.006 -0.850 19.071 1.00 31.91 C ATOM 2018 O LEU B 33 6.831 -2.026 19.379 1.00 31.11 O ATOM 2019 CB LEU B 33 5.876 -0.058 17.007 1.00 30.02 C ATOM 2020 CG LEU B 33 5.894 0.576 15.614 1.00 31.41 C ATOM 2021 CD1 LEU B 33 4.481 0.917 15.195 1.00 32.55 C ATOM 2022 CD2 LEU B 33 6.774 1.820 15.547 1.00 32.36 C ATOM 2023 HA LEU B 33 7.866 0.451 17.612 1.00 0.00 H ATOM 2024 HB2 LEU B 33 5.285 -0.972 16.942 1.00 0.00 H ATOM 2025 HB3 LEU B 33 5.383 0.645 17.679 1.00 0.00 H ATOM 2026 HG LEU B 33 6.324 -0.154 14.928 1.00 0.00 H ATOM 2027 HD21 LEU B 33 6.401 2.565 16.250 1.00 0.00 H ATOM 2028 HD22 LEU B 33 7.798 1.553 15.807 1.00 0.00 H ATOM 2029 HD23 LEU B 33 6.749 2.227 14.536 1.00 0.00 H ATOM 2030 HD11 LEU B 33 3.881 0.008 15.173 1.00 0.00 H ATOM 2031 HD12 LEU B 33 4.051 1.620 15.909 1.00 0.00 H ATOM 2032 HD13 LEU B 33 4.496 1.368 14.203 1.00 0.00 H ATOM 2033 H LEU B 33 7.407 -2.375 16.727 1.00 0.00 H ATOM 2034 N GLU B 34 6.989 0.155 19.932 1.00 34.64 N ATOM 2035 CA GLU B 34 6.730 -0.022 21.342 1.00 36.96 C ATOM 2036 C GLU B 34 5.242 -0.179 21.583 1.00 38.43 C ATOM 2037 O GLU B 34 4.418 0.311 20.803 1.00 38.18 O ATOM 2038 CB GLU B 34 7.219 1.202 22.109 1.00 37.43 C ATOM 2039 CG GLU B 34 7.976 0.865 23.360 1.00 38.44 C ATOM 2040 CD GLU B 34 7.474 1.624 24.561 1.00 38.65 C ATOM 2041 OE1 GLU B 34 6.609 2.519 24.433 1.00 39.51 O ATOM 2042 OE2 GLU B 34 7.958 1.306 25.651 1.00 41.11 O ATOM 2043 HA GLU B 34 7.254 -0.915 21.683 1.00 0.00 H ATOM 2044 HB2 GLU B 34 7.873 1.780 21.456 1.00 0.00 H ATOM 2045 HB3 GLU B 34 6.354 1.806 22.382 1.00 0.00 H ATOM 2046 HG2 GLU B 34 7.874 -0.203 23.553 1.00 0.00 H ATOM 2047 HG3 GLU B 34 9.028 1.107 23.208 1.00 0.00 H ATOM 2048 H GLU B 34 7.170 1.116 19.577 1.00 0.00 H ATOM 2049 N GLU B 35 4.927 -0.804 22.713 1.00 40.40 N ATOM 2050 CA GLU B 35 3.563 -1.202 23.083 1.00 41.78 C ATOM 2051 C GLU B 35 2.446 -0.595 22.229 1.00 42.76 C ATOM 2052 O GLU B 35 2.196 0.612 22.264 1.00 43.41 O ATOM 2053 CB GLU B 35 3.298 -0.915 24.570 1.00 41.97 C ATOM 2054 CG GLU B 35 3.676 0.488 25.044 1.00 43.11 C ATOM 2055 CD GLU B 35 3.342 0.729 26.511 1.00 44.91 C ATOM 2056 OE1 GLU B 35 4.065 1.497 27.176 1.00 46.99 O ATOM 2057 OE2 GLU B 35 2.366 0.146 27.019 1.00 47.28 O ATOM 2058 HA GLU B 35 3.529 -2.273 22.885 1.00 0.00 H ATOM 2059 HB2 GLU B 35 2.233 -1.058 24.756 1.00 0.00 H ATOM 2060 HB3 GLU B 35 3.868 -1.634 25.158 1.00 0.00 H ATOM 2061 HG2 GLU B 35 4.748 0.625 24.904 1.00 0.00 H ATOM 2062 HG3 GLU B 35 3.136 1.217 24.440 1.00 0.00 H ATOM 2063 H GLU B 35 5.696 -1.025 23.378 1.00 0.00 H ATOM 2064 N MET B 36 1.798 -1.441 21.438 1.00 43.44 N ATOM 2065 CA MET B 36 0.471 -1.126 20.941 1.00 44.20 C ATOM 2066 C MET B 36 -0.277 -2.327 20.384 1.00 44.11 C ATOM 2067 O MET B 36 0.293 -3.205 19.735 1.00 44.04 O ATOM 2068 CB MET B 36 0.514 -0.017 19.903 1.00 44.60 C ATOM 2069 CG MET B 36 1.375 -0.298 18.703 1.00 45.47 C ATOM 2070 SD MET B 36 1.419 1.223 17.754 1.00 48.22 S ATOM 2071 CE MET B 36 -0.302 1.485 17.377 1.00 47.44 C ATOM 2072 HA MET B 36 -0.085 -0.784 21.814 1.00 0.00 H ATOM 2073 HB2 MET B 36 -0.504 0.159 19.555 1.00 0.00 H ATOM 2074 HB3 MET B 36 0.892 0.884 20.387 1.00 0.00 H ATOM 2075 HG2 MET B 36 0.944 -1.103 18.108 1.00 0.00 H ATOM 2076 HG3 MET B 36 2.381 -0.578 19.016 1.00 0.00 H ATOM 2077 HE1 MET B 36 -0.680 0.638 16.805 1.00 0.00 H ATOM 2078 HE2 MET B 36 -0.866 1.579 18.305 1.00 0.00 H ATOM 2079 HE3 MET B 36 -0.409 2.398 16.791 1.00 0.00 H ATOM 2080 H MET B 36 2.246 -2.341 21.171 1.00 0.00 H ATOM 2081 N ASN B 37 -1.577 -2.335 20.652 1.00 44.17 N ATOM 2082 CA ASN B 37 -2.441 -3.427 20.251 1.00 43.73 C ATOM 2083 C ASN B 37 -2.800 -3.218 18.789 1.00 43.52 C ATOM 2084 O ASN B 37 -3.418 -2.217 18.423 1.00 44.15 O ATOM 2085 CB ASN B 37 -3.698 -3.465 21.136 1.00 43.87 C ATOM 2086 CG ASN B 37 -4.172 -4.880 21.424 1.00 43.67 C ATOM 2087 OD1 ASN B 37 -3.888 -5.812 20.672 1.00 43.67 O ATOM 2088 ND2 ASN B 37 -4.902 -5.043 22.521 1.00 43.61 N ATOM 2089 HA ASN B 37 -1.935 -4.385 20.372 1.00 0.00 H ATOM 2090 HB2 ASN B 37 -3.473 -2.973 22.082 1.00 0.00 H ATOM 2091 HB3 ASN B 37 -4.498 -2.926 20.629 1.00 0.00 H ATOM 2092 HD22 ASN B 37 -5.118 -4.227 23.128 1.00 0.00 H ATOM 2093 HD21 ASN B 37 -5.258 -5.987 22.773 1.00 0.00 H ATOM 2094 H ASN B 37 -1.989 -1.531 21.167 1.00 0.00 H ATOM 2095 N LEU B 38 -2.360 -4.135 17.943 1.00 42.71 N ATOM 2096 CA LEU B 38 -2.708 -4.079 16.537 1.00 42.21 C ATOM 2097 C LEU B 38 -3.732 -5.162 16.285 1.00 42.05 C ATOM 2098 O LEU B 38 -3.829 -6.114 17.062 1.00 41.76 O ATOM 2099 CB LEU B 38 -1.467 -4.269 15.659 1.00 41.98 C ATOM 2100 CG LEU B 38 -0.383 -3.195 15.823 1.00 41.82 C ATOM 2101 CD1 LEU B 38 0.868 -3.531 15.008 1.00 41.19 C ATOM 2102 CD2 LEU B 38 -0.915 -1.825 15.427 1.00 42.11 C ATOM 2103 HA LEU B 38 -3.122 -3.103 16.282 1.00 0.00 H ATOM 2104 HB2 LEU B 38 -1.025 -5.235 15.903 1.00 0.00 H ATOM 2105 HB3 LEU B 38 -1.787 -4.270 14.617 1.00 0.00 H ATOM 2106 HG LEU B 38 -0.104 -3.172 16.876 1.00 0.00 H ATOM 2107 HD21 LEU B 38 -1.233 -1.848 14.385 1.00 0.00 H ATOM 2108 HD22 LEU B 38 -1.763 -1.569 16.062 1.00 0.00 H ATOM 2109 HD23 LEU B 38 -0.128 -1.081 15.552 1.00 0.00 H ATOM 2110 HD11 LEU B 38 1.274 -4.485 15.344 1.00 0.00 H ATOM 2111 HD12 LEU B 38 0.605 -3.598 13.952 1.00 0.00 H ATOM 2112 HD13 LEU B 38 1.613 -2.748 15.149 1.00 0.00 H ATOM 2113 H LEU B 38 -1.756 -4.907 18.292 1.00 0.00 H ATOM 2114 N PRO B 39 -4.528 -5.007 15.218 1.00 41.84 N ATOM 2115 CA PRO B 39 -5.512 -6.025 14.887 1.00 41.67 C ATOM 2116 C PRO B 39 -4.888 -7.232 14.200 1.00 41.56 C ATOM 2117 O PRO B 39 -3.763 -7.162 13.699 1.00 41.57 O ATOM 2118 CB PRO B 39 -6.448 -5.300 13.916 1.00 41.79 C ATOM 2119 CG PRO B 39 -5.585 -4.288 13.250 1.00 41.92 C ATOM 2120 CD PRO B 39 -4.557 -3.876 14.273 1.00 42.22 C ATOM 2121 HA PRO B 39 -6.004 -6.420 15.776 1.00 0.00 H ATOM 2122 HD3 PRO B 39 -3.582 -3.733 13.808 1.00 0.00 H ATOM 2123 HD2 PRO B 39 -4.856 -2.957 14.776 1.00 0.00 H ATOM 2124 HG3 PRO B 39 -6.179 -3.427 12.943 1.00 0.00 H ATOM 2125 HG2 PRO B 39 -5.097 -4.722 12.377 1.00 0.00 H ATOM 2126 HB2 PRO B 39 -6.860 -5.996 13.185 1.00 0.00 H ATOM 2127 HB3 PRO B 39 -7.263 -4.817 14.455 1.00 0.00 H ATOM 2128 N GLY B 40 -5.632 -8.328 14.171 1.00 41.09 N ATOM 2129 CA GLY B 40 -5.270 -9.475 13.365 1.00 41.03 C ATOM 2130 C GLY B 40 -4.393 -10.476 14.089 1.00 40.98 C ATOM 2131 O GLY B 40 -4.140 -10.365 15.293 1.00 40.85 O ATOM 2132 HA3 GLY B 40 -4.734 -9.122 12.484 1.00 0.00 H ATOM 2133 HA2 GLY B 40 -6.185 -9.980 13.054 1.00 0.00 H ATOM 2134 H GLY B 40 -6.500 -8.365 14.743 1.00 0.00 H ATOM 2135 N LYS B 41 -3.927 -11.449 13.319 1.00 41.15 N ATOM 2136 CA LYS B 41 -3.130 -12.554 13.835 1.00 41.14 C ATOM 2137 C LYS B 41 -1.710 -12.086 14.157 1.00 40.79 C ATOM 2138 O LYS B 41 -1.089 -11.385 13.354 1.00 40.72 O ATOM 2139 CB LYS B 41 -3.098 -13.689 12.816 1.00 41.03 C ATOM 2140 HA LYS B 41 -3.586 -12.918 14.756 1.00 0.00 H ATOM 2141 HB2 LYS B 41 -4.114 -14.035 12.627 1.00 0.00 H ATOM 2142 HB3 LYS B 41 -2.657 -13.329 11.887 1.00 0.00 H ATOM 2143 H LYS B 41 -4.140 -11.422 12.301 1.00 0.00 H ATOM 2144 N TRP B 42 -1.227 -12.462 15.344 1.00 40.31 N ATOM 2145 CA TRP B 42 0.185 -12.288 15.732 1.00 39.73 C ATOM 2146 C TRP B 42 0.960 -13.617 15.690 1.00 39.29 C ATOM 2147 O TRP B 42 0.370 -14.694 15.805 1.00 38.59 O ATOM 2148 CB TRP B 42 0.272 -11.685 17.123 1.00 40.05 C ATOM 2149 HA TRP B 42 0.643 -11.613 15.009 1.00 0.00 H ATOM 2150 HB2 TRP B 42 -0.224 -10.714 17.128 1.00 0.00 H ATOM 2151 HB3 TRP B 42 -0.217 -12.348 17.836 1.00 0.00 H ATOM 2152 H TRP B 42 -1.878 -12.898 16.028 1.00 0.00 H ATOM 2153 N LYS B 43 2.278 -13.532 15.519 1.00 38.44 N ATOM 2154 CA LYS B 43 3.169 -14.700 15.659 1.00 38.05 C ATOM 2155 C LYS B 43 4.415 -14.293 16.438 1.00 37.49 C ATOM 2156 O LYS B 43 5.098 -13.360 16.038 1.00 37.58 O ATOM 2157 CB LYS B 43 3.570 -15.262 14.297 1.00 37.94 C ATOM 2158 HA LYS B 43 2.631 -15.480 16.197 1.00 0.00 H ATOM 2159 HB2 LYS B 43 2.676 -15.571 13.756 1.00 0.00 H ATOM 2160 HB3 LYS B 43 4.093 -14.494 13.728 1.00 0.00 H ATOM 2161 H LYS B 43 2.694 -12.610 15.278 1.00 0.00 H ATOM 2162 N PRO B 44 4.691 -14.976 17.564 1.00 36.87 N ATOM 2163 CA PRO B 44 5.904 -14.798 18.364 1.00 36.05 C ATOM 2164 C PRO B 44 7.190 -14.901 17.555 1.00 35.07 C ATOM 2165 O PRO B 44 7.302 -15.715 16.633 1.00 34.62 O ATOM 2166 CB PRO B 44 5.845 -15.951 19.368 1.00 36.26 C ATOM 2167 CG PRO B 44 4.425 -16.314 19.466 1.00 36.64 C ATOM 2168 CD PRO B 44 3.781 -15.971 18.160 1.00 36.91 C ATOM 2169 HA PRO B 44 5.928 -13.803 18.809 1.00 0.00 H ATOM 2170 HD3 PRO B 44 3.700 -16.853 17.524 1.00 0.00 H ATOM 2171 HD2 PRO B 44 2.790 -15.545 18.316 1.00 0.00 H ATOM 2172 HG3 PRO B 44 3.952 -15.754 20.273 1.00 0.00 H ATOM 2173 HG2 PRO B 44 4.326 -17.382 19.661 1.00 0.00 H ATOM 2174 HB2 PRO B 44 6.431 -16.798 19.011 1.00 0.00 H ATOM 2175 HB3 PRO B 44 6.225 -15.631 20.338 1.00 0.00 H ATOM 2176 N LYS B 45 8.164 -14.087 17.937 1.00 34.24 N ATOM 2177 CA LYS B 45 9.418 -13.977 17.213 1.00 33.55 C ATOM 2178 C LYS B 45 10.505 -13.461 18.154 1.00 32.81 C ATOM 2179 O LYS B 45 10.226 -12.687 19.061 1.00 32.27 O ATOM 2180 CB LYS B 45 9.242 -13.011 16.045 1.00 33.57 C ATOM 2181 CG LYS B 45 10.265 -13.143 14.949 1.00 34.80 C ATOM 2182 CD LYS B 45 10.099 -12.027 13.931 1.00 35.26 C ATOM 2183 CE LYS B 45 11.207 -12.047 12.910 1.00 34.83 C ATOM 2184 NZ LYS B 45 10.988 -13.136 11.922 1.00 35.02 N ATOM 2185 HA LYS B 45 9.710 -14.955 16.831 1.00 0.00 H ATOM 2186 HB2 LYS B 45 8.257 -13.182 15.611 1.00 0.00 H ATOM 2187 HB3 LYS B 45 9.294 -11.995 16.436 1.00 0.00 H ATOM 2188 HG2 LYS B 45 11.264 -13.089 15.382 1.00 0.00 H ATOM 2189 HG3 LYS B 45 10.137 -14.105 14.452 1.00 0.00 H ATOM 2190 HD2 LYS B 45 9.144 -12.151 13.421 1.00 0.00 H ATOM 2191 HD3 LYS B 45 10.111 -11.068 14.450 1.00 0.00 H ATOM 2192 HE2 LYS B 45 12.159 -12.208 13.417 1.00 0.00 H ATOM 2193 HE3 LYS B 45 11.232 -11.090 12.389 1.00 0.00 H ATOM 2194 HZ1 LYS B 45 10.967 -14.051 12.416 1.00 0.00 H ATOM 2195 HZ2 LYS B 45 10.082 -12.983 11.434 1.00 0.00 H ATOM 2196 HZ3 LYS B 45 11.762 -13.133 11.227 1.00 0.00 H ATOM 2197 H LYS B 45 8.025 -13.505 18.788 1.00 0.00 H ATOM 2198 N MET B 46 11.737 -13.903 17.919 1.00 32.34 N ATOM 2199 CA MET B 46 12.915 -13.398 18.624 1.00 31.68 C ATOM 2200 C MET B 46 13.847 -12.694 17.635 1.00 31.03 C ATOM 2201 O MET B 46 14.204 -13.269 16.607 1.00 31.08 O ATOM 2202 CB MET B 46 13.655 -14.562 19.282 1.00 31.88 C ATOM 2203 CG MET B 46 12.888 -15.223 20.405 1.00 32.52 C ATOM 2204 SD MET B 46 13.020 -14.297 21.929 1.00 35.26 S ATOM 2205 CE MET B 46 14.648 -14.809 22.486 1.00 35.51 C ATOM 2206 HA MET B 46 12.599 -12.689 19.389 1.00 0.00 H ATOM 2207 HB2 MET B 46 13.861 -15.313 18.519 1.00 0.00 H ATOM 2208 HB3 MET B 46 14.596 -14.187 19.684 1.00 0.00 H ATOM 2209 HG2 MET B 46 13.287 -16.225 20.564 1.00 0.00 H ATOM 2210 HG3 MET B 46 11.837 -15.292 20.123 1.00 0.00 H ATOM 2211 HE1 MET B 46 14.659 -15.890 22.627 1.00 0.00 H ATOM 2212 HE2 MET B 46 15.391 -14.531 21.738 1.00 0.00 H ATOM 2213 HE3 MET B 46 14.879 -14.316 23.430 1.00 0.00 H ATOM 2214 H MET B 46 11.869 -14.643 17.200 1.00 0.00 H ATOM 2215 N ILE B 47 14.257 -11.469 17.949 1.00 30.15 N ATOM 2216 CA ILE B 47 15.069 -10.673 17.020 1.00 29.61 C ATOM 2217 C ILE B 47 16.326 -10.148 17.707 1.00 29.35 C ATOM 2218 O ILE B 47 16.318 -9.825 18.893 1.00 28.94 O ATOM 2219 CB ILE B 47 14.274 -9.503 16.380 1.00 29.05 C ATOM 2220 CG1 ILE B 47 13.713 -8.570 17.455 1.00 29.97 C ATOM 2221 CG2 ILE B 47 13.139 -10.045 15.517 1.00 29.24 C ATOM 2222 CD1 ILE B 47 13.001 -7.365 16.897 1.00 30.10 C ATOM 2223 HA ILE B 47 15.360 -11.343 16.211 1.00 0.00 H ATOM 2224 HB ILE B 47 14.958 -8.932 15.752 1.00 0.00 H ATOM 2225 HG12 ILE B 47 13.009 -9.133 18.067 1.00 0.00 H ATOM 2226 HG13 ILE B 47 14.539 -8.225 18.077 1.00 0.00 H ATOM 2227 HD11 ILE B 47 13.695 -6.783 16.290 1.00 0.00 H ATOM 2228 HD12 ILE B 47 12.164 -7.692 16.280 1.00 0.00 H ATOM 2229 HD13 ILE B 47 12.631 -6.751 17.718 1.00 0.00 H ATOM 2230 HG21 ILE B 47 13.553 -10.670 14.726 1.00 0.00 H ATOM 2231 HG22 ILE B 47 12.465 -10.638 16.136 1.00 0.00 H ATOM 2232 HG23 ILE B 47 12.591 -9.213 15.075 1.00 0.00 H ATOM 2233 H ILE B 47 13.997 -11.066 18.872 1.00 0.00 H ATOM 2234 N VAL B 48 17.408 -10.091 16.943 1.00 29.51 N ATOM 2235 CA VAL B 48 18.718 -9.765 17.491 1.00 29.60 C ATOM 2236 C VAL B 48 18.925 -8.257 17.601 1.00 29.02 C ATOM 2237 O VAL B 48 18.517 -7.471 16.742 1.00 28.69 O ATOM 2238 CB VAL B 48 19.880 -10.447 16.695 1.00 29.84 C ATOM 2239 CG1 VAL B 48 19.861 -10.045 15.222 1.00 30.88 C ATOM 2240 CG2 VAL B 48 21.231 -10.118 17.314 1.00 30.12 C ATOM 2241 HA VAL B 48 18.744 -10.173 18.501 1.00 0.00 H ATOM 2242 HB VAL B 48 19.724 -11.524 16.753 1.00 0.00 H ATOM 2243 HG11 VAL B 48 18.913 -10.347 14.776 1.00 0.00 H ATOM 2244 HG12 VAL B 48 19.974 -8.964 15.140 1.00 0.00 H ATOM 2245 HG13 VAL B 48 20.682 -10.538 14.702 1.00 0.00 H ATOM 2246 HG21 VAL B 48 21.383 -9.039 17.300 1.00 0.00 H ATOM 2247 HG22 VAL B 48 21.254 -10.476 18.343 1.00 0.00 H ATOM 2248 HG23 VAL B 48 22.020 -10.605 16.741 1.00 0.00 H ATOM 2249 H VAL B 48 17.319 -10.284 15.925 1.00 0.00 H ATOM 2250 N GLY B 49 19.512 -7.866 18.723 1.00 29.39 N ATOM 2251 CA GLY B 49 20.147 -6.561 18.863 1.00 29.14 C ATOM 2252 C GLY B 49 21.474 -6.738 19.576 1.00 29.20 C ATOM 2253 O GLY B 49 21.847 -7.841 19.954 1.00 28.65 O ATOM 2254 HA3 GLY B 49 19.504 -5.900 19.444 1.00 0.00 H ATOM 2255 HA2 GLY B 49 20.315 -6.127 17.877 1.00 0.00 H ATOM 2256 H GLY B 49 19.520 -8.515 19.535 1.00 0.00 H ATOM 2257 N ILE B 50 22.197 -5.645 19.756 1.00 29.76 N ATOM 2258 CA ILE B 50 23.417 -5.679 20.554 1.00 29.75 C ATOM 2259 C ILE B 50 23.082 -6.094 21.991 1.00 29.82 C ATOM 2260 O ILE B 50 22.302 -5.431 22.675 1.00 29.36 O ATOM 2261 CB ILE B 50 24.126 -4.322 20.544 1.00 30.09 C ATOM 2262 CG1 ILE B 50 24.669 -4.022 19.146 1.00 29.63 C ATOM 2263 CG2 ILE B 50 25.285 -4.324 21.528 1.00 31.22 C ATOM 2264 CD1 ILE B 50 25.369 -2.676 19.029 1.00 30.35 C ATOM 2265 HA ILE B 50 24.095 -6.411 20.115 1.00 0.00 H ATOM 2266 HB ILE B 50 23.403 -3.558 20.832 1.00 0.00 H ATOM 2267 HG12 ILE B 50 25.381 -4.803 18.880 1.00 0.00 H ATOM 2268 HG13 ILE B 50 23.835 -4.037 18.444 1.00 0.00 H ATOM 2269 HD11 ILE B 50 24.668 -1.880 19.280 1.00 0.00 H ATOM 2270 HD12 ILE B 50 26.215 -2.647 19.716 1.00 0.00 H ATOM 2271 HD13 ILE B 50 25.724 -2.540 18.008 1.00 0.00 H ATOM 2272 HG21 ILE B 50 24.908 -4.521 22.531 1.00 0.00 H ATOM 2273 HG22 ILE B 50 25.997 -5.100 21.247 1.00 0.00 H ATOM 2274 HG23 ILE B 50 25.778 -3.352 21.508 1.00 0.00 H ATOM 2275 H ILE B 50 21.891 -4.750 19.323 1.00 0.00 H ATOM 2276 N GLY B 51 23.626 -7.232 22.414 1.00 29.60 N ATOM 2277 CA GLY B 51 23.543 -7.653 23.817 1.00 29.57 C ATOM 2278 C GLY B 51 22.463 -8.674 24.113 1.00 29.23 C ATOM 2279 O GLY B 51 22.362 -9.161 25.231 1.00 29.21 O ATOM 2280 HA3 GLY B 51 23.350 -6.769 24.425 1.00 0.00 H ATOM 2281 HA2 GLY B 51 24.504 -8.084 24.099 1.00 0.00 H ATOM 2282 H GLY B 51 24.123 -7.839 21.732 1.00 0.00 H ATOM 2283 N GLY B 52 21.646 -9.008 23.120 1.00 28.96 N ATOM 2284 CA GLY B 52 20.640 -10.034 23.313 1.00 29.07 C ATOM 2285 C GLY B 52 19.487 -9.965 22.348 1.00 28.97 C ATOM 2286 O GLY B 52 19.459 -9.138 21.443 1.00 28.53 O ATOM 2287 HA3 GLY B 52 20.245 -9.938 24.324 1.00 0.00 H ATOM 2288 HA2 GLY B 52 21.119 -11.007 23.203 1.00 0.00 H ATOM 2289 H GLY B 52 21.729 -8.531 22.200 1.00 0.00 H ATOM 2290 N PHE B 53 18.515 -10.840 22.572 1.00 29.44 N ATOM 2291 CA PHE B 53 17.354 -10.935 21.708 1.00 29.60 C ATOM 2292 C PHE B 53 16.143 -10.280 22.377 1.00 30.20 C ATOM 2293 O PHE B 53 16.007 -10.321 23.593 1.00 31.41 O ATOM 2294 CB PHE B 53 17.052 -12.396 21.410 1.00 29.13 C ATOM 2295 CG PHE B 53 17.884 -12.991 20.306 1.00 27.52 C ATOM 2296 CD1 PHE B 53 19.179 -13.413 20.544 1.00 27.97 C ATOM 2297 CD2 PHE B 53 17.338 -13.207 19.053 1.00 24.84 C ATOM 2298 CE1 PHE B 53 19.931 -13.995 19.543 1.00 25.71 C ATOM 2299 CE2 PHE B 53 18.093 -13.789 18.041 1.00 26.11 C ATOM 2300 CZ PHE B 53 19.384 -14.187 18.291 1.00 26.38 C ATOM 2301 HA PHE B 53 17.565 -10.414 20.774 1.00 0.00 H ATOM 2302 HB2 PHE B 53 17.228 -12.973 22.318 1.00 0.00 H ATOM 2303 HB3 PHE B 53 16.002 -12.477 21.127 1.00 0.00 H ATOM 2304 HD2 PHE B 53 16.305 -12.918 18.857 1.00 0.00 H ATOM 2305 HE2 PHE B 53 17.661 -13.929 17.050 1.00 0.00 H ATOM 2306 HZ PHE B 53 19.975 -14.653 17.502 1.00 0.00 H ATOM 2307 HE1 PHE B 53 20.957 -14.303 19.742 1.00 0.00 H ATOM 2308 HD1 PHE B 53 19.612 -13.284 21.536 1.00 0.00 H ATOM 2309 H PHE B 53 18.588 -11.476 23.391 1.00 0.00 H ATOM 2310 N VAL B 54 15.283 -9.646 21.591 1.00 30.73 N ATOM 2311 CA VAL B 54 14.002 -9.166 22.109 1.00 30.89 C ATOM 2312 C VAL B 54 12.892 -10.052 21.549 1.00 30.55 C ATOM 2313 O VAL B 54 12.906 -10.420 20.369 1.00 30.71 O ATOM 2314 CB VAL B 54 13.767 -7.621 21.902 1.00 31.61 C ATOM 2315 CG1 VAL B 54 14.896 -6.954 21.143 1.00 31.56 C ATOM 2316 CG2 VAL B 54 12.428 -7.297 21.258 1.00 33.24 C ATOM 2317 HA VAL B 54 14.003 -9.257 23.195 1.00 0.00 H ATOM 2318 HB VAL B 54 13.750 -7.206 22.910 1.00 0.00 H ATOM 2319 HG11 VAL B 54 15.827 -7.080 21.695 1.00 0.00 H ATOM 2320 HG12 VAL B 54 14.991 -7.413 20.159 1.00 0.00 H ATOM 2321 HG13 VAL B 54 14.679 -5.892 21.031 1.00 0.00 H ATOM 2322 HG21 VAL B 54 12.373 -7.772 20.279 1.00 0.00 H ATOM 2323 HG22 VAL B 54 11.622 -7.670 21.890 1.00 0.00 H ATOM 2324 HG23 VAL B 54 12.332 -6.217 21.145 1.00 0.00 H ATOM 2325 H VAL B 54 15.523 -9.488 20.592 1.00 0.00 H ATOM 2326 N LYS B 55 11.985 -10.457 22.433 1.00 29.67 N ATOM 2327 CA LYS B 55 10.809 -11.221 22.044 1.00 29.76 C ATOM 2328 C LYS B 55 9.708 -10.265 21.591 1.00 29.67 C ATOM 2329 O LYS B 55 9.336 -9.342 22.311 1.00 30.04 O ATOM 2330 CB LYS B 55 10.317 -12.103 23.196 1.00 29.20 C ATOM 2331 CG LYS B 55 9.204 -13.060 22.788 1.00 30.00 C ATOM 2332 CD LYS B 55 8.721 -13.901 23.961 1.00 30.40 C ATOM 2333 CE LYS B 55 7.419 -14.585 23.630 1.00 30.74 C ATOM 2334 NZ LYS B 55 6.885 -15.370 24.777 1.00 32.05 N ATOM 2335 HA LYS B 55 11.077 -11.879 21.217 1.00 0.00 H ATOM 2336 HB2 LYS B 55 11.158 -12.688 23.568 1.00 0.00 H ATOM 2337 HB3 LYS B 55 9.945 -11.458 23.992 1.00 0.00 H ATOM 2338 HG2 LYS B 55 8.366 -12.481 22.400 1.00 0.00 H ATOM 2339 HG3 LYS B 55 9.578 -13.724 22.008 1.00 0.00 H ATOM 2340 HD2 LYS B 55 9.472 -14.656 24.193 1.00 0.00 H ATOM 2341 HD3 LYS B 55 8.576 -13.256 24.828 1.00 0.00 H ATOM 2342 HE2 LYS B 55 7.581 -15.259 22.789 1.00 0.00 H ATOM 2343 HE3 LYS B 55 6.686 -13.828 23.352 1.00 0.00 H ATOM 2344 HZ1 LYS B 55 7.574 -16.101 25.046 1.00 0.00 H ATOM 2345 HZ2 LYS B 55 6.720 -14.734 25.583 1.00 0.00 H ATOM 2346 HZ3 LYS B 55 5.990 -15.821 24.500 1.00 0.00 H ATOM 2347 H LYS B 55 12.121 -10.220 23.436 1.00 0.00 H ATOM 2348 N VAL B 56 9.206 -10.478 20.383 1.00 30.34 N ATOM 2349 CA VAL B 56 8.215 -9.583 19.801 1.00 30.79 C ATOM 2350 C VAL B 56 7.012 -10.342 19.256 1.00 31.52 C ATOM 2351 O VAL B 56 7.080 -11.553 19.033 1.00 31.68 O ATOM 2352 CB VAL B 56 8.828 -8.722 18.671 1.00 30.62 C ATOM 2353 CG1 VAL B 56 9.973 -7.882 19.208 1.00 30.50 C ATOM 2354 CG2 VAL B 56 9.312 -9.590 17.511 1.00 30.43 C ATOM 2355 HA VAL B 56 7.879 -8.931 20.608 1.00 0.00 H ATOM 2356 HB VAL B 56 8.047 -8.061 18.295 1.00 0.00 H ATOM 2357 HG11 VAL B 56 9.602 -7.225 19.995 1.00 0.00 H ATOM 2358 HG12 VAL B 56 10.744 -8.537 19.614 1.00 0.00 H ATOM 2359 HG13 VAL B 56 10.392 -7.283 18.400 1.00 0.00 H ATOM 2360 HG21 VAL B 56 10.072 -10.283 17.870 1.00 0.00 H ATOM 2361 HG22 VAL B 56 8.471 -10.151 17.103 1.00 0.00 H ATOM 2362 HG23 VAL B 56 9.737 -8.953 16.735 1.00 0.00 H ATOM 2363 H VAL B 56 9.527 -11.303 19.838 1.00 0.00 H ATOM 2364 N ARG B 57 5.917 -9.614 19.034 1.00 32.23 N ATOM 2365 CA ARG B 57 4.786 -10.112 18.242 1.00 32.66 C ATOM 2366 C ARG B 57 4.899 -9.564 16.822 1.00 32.89 C ATOM 2367 O ARG B 57 5.064 -8.357 16.628 1.00 32.56 O ATOM 2368 CB ARG B 57 3.446 -9.677 18.857 1.00 32.87 C ATOM 2369 CG ARG B 57 3.411 -9.712 20.379 1.00 33.05 C ATOM 2370 CD ARG B 57 2.017 -9.405 20.934 1.00 34.89 C ATOM 2371 NE ARG B 57 1.561 -8.051 20.624 1.00 33.63 N ATOM 2372 CZ ARG B 57 1.797 -6.968 21.360 1.00 33.12 C ATOM 2373 NH1 ARG B 57 2.513 -7.040 22.477 1.00 32.66 N ATOM 2374 NH2 ARG B 57 1.310 -5.796 20.973 1.00 33.01 N ATOM 2375 HA ARG B 57 4.816 -11.202 18.232 1.00 0.00 H ATOM 2376 HB2 ARG B 57 3.238 -8.657 18.534 1.00 0.00 H ATOM 2377 HB3 ARG B 57 2.667 -10.341 18.483 1.00 0.00 H ATOM 2378 HG2 ARG B 57 3.712 -10.705 20.714 1.00 0.00 H ATOM 2379 HG3 ARG B 57 4.113 -8.972 20.763 1.00 0.00 H ATOM 2380 HD2 ARG B 57 2.041 -9.524 22.017 1.00 0.00 H ATOM 2381 HD3 ARG B 57 1.309 -10.116 20.507 1.00 0.00 H ATOM 2382 HE ARG B 57 1.005 -7.924 19.754 1.00 0.00 H ATOM 2383 HH12 ARG B 57 2.687 -6.183 23.039 1.00 0.00 H ATOM 2384 HH11 ARG B 57 2.899 -7.954 22.789 1.00 0.00 H ATOM 2385 HH22 ARG B 57 1.490 -4.945 21.542 1.00 0.00 H ATOM 2386 HH21 ARG B 57 0.748 -5.729 20.100 1.00 0.00 H ATOM 2387 H ARG B 57 5.862 -8.657 19.437 1.00 0.00 H ATOM 2388 N GLN B 58 4.826 -10.453 15.838 1.00 33.05 N ATOM 2389 CA GLN B 58 4.862 -10.061 14.439 1.00 33.82 C ATOM 2390 C GLN B 58 3.438 -9.942 13.891 1.00 34.41 C ATOM 2391 O GLN B 58 2.671 -10.909 13.929 1.00 34.40 O ATOM 2392 CB GLN B 58 5.649 -11.082 13.614 1.00 34.19 C ATOM 2393 CG GLN B 58 5.730 -10.748 12.133 1.00 35.87 C ATOM 2394 CD GLN B 58 6.262 -11.887 11.285 1.00 40.38 C ATOM 2395 OE1 GLN B 58 7.176 -12.617 11.686 1.00 42.32 O ATOM 2396 NE2 GLN B 58 5.708 -12.030 10.082 1.00 42.48 N ATOM 2397 HA GLN B 58 5.359 -9.094 14.365 1.00 0.00 H ATOM 2398 HB2 GLN B 58 6.663 -11.135 14.010 1.00 0.00 H ATOM 2399 HB3 GLN B 58 5.168 -12.054 13.721 1.00 0.00 H ATOM 2400 HG2 GLN B 58 4.730 -10.493 11.781 1.00 0.00 H ATOM 2401 HG3 GLN B 58 6.388 -9.888 12.008 1.00 0.00 H ATOM 2402 HE22 GLN B 58 4.941 -11.394 9.784 1.00 0.00 H ATOM 2403 HE21 GLN B 58 6.042 -12.778 9.441 1.00 0.00 H ATOM 2404 H GLN B 58 4.740 -11.462 16.076 1.00 0.00 H ATOM 2405 N TYR B 59 3.106 -8.759 13.376 1.00 34.65 N ATOM 2406 CA TYR B 59 1.849 -8.526 12.661 1.00 34.89 C ATOM 2407 C TYR B 59 2.142 -8.188 11.210 1.00 35.22 C ATOM 2408 O TYR B 59 3.060 -7.431 10.911 1.00 34.92 O ATOM 2409 CB TYR B 59 1.086 -7.344 13.252 1.00 34.85 C ATOM 2410 CG TYR B 59 0.653 -7.470 14.693 1.00 33.52 C ATOM 2411 CD1 TYR B 59 1.473 -7.023 15.722 1.00 33.98 C ATOM 2412 CD2 TYR B 59 -0.612 -7.949 15.022 1.00 34.08 C ATOM 2413 CE1 TYR B 59 1.080 -7.097 17.037 1.00 33.53 C ATOM 2414 CE2 TYR B 59 -1.031 -8.016 16.342 1.00 35.35 C ATOM 2415 CZ TYR B 59 -0.182 -7.587 17.349 1.00 36.19 C ATOM 2416 OH TYR B 59 -0.582 -7.642 18.671 1.00 36.26 O ATOM 2417 HA TYR B 59 1.252 -9.434 12.748 1.00 0.00 H ATOM 2418 HB3 TYR B 59 0.190 -7.194 12.649 1.00 0.00 H ATOM 2419 HB2 TYR B 59 1.726 -6.465 13.175 1.00 0.00 H ATOM 2420 HD2 TYR B 59 -1.284 -8.277 14.229 1.00 0.00 H ATOM 2421 HE2 TYR B 59 -2.020 -8.403 16.585 1.00 0.00 H ATOM 2422 HE1 TYR B 59 1.754 -6.773 17.830 1.00 0.00 H ATOM 2423 HD1 TYR B 59 2.450 -6.604 15.481 1.00 0.00 H ATOM 2424 HH TYR B 59 0.145 -7.298 19.249 1.00 0.00 H ATOM 2425 H TYR B 59 3.769 -7.965 13.487 1.00 0.00 H ATOM 2426 N ASP B 60 1.327 -8.711 10.310 1.00 35.67 N ATOM 2427 CA ASP B 60 1.491 -8.445 8.888 1.00 36.31 C ATOM 2428 C ASP B 60 0.452 -7.424 8.422 1.00 35.48 C ATOM 2429 O ASP B 60 -0.571 -7.221 9.080 1.00 34.80 O ATOM 2430 CB ASP B 60 1.373 -9.760 8.101 1.00 37.32 C ATOM 2431 CG ASP B 60 2.401 -10.804 8.545 1.00 39.43 C ATOM 2432 OD1 ASP B 60 3.627 -10.535 8.464 1.00 42.19 O ATOM 2433 OD2 ASP B 60 1.980 -11.895 8.982 1.00 43.67 O ATOM 2434 HA ASP B 60 2.479 -8.023 8.706 1.00 0.00 H ATOM 2435 HB2 ASP B 60 0.373 -10.168 8.250 1.00 0.00 H ATOM 2436 HB3 ASP B 60 1.524 -9.549 7.042 1.00 0.00 H ATOM 2437 H ASP B 60 0.550 -9.327 10.625 1.00 0.00 H ATOM 2438 N GLN B 61 0.759 -6.742 7.322 1.00 35.27 N ATOM 2439 CA GLN B 61 -0.194 -5.863 6.629 1.00 35.66 C ATOM 2440 C GLN B 61 -0.717 -4.689 7.464 1.00 34.86 C ATOM 2441 O GLN B 61 -1.907 -4.370 7.429 1.00 34.02 O ATOM 2442 CB GLN B 61 -1.366 -6.681 6.062 1.00 36.22 C ATOM 2443 CG GLN B 61 -0.962 -7.546 4.876 1.00 38.79 C ATOM 2444 CD GLN B 61 -0.262 -6.742 3.799 1.00 40.93 C ATOM 2445 OE1 GLN B 61 0.948 -6.863 3.607 1.00 44.70 O ATOM 2446 NE2 GLN B 61 -1.018 -5.894 3.106 1.00 44.04 N ATOM 2447 HA GLN B 61 0.376 -5.408 5.819 1.00 0.00 H ATOM 2448 HB2 GLN B 61 -1.753 -7.328 6.849 1.00 0.00 H ATOM 2449 HB3 GLN B 61 -2.148 -5.993 5.741 1.00 0.00 H ATOM 2450 HG2 GLN B 61 -0.289 -8.329 5.224 1.00 0.00 H ATOM 2451 HG3 GLN B 61 -1.857 -8.001 4.451 1.00 0.00 H ATOM 2452 HE22 GLN B 61 -2.037 -5.825 3.303 1.00 0.00 H ATOM 2453 HE21 GLN B 61 -0.590 -5.300 2.368 1.00 0.00 H ATOM 2454 H GLN B 61 1.719 -6.835 6.934 1.00 0.00 H ATOM 2455 N ILE B 62 0.200 -4.024 8.168 1.00 34.04 N ATOM 2456 CA ILE B 62 -0.120 -2.884 9.029 1.00 33.27 C ATOM 2457 C ILE B 62 0.223 -1.578 8.306 1.00 33.07 C ATOM 2458 O ILE B 62 1.381 -1.362 7.949 1.00 32.99 O ATOM 2459 CB ILE B 62 0.684 -2.965 10.347 1.00 33.20 C ATOM 2460 CG1 ILE B 62 0.318 -4.236 11.143 1.00 33.19 C ATOM 2461 CG2 ILE B 62 0.493 -1.713 11.192 1.00 32.87 C ATOM 2462 CD1 ILE B 62 -1.098 -4.273 11.694 1.00 32.64 C ATOM 2463 HA ILE B 62 -1.185 -2.908 9.259 1.00 0.00 H ATOM 2464 HB ILE B 62 1.740 -3.027 10.086 1.00 0.00 H ATOM 2465 HG12 ILE B 62 0.446 -5.095 10.484 1.00 0.00 H ATOM 2466 HG13 ILE B 62 1.008 -4.318 11.982 1.00 0.00 H ATOM 2467 HD11 ILE B 62 -1.246 -3.431 12.370 1.00 0.00 H ATOM 2468 HD12 ILE B 62 -1.809 -4.208 10.870 1.00 0.00 H ATOM 2469 HD13 ILE B 62 -1.252 -5.207 12.235 1.00 0.00 H ATOM 2470 HG21 ILE B 62 0.833 -0.842 10.631 1.00 0.00 H ATOM 2471 HG22 ILE B 62 -0.563 -1.599 11.437 1.00 0.00 H ATOM 2472 HG23 ILE B 62 1.072 -1.804 12.111 1.00 0.00 H ATOM 2473 H ILE B 62 1.192 -4.330 8.102 1.00 0.00 H ATOM 2474 N PRO B 63 -0.778 -0.707 8.071 1.00 32.32 N ATOM 2475 CA PRO B 63 -0.495 0.619 7.530 1.00 31.97 C ATOM 2476 C PRO B 63 0.116 1.583 8.539 1.00 31.71 C ATOM 2477 O PRO B 63 -0.426 1.786 9.625 1.00 31.48 O ATOM 2478 CB PRO B 63 -1.872 1.128 7.078 1.00 32.08 C ATOM 2479 CG PRO B 63 -2.795 -0.044 7.166 1.00 32.19 C ATOM 2480 CD PRO B 63 -2.225 -0.935 8.208 1.00 32.50 C ATOM 2481 HA PRO B 63 0.247 0.559 6.734 1.00 0.00 H ATOM 2482 HD3 PRO B 63 -2.575 -0.654 9.201 1.00 0.00 H ATOM 2483 HD2 PRO B 63 -2.479 -1.978 8.016 1.00 0.00 H ATOM 2484 HG3 PRO B 63 -2.842 -0.562 6.208 1.00 0.00 H ATOM 2485 HG2 PRO B 63 -3.795 0.282 7.451 1.00 0.00 H ATOM 2486 HB2 PRO B 63 -2.214 1.929 7.733 1.00 0.00 H ATOM 2487 HB3 PRO B 63 -1.822 1.495 6.053 1.00 0.00 H ATOM 2488 N ILE B 64 1.247 2.165 8.161 1.00 31.38 N ATOM 2489 CA ILE B 64 1.844 3.268 8.887 1.00 31.58 C ATOM 2490 C ILE B 64 2.095 4.424 7.924 1.00 31.78 C ATOM 2491 O ILE B 64 2.668 4.232 6.847 1.00 30.80 O ATOM 2492 CB ILE B 64 3.190 2.871 9.532 1.00 31.70 C ATOM 2493 CG1 ILE B 64 3.025 1.607 10.378 1.00 32.16 C ATOM 2494 CG2 ILE B 64 3.733 4.026 10.380 1.00 31.38 C ATOM 2495 CD1 ILE B 64 4.242 1.264 11.240 1.00 33.16 C ATOM 2496 HA ILE B 64 1.153 3.556 9.679 1.00 0.00 H ATOM 2497 HB ILE B 64 3.908 2.659 8.740 1.00 0.00 H ATOM 2498 HG12 ILE B 64 2.168 1.746 11.037 1.00 0.00 H ATOM 2499 HG13 ILE B 64 2.834 0.769 9.707 1.00 0.00 H ATOM 2500 HD11 ILE B 64 5.108 1.108 10.597 1.00 0.00 H ATOM 2501 HD12 ILE B 64 4.442 2.086 11.928 1.00 0.00 H ATOM 2502 HD13 ILE B 64 4.040 0.355 11.807 1.00 0.00 H ATOM 2503 HG21 ILE B 64 3.885 4.900 9.747 1.00 0.00 H ATOM 2504 HG22 ILE B 64 3.017 4.265 11.166 1.00 0.00 H ATOM 2505 HG23 ILE B 64 4.682 3.731 10.828 1.00 0.00 H ATOM 2506 H ILE B 64 1.726 1.814 7.307 1.00 0.00 H ATOM 2507 N GLU B 65 1.661 5.622 8.306 1.00 32.26 N ATOM 2508 CA GLU B 65 2.041 6.816 7.562 1.00 32.71 C ATOM 2509 C GLU B 65 3.325 7.411 8.142 1.00 32.65 C ATOM 2510 O GLU B 65 3.405 7.701 9.337 1.00 31.80 O ATOM 2511 CB GLU B 65 0.923 7.863 7.540 1.00 32.76 C ATOM 2512 CG GLU B 65 1.177 8.938 6.490 1.00 33.59 C ATOM 2513 CD GLU B 65 -0.019 9.825 6.215 1.00 36.75 C ATOM 2514 OE1 GLU B 65 0.192 11.034 5.991 1.00 36.28 O ATOM 2515 OE2 GLU B 65 -1.164 9.324 6.200 1.00 38.49 O ATOM 2516 HA GLU B 65 2.219 6.517 6.529 1.00 0.00 H ATOM 2517 HB2 GLU B 65 -0.021 7.367 7.317 1.00 0.00 H ATOM 2518 HB3 GLU B 65 0.861 8.335 8.521 1.00 0.00 H ATOM 2519 HG2 GLU B 65 1.998 9.567 6.834 1.00 0.00 H ATOM 2520 HG3 GLU B 65 1.462 8.448 5.559 1.00 0.00 H ATOM 2521 H GLU B 65 1.047 5.707 9.141 1.00 0.00 H ATOM 2522 N ILE B 66 4.310 7.607 7.269 1.00 32.98 N ATOM 2523 CA ILE B 66 5.656 8.041 7.652 1.00 33.31 C ATOM 2524 C ILE B 66 6.021 9.269 6.822 1.00 34.03 C ATOM 2525 O ILE B 66 6.192 9.169 5.604 1.00 33.72 O ATOM 2526 CB ILE B 66 6.699 6.934 7.368 1.00 33.06 C ATOM 2527 CG1 ILE B 66 6.334 5.645 8.104 1.00 33.11 C ATOM 2528 CG2 ILE B 66 8.115 7.391 7.754 1.00 32.66 C ATOM 2529 CD1 ILE B 66 7.059 4.410 7.577 1.00 33.13 C ATOM 2530 HA ILE B 66 5.662 8.265 8.719 1.00 0.00 H ATOM 2531 HB ILE B 66 6.689 6.736 6.296 1.00 0.00 H ATOM 2532 HG12 ILE B 66 6.584 5.768 9.158 1.00 0.00 H ATOM 2533 HG13 ILE B 66 5.261 5.483 8.003 1.00 0.00 H ATOM 2534 HD11 ILE B 66 6.810 4.265 6.526 1.00 0.00 H ATOM 2535 HD12 ILE B 66 8.135 4.550 7.681 1.00 0.00 H ATOM 2536 HD13 ILE B 66 6.748 3.536 8.149 1.00 0.00 H ATOM 2537 HG21 ILE B 66 8.380 8.276 7.175 1.00 0.00 H ATOM 2538 HG22 ILE B 66 8.141 7.629 8.817 1.00 0.00 H ATOM 2539 HG23 ILE B 66 8.824 6.591 7.542 1.00 0.00 H ATOM 2540 H ILE B 66 4.114 7.443 6.261 1.00 0.00 H ATOM 2541 N CYS B 67 6.122 10.423 7.476 1.00 35.10 N ATOM 2542 CA CYS B 67 6.380 11.703 6.796 1.00 36.00 C ATOM 2543 C CYS B 67 5.455 11.968 5.621 1.00 35.62 C ATOM 2544 O CYS B 67 5.891 12.505 4.592 1.00 35.83 O ATOM 2545 CB CYS B 67 7.812 11.749 6.284 1.00 36.43 C ATOM 2546 SG CYS B 67 8.971 11.639 7.594 1.00 41.13 S ATOM 2547 HA CYS B 67 6.198 12.472 7.546 1.00 0.00 H ATOM 2548 HB2 CYS B 67 7.968 12.688 5.752 1.00 0.00 H ATOM 2549 HB3 CYS B 67 7.970 10.915 5.601 1.00 0.00 H ATOM 2550 HG CYS B 67 10.251 11.685 7.079 1.00 0.00 H ATOM 2551 H CYS B 67 6.014 10.421 8.510 1.00 0.00 H ATOM 2552 N GLY B 68 4.193 11.577 5.766 1.00 35.08 N ATOM 2553 CA GLY B 68 3.203 11.776 4.716 1.00 34.92 C ATOM 2554 C GLY B 68 3.194 10.700 3.649 1.00 34.65 C ATOM 2555 O GLY B 68 2.427 10.796 2.690 1.00 35.06 O ATOM 2556 HA3 GLY B 68 3.405 12.732 4.234 1.00 0.00 H ATOM 2557 HA2 GLY B 68 2.217 11.805 5.179 1.00 0.00 H ATOM 2558 H GLY B 68 3.905 11.117 6.653 1.00 0.00 H ATOM 2559 N HIS B 69 4.026 9.672 3.822 1.00 33.69 N ATOM 2560 CA HIS B 69 4.089 8.543 2.894 1.00 33.11 C ATOM 2561 C HIS B 69 3.396 7.313 3.475 1.00 32.94 C ATOM 2562 O HIS B 69 3.605 6.970 4.641 1.00 32.05 O ATOM 2563 CB HIS B 69 5.541 8.178 2.587 1.00 33.09 C ATOM 2564 CG HIS B 69 6.296 9.251 1.865 1.00 33.12 C ATOM 2565 ND1 HIS B 69 6.722 9.117 0.562 1.00 33.11 N ATOM 2566 CD2 HIS B 69 6.709 10.474 2.271 1.00 32.72 C ATOM 2567 CE1 HIS B 69 7.359 10.214 0.194 1.00 33.13 C ATOM 2568 NE2 HIS B 69 7.371 11.050 1.216 1.00 32.08 N ATOM 2569 HA HIS B 69 3.580 8.849 1.980 1.00 0.00 H ATOM 2570 HB2 HIS B 69 6.050 7.974 3.529 1.00 0.00 H ATOM 2571 HB3 HIS B 69 5.546 7.279 1.970 1.00 0.00 H ATOM 2572 HD2 HIS B 69 6.546 10.919 3.253 1.00 0.00 H ATOM 2573 HE1 HIS B 69 7.800 10.398 -0.786 1.00 0.00 H ATOM 2574 H HIS B 69 4.655 9.673 4.650 1.00 0.00 H ATOM 2575 N LYS B 70 2.632 6.623 2.627 1.00 32.29 N ATOM 2576 CA LYS B 70 1.871 5.446 3.027 1.00 32.05 C ATOM 2577 C LYS B 70 2.664 4.155 2.852 1.00 31.26 C ATOM 2578 O LYS B 70 3.000 3.748 1.745 1.00 31.13 O ATOM 2579 CB LYS B 70 0.564 5.363 2.242 1.00 32.13 C ATOM 2580 CG LYS B 70 -0.302 6.602 2.376 1.00 33.02 C ATOM 2581 CD LYS B 70 -1.329 6.709 1.263 1.00 34.27 C ATOM 2582 CE LYS B 70 -2.436 5.686 1.418 1.00 35.60 C ATOM 2583 NZ LYS B 70 -3.540 5.937 0.450 1.00 36.75 N ATOM 2584 HA LYS B 70 1.652 5.556 4.089 1.00 0.00 H ATOM 2585 HB2 LYS B 70 0.803 5.221 1.188 1.00 0.00 H ATOM 2586 HB3 LYS B 70 -0.002 4.505 2.604 1.00 0.00 H ATOM 2587 HG2 LYS B 70 -0.824 6.564 3.332 1.00 0.00 H ATOM 2588 HG3 LYS B 70 0.339 7.483 2.348 1.00 0.00 H ATOM 2589 HD2 LYS B 70 -1.766 7.707 1.281 1.00 0.00 H ATOM 2590 HD3 LYS B 70 -0.831 6.548 0.307 1.00 0.00 H ATOM 2591 HE2 LYS B 70 -2.832 5.741 2.432 1.00 0.00 H ATOM 2592 HE3 LYS B 70 -2.028 4.691 1.242 1.00 0.00 H ATOM 2593 HZ1 LYS B 70 -3.937 6.884 0.616 1.00 0.00 H ATOM 2594 HZ2 LYS B 70 -3.169 5.881 -0.520 1.00 0.00 H ATOM 2595 HZ3 LYS B 70 -4.283 5.221 0.580 1.00 0.00 H ATOM 2596 H LYS B 70 2.577 6.938 1.638 1.00 0.00 H ATOM 2597 N ALA B 71 2.971 3.517 3.967 1.00 30.59 N ATOM 2598 CA ALA B 71 3.607 2.214 3.938 1.00 30.16 C ATOM 2599 C ALA B 71 2.648 1.187 4.526 1.00 29.53 C ATOM 2600 O ALA B 71 1.763 1.530 5.313 1.00 28.21 O ATOM 2601 CB ALA B 71 4.913 2.249 4.703 1.00 30.54 C ATOM 2602 HA ALA B 71 3.839 1.935 2.910 1.00 0.00 H ATOM 2603 HB1 ALA B 71 5.580 2.981 4.248 1.00 0.00 H ATOM 2604 HB2 ALA B 71 4.719 2.528 5.739 1.00 0.00 H ATOM 2605 HB3 ALA B 71 5.378 1.263 4.672 1.00 0.00 H ATOM 2606 H ALA B 71 2.752 3.958 4.883 1.00 0.00 H ATOM 2607 N ILE B 72 2.801 -0.060 4.090 1.00 29.20 N ATOM 2608 CA ILE B 72 2.025 -1.179 4.626 1.00 29.25 C ATOM 2609 C ILE B 72 2.902 -2.422 4.639 1.00 28.92 C ATOM 2610 O ILE B 72 3.453 -2.812 3.608 1.00 29.27 O ATOM 2611 CB ILE B 72 0.770 -1.492 3.772 1.00 28.86 C ATOM 2612 CG1 ILE B 72 -0.018 -0.216 3.491 1.00 29.26 C ATOM 2613 CG2 ILE B 72 -0.103 -2.546 4.475 1.00 29.73 C ATOM 2614 CD1 ILE B 72 -1.410 -0.445 2.961 1.00 28.51 C ATOM 2615 HA ILE B 72 1.698 -0.899 5.627 1.00 0.00 H ATOM 2616 HB ILE B 72 1.089 -1.903 2.814 1.00 0.00 H ATOM 2617 HG12 ILE B 72 -0.096 0.348 4.420 1.00 0.00 H ATOM 2618 HG13 ILE B 72 0.534 0.371 2.757 1.00 0.00 H ATOM 2619 HD11 ILE B 72 -1.354 -0.997 2.023 1.00 0.00 H ATOM 2620 HD12 ILE B 72 -1.984 -1.019 3.688 1.00 0.00 H ATOM 2621 HD13 ILE B 72 -1.895 0.516 2.790 1.00 0.00 H ATOM 2622 HG21 ILE B 72 0.473 -3.461 4.611 1.00 0.00 H ATOM 2623 HG22 ILE B 72 -0.418 -2.165 5.447 1.00 0.00 H ATOM 2624 HG23 ILE B 72 -0.981 -2.756 3.863 1.00 0.00 H ATOM 2625 H ILE B 72 3.498 -0.247 3.341 1.00 0.00 H ATOM 2626 N GLY B 73 3.001 -3.062 5.790 1.00 28.38 N ATOM 2627 CA GLY B 73 3.817 -4.256 5.905 1.00 28.23 C ATOM 2628 C GLY B 73 3.886 -4.825 7.301 1.00 28.35 C ATOM 2629 O GLY B 73 2.998 -4.612 8.126 1.00 28.04 O ATOM 2630 HA3 GLY B 73 4.830 -4.011 5.585 1.00 0.00 H ATOM 2631 HA2 GLY B 73 3.403 -5.018 5.245 1.00 0.00 H ATOM 2632 H GLY B 73 2.489 -2.706 6.622 1.00 0.00 H ATOM 2633 N THR B 74 4.951 -5.574 7.552 1.00 28.06 N ATOM 2634 CA THR B 74 5.134 -6.236 8.824 1.00 28.73 C ATOM 2635 C THR B 74 5.551 -5.223 9.886 1.00 27.97 C ATOM 2636 O THR B 74 6.404 -4.360 9.648 1.00 27.44 O ATOM 2637 CB THR B 74 6.168 -7.387 8.687 1.00 28.93 C ATOM 2638 OG1 THR B 74 5.709 -8.300 7.681 1.00 30.53 O ATOM 2639 CG2 THR B 74 6.333 -8.137 9.991 1.00 28.70 C ATOM 2640 HA THR B 74 4.190 -6.679 9.140 1.00 0.00 H ATOM 2641 HB THR B 74 7.132 -6.957 8.414 1.00 0.00 H ATOM 2642 HG1 THR B 74 4.829 -8.668 7.947 1.00 0.00 H ATOM 2643 HG23 THR B 74 6.682 -7.450 10.762 1.00 0.00 H ATOM 2644 HG21 THR B 74 5.374 -8.562 10.288 1.00 0.00 H ATOM 2645 HG22 THR B 74 7.061 -8.937 9.859 1.00 0.00 H ATOM 2646 H THR B 74 5.674 -5.688 6.814 1.00 0.00 H ATOM 2647 N VAL B 75 4.908 -5.308 11.043 1.00 27.97 N ATOM 2648 CA VAL B 75 5.303 -4.532 12.204 1.00 27.53 C ATOM 2649 C VAL B 75 5.503 -5.488 13.357 1.00 27.81 C ATOM 2650 O VAL B 75 4.668 -6.356 13.616 1.00 27.41 O ATOM 2651 CB VAL B 75 4.258 -3.457 12.599 1.00 27.74 C ATOM 2652 CG1 VAL B 75 4.697 -2.722 13.873 1.00 27.69 C ATOM 2653 CG2 VAL B 75 4.059 -2.458 11.469 1.00 27.06 C ATOM 2654 HA VAL B 75 6.221 -3.998 11.958 1.00 0.00 H ATOM 2655 HB VAL B 75 3.311 -3.962 12.790 1.00 0.00 H ATOM 2656 HG11 VAL B 75 4.794 -3.438 14.689 1.00 0.00 H ATOM 2657 HG12 VAL B 75 5.657 -2.236 13.698 1.00 0.00 H ATOM 2658 HG13 VAL B 75 3.950 -1.972 14.134 1.00 0.00 H ATOM 2659 HG21 VAL B 75 5.006 -1.965 11.250 1.00 0.00 H ATOM 2660 HG22 VAL B 75 3.707 -2.982 10.580 1.00 0.00 H ATOM 2661 HG23 VAL B 75 3.322 -1.714 11.769 1.00 0.00 H ATOM 2662 H VAL B 75 4.095 -5.951 11.121 1.00 0.00 H ATOM 2663 N LEU B 76 6.636 -5.333 14.034 1.00 27.58 N ATOM 2664 CA LEU B 76 6.943 -6.138 15.198 1.00 27.91 C ATOM 2665 C LEU B 76 6.671 -5.283 16.416 1.00 27.98 C ATOM 2666 O LEU B 76 6.889 -4.067 16.405 1.00 27.48 O ATOM 2667 CB LEU B 76 8.394 -6.630 15.170 1.00 27.80 C ATOM 2668 CG LEU B 76 8.847 -7.309 13.875 1.00 27.97 C ATOM 2669 CD1 LEU B 76 10.295 -7.750 14.013 1.00 30.42 C ATOM 2670 CD2 LEU B 76 7.978 -8.507 13.504 1.00 28.10 C ATOM 2671 HA LEU B 76 6.322 -7.033 15.217 1.00 0.00 H ATOM 2672 HB2 LEU B 76 9.042 -5.770 15.340 1.00 0.00 H ATOM 2673 HB3 LEU B 76 8.520 -7.345 15.983 1.00 0.00 H ATOM 2674 HG LEU B 76 8.746 -6.578 13.073 1.00 0.00 H ATOM 2675 HD21 LEU B 76 8.021 -9.247 14.303 1.00 0.00 H ATOM 2676 HD22 LEU B 76 6.948 -8.178 13.367 1.00 0.00 H ATOM 2677 HD23 LEU B 76 8.346 -8.948 12.578 1.00 0.00 H ATOM 2678 HD11 LEU B 76 10.922 -6.879 14.206 1.00 0.00 H ATOM 2679 HD12 LEU B 76 10.382 -8.453 14.842 1.00 0.00 H ATOM 2680 HD13 LEU B 76 10.616 -8.233 13.090 1.00 0.00 H ATOM 2681 H LEU B 76 7.320 -4.615 13.720 1.00 0.00 H ATOM 2682 N VAL B 77 6.116 -5.908 17.445 1.00 28.49 N ATOM 2683 CA VAL B 77 5.787 -5.195 18.662 1.00 28.22 C ATOM 2684 C VAL B 77 6.456 -5.905 19.836 1.00 28.27 C ATOM 2685 O VAL B 77 6.306 -7.109 20.027 1.00 28.11 O ATOM 2686 CB VAL B 77 4.258 -5.068 18.855 1.00 28.55 C ATOM 2687 CG1 VAL B 77 3.941 -4.303 20.136 1.00 28.07 C ATOM 2688 CG2 VAL B 77 3.619 -4.361 17.656 1.00 28.42 C ATOM 2689 HA VAL B 77 6.164 -4.174 18.599 1.00 0.00 H ATOM 2690 HB VAL B 77 3.843 -6.073 18.932 1.00 0.00 H ATOM 2691 HG11 VAL B 77 4.363 -4.835 20.989 1.00 0.00 H ATOM 2692 HG12 VAL B 77 4.375 -3.305 20.078 1.00 0.00 H ATOM 2693 HG13 VAL B 77 2.860 -4.225 20.253 1.00 0.00 H ATOM 2694 HG21 VAL B 77 4.046 -3.363 17.554 1.00 0.00 H ATOM 2695 HG22 VAL B 77 3.814 -4.936 16.751 1.00 0.00 H ATOM 2696 HG23 VAL B 77 2.543 -4.283 17.813 1.00 0.00 H ATOM 2697 H VAL B 77 5.914 -6.926 17.377 1.00 0.00 H ATOM 2698 N GLY B 78 7.226 -5.142 20.596 1.00 28.60 N ATOM 2699 CA GLY B 78 7.941 -5.667 21.746 1.00 29.10 C ATOM 2700 C GLY B 78 8.705 -4.577 22.472 1.00 28.99 C ATOM 2701 O GLY B 78 8.662 -3.412 22.059 1.00 29.05 O ATOM 2702 HA3 GLY B 78 8.645 -6.428 21.409 1.00 0.00 H ATOM 2703 HA2 GLY B 78 7.225 -6.116 22.434 1.00 0.00 H ATOM 2704 H GLY B 78 7.322 -4.133 20.362 1.00 0.00 H ATOM 2705 N PRO B 79 9.391 -4.949 23.568 1.00 29.12 N ATOM 2706 CA PRO B 79 10.220 -4.063 24.386 1.00 29.00 C ATOM 2707 C PRO B 79 11.438 -3.553 23.637 1.00 28.97 C ATOM 2708 O PRO B 79 12.561 -3.968 23.908 1.00 28.69 O ATOM 2709 CB PRO B 79 10.659 -4.936 25.568 1.00 29.02 C ATOM 2710 CG PRO B 79 10.118 -6.277 25.348 1.00 29.52 C ATOM 2711 CD PRO B 79 9.327 -6.323 24.097 1.00 29.29 C ATOM 2712 HA PRO B 79 9.666 -3.173 24.685 1.00 0.00 H ATOM 2713 HD3 PRO B 79 9.764 -7.029 23.390 1.00 0.00 H ATOM 2714 HD2 PRO B 79 8.296 -6.609 24.303 1.00 0.00 H ATOM 2715 HG3 PRO B 79 9.477 -6.547 26.187 1.00 0.00 H ATOM 2716 HG2 PRO B 79 10.941 -6.988 25.278 1.00 0.00 H ATOM 2717 HB2 PRO B 79 11.747 -4.977 25.617 1.00 0.00 H ATOM 2718 HB3 PRO B 79 10.269 -4.525 26.499 1.00 0.00 H ATOM 2719 N THR B 80 11.202 -2.663 22.685 1.00 29.47 N ATOM 2720 CA THR B 80 12.292 -2.032 21.963 1.00 29.54 C ATOM 2721 C THR B 80 12.585 -0.692 22.624 1.00 29.27 C ATOM 2722 O THR B 80 11.652 0.049 22.953 1.00 29.70 O ATOM 2723 CB THR B 80 11.980 -1.883 20.455 1.00 29.49 C ATOM 2724 OG1 THR B 80 13.140 -1.383 19.785 1.00 29.77 O ATOM 2725 CG2 THR B 80 10.783 -0.968 20.203 1.00 29.49 C ATOM 2726 HA THR B 80 13.179 -2.664 22.013 1.00 0.00 H ATOM 2727 HB THR B 80 11.716 -2.865 20.062 1.00 0.00 H ATOM 2728 HG1 THR B 80 13.384 -0.502 20.164 1.00 0.00 H ATOM 2729 HG23 THR B 80 9.909 -1.364 20.720 1.00 0.00 H ATOM 2730 HG21 THR B 80 11.006 0.031 20.577 1.00 0.00 H ATOM 2731 HG22 THR B 80 10.582 -0.921 19.133 1.00 0.00 H ATOM 2732 H THR B 80 10.220 -2.412 22.451 1.00 0.00 H ATOM 2733 N PRO B 81 13.875 -0.417 22.896 1.00 29.60 N ATOM 2734 CA PRO B 81 14.399 0.861 23.398 1.00 29.18 C ATOM 2735 C PRO B 81 13.937 2.101 22.659 1.00 28.80 C ATOM 2736 O PRO B 81 13.906 3.185 23.246 1.00 29.76 O ATOM 2737 CB PRO B 81 15.906 0.695 23.225 1.00 29.26 C ATOM 2738 CG PRO B 81 16.123 -0.736 23.482 1.00 29.51 C ATOM 2739 CD PRO B 81 14.950 -1.426 22.821 1.00 29.87 C ATOM 2740 HA PRO B 81 14.047 1.034 24.415 1.00 0.00 H ATOM 2741 HD3 PRO B 81 15.178 -1.678 21.785 1.00 0.00 H ATOM 2742 HD2 PRO B 81 14.674 -2.332 23.361 1.00 0.00 H ATOM 2743 HG3 PRO B 81 16.134 -0.937 24.553 1.00 0.00 H ATOM 2744 HG2 PRO B 81 17.063 -1.068 23.041 1.00 0.00 H ATOM 2745 HB2 PRO B 81 16.215 0.961 22.214 1.00 0.00 H ATOM 2746 HB3 PRO B 81 16.451 1.308 23.943 1.00 0.00 H ATOM 2747 N ALA B 82 13.603 1.952 21.382 1.00 28.00 N ATOM 2748 CA ALA B 82 13.069 3.062 20.607 1.00 27.11 C ATOM 2749 C ALA B 82 12.172 2.540 19.482 1.00 26.13 C ATOM 2750 O ALA B 82 12.371 1.439 18.971 1.00 26.40 O ATOM 2751 CB ALA B 82 14.209 3.915 20.048 1.00 26.94 C ATOM 2752 HA ALA B 82 12.464 3.690 21.260 1.00 0.00 H ATOM 2753 HB1 ALA B 82 14.804 4.309 20.872 1.00 0.00 H ATOM 2754 HB2 ALA B 82 14.839 3.301 19.404 1.00 0.00 H ATOM 2755 HB3 ALA B 82 13.794 4.741 19.471 1.00 0.00 H ATOM 2756 H ALA B 82 13.725 1.025 20.927 1.00 0.00 H ATOM 2757 N ASN B 83 11.155 3.317 19.144 1.00 24.99 N ATOM 2758 CA ASN B 83 10.378 3.063 17.943 1.00 25.01 C ATOM 2759 C ASN B 83 11.265 3.171 16.703 1.00 23.98 C ATOM 2760 O ASN B 83 11.966 4.175 16.515 1.00 23.87 O ATOM 2761 CB ASN B 83 9.220 4.046 17.856 1.00 24.98 C ATOM 2762 CG ASN B 83 8.147 3.769 18.888 1.00 26.94 C ATOM 2763 OD1 ASN B 83 8.011 2.645 19.379 1.00 26.44 O ATOM 2764 ND2 ASN B 83 7.363 4.796 19.210 1.00 28.05 N ATOM 2765 HA ASN B 83 9.976 2.051 17.990 1.00 0.00 H ATOM 2766 HB2 ASN B 83 9.604 5.054 18.012 1.00 0.00 H ATOM 2767 HB3 ASN B 83 8.776 3.977 16.863 1.00 0.00 H ATOM 2768 HD22 ASN B 83 7.516 5.725 18.769 1.00 0.00 H ATOM 2769 HD21 ASN B 83 6.597 4.669 19.902 1.00 0.00 H ATOM 2770 H ASN B 83 10.907 4.125 19.750 1.00 0.00 H ATOM 2771 N ILE B 84 11.237 2.128 15.878 1.00 23.19 N ATOM 2772 CA ILE B 84 12.164 1.977 14.747 1.00 22.72 C ATOM 2773 C ILE B 84 11.397 1.696 13.455 1.00 22.40 C ATOM 2774 O ILE B 84 10.528 0.814 13.419 1.00 22.38 O ATOM 2775 CB ILE B 84 13.156 0.808 14.983 1.00 23.15 C ATOM 2776 CG1 ILE B 84 14.135 1.127 16.119 1.00 23.76 C ATOM 2777 CG2 ILE B 84 13.933 0.472 13.706 1.00 23.50 C ATOM 2778 CD1 ILE B 84 15.212 2.095 15.739 1.00 25.89 C ATOM 2779 HA ILE B 84 12.716 2.913 14.662 1.00 0.00 H ATOM 2780 HB ILE B 84 12.564 -0.061 15.269 1.00 0.00 H ATOM 2781 HG12 ILE B 84 13.571 1.550 16.950 1.00 0.00 H ATOM 2782 HG13 ILE B 84 14.606 0.197 16.438 1.00 0.00 H ATOM 2783 HD11 ILE B 84 15.796 1.683 14.916 1.00 0.00 H ATOM 2784 HD12 ILE B 84 14.759 3.037 15.429 1.00 0.00 H ATOM 2785 HD13 ILE B 84 15.862 2.268 16.596 1.00 0.00 H ATOM 2786 HG21 ILE B 84 13.233 0.181 12.922 1.00 0.00 H ATOM 2787 HG22 ILE B 84 14.497 1.347 13.385 1.00 0.00 H ATOM 2788 HG23 ILE B 84 14.619 -0.351 13.906 1.00 0.00 H ATOM 2789 H ILE B 84 10.527 1.386 16.040 1.00 0.00 H ATOM 2790 N ILE B 85 11.709 2.472 12.414 1.00 21.37 N ATOM 2791 CA ILE B 85 11.300 2.170 11.047 1.00 21.16 C ATOM 2792 C ILE B 85 12.462 1.485 10.319 1.00 21.29 C ATOM 2793 O ILE B 85 13.484 2.115 10.000 1.00 20.78 O ATOM 2794 CB ILE B 85 10.843 3.439 10.278 1.00 20.27 C ATOM 2795 CG1 ILE B 85 9.725 4.175 11.040 1.00 19.59 C ATOM 2796 CG2 ILE B 85 10.358 3.096 8.883 1.00 21.39 C ATOM 2797 CD1 ILE B 85 8.552 3.314 11.452 1.00 19.15 C ATOM 2798 HA ILE B 85 10.439 1.502 11.085 1.00 0.00 H ATOM 2799 HB ILE B 85 11.711 4.093 10.197 1.00 0.00 H ATOM 2800 HG12 ILE B 85 10.159 4.608 11.941 1.00 0.00 H ATOM 2801 HG13 ILE B 85 9.349 4.973 10.400 1.00 0.00 H ATOM 2802 HD11 ILE B 85 8.091 2.882 10.564 1.00 0.00 H ATOM 2803 HD12 ILE B 85 8.901 2.516 12.107 1.00 0.00 H ATOM 2804 HD13 ILE B 85 7.822 3.926 11.981 1.00 0.00 H ATOM 2805 HG21 ILE B 85 11.167 2.625 8.324 1.00 0.00 H ATOM 2806 HG22 ILE B 85 9.514 2.410 8.952 1.00 0.00 H ATOM 2807 HG23 ILE B 85 10.046 4.008 8.374 1.00 0.00 H ATOM 2808 H ILE B 85 12.269 3.331 12.586 1.00 0.00 H ATOM 2809 N GLY B 86 12.281 0.194 10.059 1.00 21.48 N ATOM 2810 CA GLY B 86 13.299 -0.638 9.417 1.00 21.52 C ATOM 2811 C GLY B 86 13.173 -0.667 7.905 1.00 21.77 C ATOM 2812 O GLY B 86 12.306 -0.005 7.321 1.00 21.25 O ATOM 2813 HA3 GLY B 86 13.204 -1.656 9.793 1.00 0.00 H ATOM 2814 HA2 GLY B 86 14.283 -0.246 9.677 1.00 0.00 H ATOM 2815 H GLY B 86 11.376 -0.244 10.324 1.00 0.00 H ATOM 2816 N ARG B 87 14.037 -1.460 7.281 1.00 22.50 N ATOM 2817 CA ARG B 87 14.186 -1.487 5.827 1.00 22.99 C ATOM 2818 C ARG B 87 12.935 -1.950 5.095 1.00 23.40 C ATOM 2819 O ARG B 87 12.666 -1.507 3.984 1.00 24.67 O ATOM 2820 CB ARG B 87 15.368 -2.372 5.416 1.00 22.93 C ATOM 2821 CG ARG B 87 16.712 -1.800 5.792 1.00 23.56 C ATOM 2822 CD ARG B 87 17.859 -2.613 5.231 1.00 23.54 C ATOM 2823 NE ARG B 87 17.892 -3.982 5.742 1.00 24.38 N ATOM 2824 CZ ARG B 87 17.563 -5.076 5.061 1.00 24.27 C ATOM 2825 NH1 ARG B 87 17.135 -5.013 3.809 1.00 25.04 N ATOM 2826 NH2 ARG B 87 17.660 -6.253 5.652 1.00 25.57 N ATOM 2827 HA ARG B 87 14.369 -0.453 5.533 1.00 0.00 H ATOM 2828 HB2 ARG B 87 15.258 -3.341 5.902 1.00 0.00 H ATOM 2829 HB3 ARG B 87 15.340 -2.504 4.334 1.00 0.00 H ATOM 2830 HG2 ARG B 87 16.781 -0.783 5.406 1.00 0.00 H ATOM 2831 HG3 ARG B 87 16.794 -1.781 6.879 1.00 0.00 H ATOM 2832 HD2 ARG B 87 18.795 -2.121 5.494 1.00 0.00 H ATOM 2833 HD3 ARG B 87 17.762 -2.649 4.146 1.00 0.00 H ATOM 2834 HE ARG B 87 18.200 -4.112 6.727 1.00 0.00 H ATOM 2835 HH12 ARG B 87 16.885 -5.885 3.301 1.00 0.00 H ATOM 2836 HH11 ARG B 87 17.049 -4.092 3.334 1.00 0.00 H ATOM 2837 HH22 ARG B 87 17.407 -7.118 5.133 1.00 0.00 H ATOM 2838 HH21 ARG B 87 17.990 -6.315 6.636 1.00 0.00 H ATOM 2839 H ARG B 87 14.635 -2.090 7.853 1.00 0.00 H ATOM 2840 N ASN B 88 12.176 -2.843 5.720 1.00 23.57 N ATOM 2841 CA ASN B 88 10.972 -3.372 5.111 1.00 23.13 C ATOM 2842 C ASN B 88 10.005 -2.253 4.716 1.00 23.16 C ATOM 2843 O ASN B 88 9.291 -2.377 3.725 1.00 24.11 O ATOM 2844 CB ASN B 88 10.293 -4.400 6.031 1.00 22.89 C ATOM 2845 CG ASN B 88 9.534 -3.755 7.190 1.00 23.88 C ATOM 2846 OD1 ASN B 88 10.124 -3.084 8.044 1.00 22.99 O ATOM 2847 ND2 ASN B 88 8.224 -4.003 7.250 1.00 24.82 N ATOM 2848 HA ASN B 88 11.264 -3.887 4.196 1.00 0.00 H ATOM 2849 HB2 ASN B 88 9.590 -4.986 5.439 1.00 0.00 H ATOM 2850 HB3 ASN B 88 11.059 -5.059 6.441 1.00 0.00 H ATOM 2851 HD22 ASN B 88 7.768 -4.573 6.509 1.00 0.00 H ATOM 2852 HD21 ASN B 88 7.659 -3.626 8.038 1.00 0.00 H ATOM 2853 H ASN B 88 12.452 -3.170 6.668 1.00 0.00 H ATOM 2854 N LEU B 89 9.971 -1.171 5.492 1.00 23.41 N ATOM 2855 CA LEU B 89 9.117 -0.025 5.160 1.00 23.27 C ATOM 2856 C LEU B 89 9.879 1.133 4.532 1.00 23.32 C ATOM 2857 O LEU B 89 9.316 1.879 3.736 1.00 23.48 O ATOM 2858 CB LEU B 89 8.338 0.468 6.380 1.00 22.83 C ATOM 2859 CG LEU B 89 7.447 -0.547 7.083 1.00 22.30 C ATOM 2860 CD1 LEU B 89 6.672 0.154 8.201 1.00 21.80 C ATOM 2861 CD2 LEU B 89 6.508 -1.251 6.125 1.00 23.78 C ATOM 2862 HA LEU B 89 8.416 -0.395 4.412 1.00 0.00 H ATOM 2863 HB2 LEU B 89 9.062 0.832 7.109 1.00 0.00 H ATOM 2864 HB3 LEU B 89 7.705 1.294 6.055 1.00 0.00 H ATOM 2865 HG LEU B 89 8.083 -1.323 7.510 1.00 0.00 H ATOM 2866 HD21 LEU B 89 5.865 -0.515 5.642 1.00 0.00 H ATOM 2867 HD22 LEU B 89 7.090 -1.779 5.370 1.00 0.00 H ATOM 2868 HD23 LEU B 89 5.895 -1.964 6.677 1.00 0.00 H ATOM 2869 HD11 LEU B 89 7.375 0.582 8.916 1.00 0.00 H ATOM 2870 HD12 LEU B 89 6.058 0.947 7.774 1.00 0.00 H ATOM 2871 HD13 LEU B 89 6.033 -0.569 8.707 1.00 0.00 H ATOM 2872 H LEU B 89 10.560 -1.138 6.348 1.00 0.00 H ATOM 2873 N LEU B 90 11.151 1.288 4.887 1.00 23.82 N ATOM 2874 CA LEU B 90 11.985 2.345 4.306 1.00 23.85 C ATOM 2875 C LEU B 90 12.091 2.210 2.784 1.00 24.19 C ATOM 2876 O LEU B 90 12.095 3.207 2.055 1.00 23.52 O ATOM 2877 CB LEU B 90 13.378 2.353 4.943 1.00 23.07 C ATOM 2878 CG LEU B 90 13.475 2.800 6.410 1.00 23.67 C ATOM 2879 CD1 LEU B 90 14.914 2.664 6.929 1.00 23.12 C ATOM 2880 CD2 LEU B 90 12.984 4.212 6.570 1.00 23.15 C ATOM 2881 HA LEU B 90 11.500 3.297 4.521 1.00 0.00 H ATOM 2882 HB2 LEU B 90 13.773 1.339 4.882 1.00 0.00 H ATOM 2883 HB3 LEU B 90 14.005 3.022 4.354 1.00 0.00 H ATOM 2884 HG LEU B 90 12.837 2.147 7.005 1.00 0.00 H ATOM 2885 HD21 LEU B 90 13.592 4.878 5.958 1.00 0.00 H ATOM 2886 HD22 LEU B 90 11.943 4.272 6.251 1.00 0.00 H ATOM 2887 HD23 LEU B 90 13.062 4.506 7.617 1.00 0.00 H ATOM 2888 HD11 LEU B 90 15.228 1.623 6.857 1.00 0.00 H ATOM 2889 HD12 LEU B 90 15.576 3.287 6.327 1.00 0.00 H ATOM 2890 HD13 LEU B 90 14.956 2.987 7.969 1.00 0.00 H ATOM 2891 H LEU B 90 11.564 0.645 5.593 1.00 0.00 H ATOM 2892 N THR B 91 12.157 0.971 2.305 1.00 25.13 N ATOM 2893 CA THR B 91 12.180 0.711 0.861 1.00 25.17 C ATOM 2894 C THR B 91 10.883 1.139 0.179 1.00 25.57 C ATOM 2895 O THR B 91 10.893 1.621 -0.955 1.00 25.27 O ATOM 2896 CB THR B 91 12.352 -0.790 0.559 1.00 25.53 C ATOM 2897 OG1 THR B 91 11.422 -1.548 1.346 1.00 27.05 O ATOM 2898 CG2 THR B 91 13.758 -1.254 0.832 1.00 24.75 C ATOM 2899 HA THR B 91 13.022 1.288 0.480 1.00 0.00 H ATOM 2900 HB THR B 91 12.153 -0.948 -0.501 1.00 0.00 H ATOM 2901 HG1 THR B 91 11.593 -1.383 2.307 1.00 0.00 H ATOM 2902 HG23 THR B 91 14.455 -0.672 0.229 1.00 0.00 H ATOM 2903 HG21 THR B 91 13.986 -1.116 1.889 1.00 0.00 H ATOM 2904 HG22 THR B 91 13.847 -2.309 0.575 1.00 0.00 H ATOM 2905 H THR B 91 12.193 0.170 2.967 1.00 0.00 H ATOM 2906 N GLN B 92 9.764 0.906 0.857 1.00 25.97 N ATOM 2907 CA GLN B 92 8.448 1.215 0.314 1.00 26.27 C ATOM 2908 C GLN B 92 8.280 2.711 0.048 1.00 26.16 C ATOM 2909 O GLN B 92 7.635 3.109 -0.925 1.00 26.28 O ATOM 2910 CB GLN B 92 7.348 0.712 1.267 1.00 26.67 C ATOM 2911 CG GLN B 92 7.206 -0.808 1.273 1.00 27.22 C ATOM 2912 CD GLN B 92 6.010 -1.300 2.055 1.00 27.42 C ATOM 2913 OE1 GLN B 92 5.168 -0.521 2.488 1.00 29.37 O ATOM 2914 NE2 GLN B 92 5.915 -2.608 2.216 1.00 29.68 N ATOM 2915 HA GLN B 92 8.355 0.700 -0.642 1.00 0.00 H ATOM 2916 HB2 GLN B 92 7.588 1.042 2.278 1.00 0.00 H ATOM 2917 HB3 GLN B 92 6.397 1.148 0.960 1.00 0.00 H ATOM 2918 HG2 GLN B 92 7.109 -1.150 0.242 1.00 0.00 H ATOM 2919 HG3 GLN B 92 8.106 -1.237 1.713 1.00 0.00 H ATOM 2920 HE22 GLN B 92 6.652 -3.234 1.833 1.00 0.00 H ATOM 2921 HE21 GLN B 92 5.103 -3.012 2.726 1.00 0.00 H ATOM 2922 H GLN B 92 9.830 0.489 1.807 1.00 0.00 H ATOM 2923 N ILE B 93 8.860 3.538 0.912 1.00 26.76 N ATOM 2924 CA ILE B 93 8.739 4.985 0.778 1.00 26.68 C ATOM 2925 C ILE B 93 9.860 5.573 -0.090 1.00 27.19 C ATOM 2926 O ILE B 93 9.918 6.779 -0.280 1.00 26.91 O ATOM 2927 CB ILE B 93 8.631 5.699 2.159 1.00 26.61 C ATOM 2928 CG1 ILE B 93 9.939 5.622 2.961 1.00 26.36 C ATOM 2929 CG2 ILE B 93 7.478 5.085 2.958 1.00 26.95 C ATOM 2930 CD1 ILE B 93 9.935 6.477 4.230 1.00 27.30 C ATOM 2931 HA ILE B 93 7.800 5.176 0.258 1.00 0.00 H ATOM 2932 HB ILE B 93 8.436 6.756 1.976 1.00 0.00 H ATOM 2933 HG12 ILE B 93 10.107 4.584 3.246 1.00 0.00 H ATOM 2934 HG13 ILE B 93 10.755 5.959 2.322 1.00 0.00 H ATOM 2935 HD11 ILE B 93 9.779 7.522 3.962 1.00 0.00 H ATOM 2936 HD12 ILE B 93 9.131 6.146 4.887 1.00 0.00 H ATOM 2937 HD13 ILE B 93 10.892 6.370 4.742 1.00 0.00 H ATOM 2938 HG21 ILE B 93 6.547 5.213 2.407 1.00 0.00 H ATOM 2939 HG22 ILE B 93 7.668 4.023 3.110 1.00 0.00 H ATOM 2940 HG23 ILE B 93 7.401 5.584 3.924 1.00 0.00 H ATOM 2941 H ILE B 93 9.412 3.145 1.701 1.00 0.00 H ATOM 2942 N GLY B 94 10.719 4.711 -0.640 1.00 27.31 N ATOM 2943 CA GLY B 94 11.758 5.137 -1.580 1.00 27.64 C ATOM 2944 C GLY B 94 13.007 5.722 -0.946 1.00 27.93 C ATOM 2945 O GLY B 94 13.724 6.509 -1.569 1.00 27.64 O ATOM 2946 HA3 GLY B 94 11.328 5.893 -2.237 1.00 0.00 H ATOM 2947 HA2 GLY B 94 12.054 4.270 -2.170 1.00 0.00 H ATOM 2948 H GLY B 94 10.648 3.703 -0.392 1.00 0.00 H ATOM 2949 N CYS B 95 13.284 5.309 0.288 1.00 28.77 N ATOM 2950 CA CYS B 95 14.402 5.838 1.060 1.00 28.54 C ATOM 2951 C CYS B 95 15.741 5.232 0.633 1.00 28.46 C ATOM 2952 O CYS B 95 15.887 4.012 0.577 1.00 29.15 O ATOM 2953 CB CYS B 95 14.161 5.582 2.553 1.00 28.62 C ATOM 2954 SG CYS B 95 15.251 6.512 3.634 1.00 30.99 S ATOM 2955 HA CYS B 95 14.459 6.910 0.869 1.00 0.00 H ATOM 2956 HB2 CYS B 95 14.308 4.520 2.748 1.00 0.00 H ATOM 2957 HB3 CYS B 95 13.132 5.854 2.787 1.00 0.00 H ATOM 2958 HG CYS B 95 14.956 6.214 4.949 1.00 0.00 H ATOM 2959 H CYS B 95 12.680 4.580 0.719 1.00 0.00 H ATOM 2960 N THR B 96 16.719 6.094 0.352 1.00 28.48 N ATOM 2961 CA THR B 96 18.101 5.674 0.066 1.00 28.09 C ATOM 2962 C THR B 96 19.142 6.395 0.930 1.00 27.95 C ATOM 2963 O THR B 96 18.898 7.492 1.451 1.00 26.65 O ATOM 2964 CB THR B 96 18.471 5.922 -1.418 1.00 28.24 C ATOM 2965 OG1 THR B 96 18.421 7.327 -1.706 1.00 27.17 O ATOM 2966 CG2 THR B 96 17.523 5.162 -2.353 1.00 28.89 C ATOM 2967 HA THR B 96 18.125 4.609 0.298 1.00 0.00 H ATOM 2968 HB THR B 96 19.484 5.555 -1.585 1.00 0.00 H ATOM 2969 HG1 THR B 96 17.506 7.665 -1.536 1.00 0.00 H ATOM 2970 HG23 THR B 96 17.568 4.097 -2.127 1.00 0.00 H ATOM 2971 HG21 THR B 96 16.505 5.523 -2.208 1.00 0.00 H ATOM 2972 HG22 THR B 96 17.824 5.328 -3.387 1.00 0.00 H ATOM 2973 H THR B 96 16.495 7.109 0.334 1.00 0.00 H ATOM 2974 N LEU B 97 20.309 5.765 1.068 1.00 27.68 N ATOM 2975 CA LEU B 97 21.486 6.417 1.639 1.00 28.48 C ATOM 2976 C LEU B 97 22.326 6.983 0.513 1.00 28.11 C ATOM 2977 O LEU B 97 22.554 6.320 -0.492 1.00 28.43 O ATOM 2978 CB LEU B 97 22.340 5.438 2.451 1.00 28.74 C ATOM 2979 CG LEU B 97 21.763 4.971 3.787 1.00 28.80 C ATOM 2980 CD1 LEU B 97 22.589 3.810 4.316 1.00 29.80 C ATOM 2981 CD2 LEU B 97 21.743 6.110 4.780 1.00 28.62 C ATOM 2982 HA LEU B 97 21.146 7.206 2.309 1.00 0.00 H ATOM 2983 HB2 LEU B 97 22.506 4.554 1.835 1.00 0.00 H ATOM 2984 HB3 LEU B 97 23.295 5.922 2.654 1.00 0.00 H ATOM 2985 HG LEU B 97 20.736 4.637 3.639 1.00 0.00 H ATOM 2986 HD21 LEU B 97 22.760 6.470 4.938 1.00 0.00 H ATOM 2987 HD22 LEU B 97 21.126 6.920 4.390 1.00 0.00 H ATOM 2988 HD23 LEU B 97 21.329 5.759 5.725 1.00 0.00 H ATOM 2989 HD11 LEU B 97 22.560 2.989 3.600 1.00 0.00 H ATOM 2990 HD12 LEU B 97 23.620 4.134 4.458 1.00 0.00 H ATOM 2991 HD13 LEU B 97 22.177 3.477 5.269 1.00 0.00 H ATOM 2992 H LEU B 97 20.384 4.775 0.759 1.00 0.00 H ATOM 2993 N ASN B 98 22.822 8.194 0.711 1.00 28.37 N ATOM 2994 CA ASN B 98 23.534 8.918 -0.329 1.00 28.07 C ATOM 2995 C ASN B 98 24.769 9.591 0.246 1.00 28.51 C ATOM 2996 O ASN B 98 24.669 10.355 1.205 1.00 28.12 O ATOM 2997 CB ASN B 98 22.612 9.974 -0.945 1.00 28.40 C ATOM 2998 CG ASN B 98 21.436 9.356 -1.686 1.00 27.53 C ATOM 2999 OD1 ASN B 98 20.356 9.198 -1.133 1.00 28.68 O ATOM 3000 ND2 ASN B 98 21.672 8.940 -2.916 1.00 25.12 N ATOM 3001 HA ASN B 98 23.845 8.212 -1.099 1.00 0.00 H ATOM 3002 HB2 ASN B 98 22.228 10.612 -0.149 1.00 0.00 H ATOM 3003 HB3 ASN B 98 23.189 10.577 -1.645 1.00 0.00 H ATOM 3004 HD22 ASN B 98 22.605 9.095 -3.347 1.00 0.00 H ATOM 3005 HD21 ASN B 98 20.925 8.457 -3.454 1.00 0.00 H ATOM 3006 H ASN B 98 22.698 8.642 1.641 1.00 0.00 H ATOM 3007 N PHE B 99 25.924 9.307 -0.353 1.00 28.50 N ATOM 3008 CA PHE B 99 27.174 9.972 0.010 1.00 29.07 C ATOM 3009 C PHE B 99 28.186 9.943 -1.139 1.00 29.31 C ATOM 3010 O PHE B 99 29.315 10.406 -0.980 1.00 29.10 O ATOM 3011 CB PHE B 99 27.765 9.383 1.306 1.00 28.75 C ATOM 3012 CG PHE B 99 28.172 7.936 1.209 1.00 28.68 C ATOM 3013 CD1 PHE B 99 27.238 6.923 1.356 1.00 27.89 C ATOM 3014 CD2 PHE B 99 29.505 7.588 1.017 1.00 29.97 C ATOM 3015 CE1 PHE B 99 27.620 5.590 1.281 1.00 28.01 C ATOM 3016 CE2 PHE B 99 29.892 6.258 0.938 1.00 28.57 C ATOM 3017 CZ PHE B 99 28.943 5.259 1.070 1.00 28.57 C ATOM 3018 HA PHE B 99 26.943 11.020 0.203 1.00 0.00 H ATOM 3019 OXT PHE B 99 27.891 9.493 -2.256 1.00 29.51 O ATOM 3020 HB2 PHE B 99 28.645 9.967 1.574 1.00 0.00 H ATOM 3021 HB3 PHE B 99 27.017 9.474 2.093 1.00 0.00 H ATOM 3022 HD2 PHE B 99 30.257 8.372 0.927 1.00 0.00 H ATOM 3023 HE2 PHE B 99 30.938 6.001 0.773 1.00 0.00 H ATOM 3024 HZ PHE B 99 29.240 4.212 1.007 1.00 0.00 H ATOM 3025 HE1 PHE B 99 26.873 4.803 1.389 1.00 0.00 H ATOM 3026 HD1 PHE B 99 26.192 7.175 1.532 1.00 0.00 H ATOM 3027 H PHE B 99 25.937 8.588 -1.104 1.00 0.00 H TER 3028 PHE B 99 HETATM 3029 O HOH 1 37.174 1.520 1.871 1.00 33.59 O HETATM 3030 O HOH 2 31.861 -1.836 -0.532 1.00 26.40 O HETATM 3031 O HOH 3 34.175 -8.678 8.194 1.00 27.17 O HETATM 3032 O HOH 4 35.735 0.149 0.574 1.00 30.19 O HETATM 3033 O HOH 5 31.727 5.547 17.996 1.00 16.41 O HETATM 3034 O HOH 6 20.479 7.594 15.075 1.00 21.12 O HETATM 3035 O HOH 7 20.039 6.295 17.715 1.00 17.88 O HETATM 3036 O HOH 8 24.985 -7.049 9.432 1.00 24.54 O HETATM 3037 O HOH 9 30.893 -10.506 18.165 1.00 26.31 O HETATM 3038 O HOH 10 33.601 10.279 16.287 1.00 21.96 O HETATM 3039 O HOH 11 25.107 -9.099 7.925 1.00 42.76 O HETATM 3040 O HOH 12 37.368 10.566 18.217 1.00 26.88 O HETATM 3041 O HOH 13 18.365 10.914 -4.009 1.00 36.34 O HETATM 3042 O HOH 14 26.921 14.861 7.101 1.00 45.68 O HETATM 3043 O HOH 15 33.435 -9.744 18.933 1.00 22.69 O HETATM 3044 O HOH 16 19.479 -2.801 -1.909 1.00 31.63 O HETATM 3045 O HOH 17 41.714 6.600 22.214 1.00 30.36 O HETATM 3046 O HOH 18 30.972 7.549 19.186 1.00 36.95 O HETATM 3047 O HOH 19 36.284 -4.503 27.261 1.00 47.62 O HETATM 3048 O HOH 20 44.180 1.717 7.375 1.00 30.70 O HETATM 3049 O HOH 21 35.966 -5.050 23.610 1.00 38.67 O HETATM 3050 O HOH 22 46.659 -5.079 9.169 1.00 43.82 O HETATM 3051 O HOH 23 45.284 -0.723 22.697 1.00 37.06 O HETATM 3052 O HOH 24 44.392 10.394 14.376 1.00 33.12 O HETATM 3053 O HOH 25 31.945 8.194 22.078 1.00 34.28 O HETATM 3054 O HOH 26 27.559 9.415 20.885 1.00 38.79 O HETATM 3055 O HOH 27 10.367 8.546 -2.413 1.00 33.13 O HETATM 3056 O HOH 28 32.590 11.983 14.753 1.00 23.13 O HETATM 3057 O HOH 29 16.261 -4.094 26.424 1.00 39.04 O HETATM 3058 O HOH 30 19.383 -1.455 28.041 1.00 35.57 O HETATM 3059 O HOH 31 17.223 0.509 27.115 1.00 47.22 O HETATM 3060 O HOH 32 31.910 8.087 -4.210 1.00 46.44 O HETATM 3061 O HOH 33 37.723 11.364 1.320 1.00 33.92 O HETATM 3062 O HOH 34 40.855 8.356 7.246 1.00 32.53 O HETATM 3063 O HOH 35 28.472 13.979 13.965 1.00 32.83 O HETATM 3064 O HOH 36 29.250 11.885 17.595 1.00 37.26 O HETATM 3065 O HOH 37 38.451 12.627 20.579 1.00 41.57 O HETATM 3066 O HOH 38 20.468 -2.741 19.168 1.00 40.69 O HETATM 3067 O HOH 39 24.625 7.416 22.743 1.00 37.80 O HETATM 3068 O HOH 40 26.743 6.012 24.379 1.00 44.22 O HETATM 3069 O HOH 41 25.336 11.874 19.513 1.00 50.80 O HETATM 3070 O HOH 42 31.403 10.269 18.980 1.00 42.02 O HETATM 3071 O HOH 43 26.577 12.599 15.084 1.00 37.82 O HETATM 3072 O HOH 44 26.737 10.384 17.191 1.00 44.17 O HETATM 3073 O HOH 45 33.581 11.997 2.222 1.00 34.65 O HETATM 3074 O HOH 46 32.641 16.342 5.928 1.00 40.84 O HETATM 3075 O HOH 47 26.812 -8.953 23.220 1.00 50.69 O HETATM 3076 O HOH 48 21.515 -9.323 11.771 1.00 39.88 O HETATM 3077 O HOH 49 27.363 -5.915 9.468 1.00 34.56 O HETATM 3078 O HOH 50 21.830 -1.977 0.493 1.00 27.56 O HETATM 3079 O HOH 51 36.095 -7.108 3.872 1.00 33.28 O HETATM 3080 O HOH 52 34.996 -7.905 12.011 1.00 31.81 O HETATM 3081 O HOH 53 30.461 4.520 29.763 1.00 29.02 O HETATM 3082 O HOH 54 41.758 6.119 6.209 1.00 30.91 O HETATM 3083 O HOH 55 25.593 1.612 -4.390 1.00 39.57 O HETATM 3084 O HOH 56 35.993 -6.063 13.965 1.00 30.94 O HETATM 3085 O HOH 57 35.316 12.030 4.335 1.00 36.02 O HETATM 3086 O HOH 58 24.493 13.238 0.799 1.00 31.77 O HETATM 3087 O HOH 59 15.362 -1.566 26.846 1.00 40.10 O HETATM 3088 O HOH 60 29.192 -6.490 27.897 1.00 33.91 O HETATM 3089 O HOH 61 24.243 3.559 24.177 1.00 38.19 O HETATM 3090 O HOH 62 15.705 1.536 -0.839 1.00 20.46 O HETATM 3091 O HOH 63 42.306 1.023 29.093 1.00 41.78 O HETATM 3092 O HOH 64 22.838 -6.359 27.137 1.00 34.71 O HETATM 3093 O HOH 65 38.984 13.239 14.369 1.00 24.41 O HETATM 3094 O HOH 66 43.227 3.003 11.164 1.00 34.17 O HETATM 3095 O HOH 67 24.076 -2.496 -0.645 1.00 40.02 O HETATM 3096 O HOH 68 47.190 -6.574 11.237 1.00 46.50 O HETATM 3097 O HOH 69 30.013 -8.057 11.219 1.00 29.33 O HETATM 3098 O HOH 70 30.582 13.650 15.470 1.00 33.41 O HETATM 3099 O HOH 71 29.320 8.559 -6.504 1.00 57.82 O HETATM 3100 O HOH 72 30.368 10.800 -3.266 1.00 38.86 O HETATM 3101 O HOH 73 -5.834 4.685 2.003 1.00 53.39 O HETATM 3102 O HOH 74 22.511 -6.883 10.347 1.00 30.76 O HETATM 3103 O HOH 75 21.726 -12.465 25.580 1.00 42.67 O HETATM 3104 O HOH 76 -0.573 -4.153 0.475 1.00 46.56 O HETATM 3105 O HOH 77 14.596 18.202 2.332 1.00 37.99 O HETATM 3106 O HOH 78 17.425 -7.794 14.323 1.00 27.33 O HETATM 3107 O HOH 79 14.131 -5.826 25.297 1.00 33.81 O HETATM 3108 O HOH 80 12.259 -9.838 25.051 1.00 29.46 O HETATM 3109 O HOH 81 -5.002 9.201 1.107 1.00 45.59 O HETATM 3110 O HOH 82 20.253 -9.991 27.086 1.00 42.57 O HETATM 3111 O HOH 83 10.019 -10.428 26.934 1.00 33.46 O HETATM 3112 O HOH 84 19.728 -3.440 7.671 1.00 25.34 O HETATM 3113 O HOH 85 8.733 -5.629 10.486 1.00 37.22 O HETATM 3114 O HOH 86 0.492 -8.428 23.826 1.00 42.63 O HETATM 3115 O HOH 87 7.846 14.514 0.689 1.00 43.00 O HETATM 3116 O HOH 88 16.172 15.241 -1.154 1.00 44.31 O HETATM 3117 O HOH 89 12.507 7.362 -3.728 1.00 34.73 O HETATM 3118 O HOH 90 -1.716 5.318 8.423 1.00 39.62 O HETATM 3119 O HOH 91 15.909 7.877 -2.450 1.00 29.12 O HETATM 3120 O HOH 92 -2.663 3.776 9.882 1.00 35.48 O HETATM 3121 O HOH 93 24.335 13.987 7.545 1.00 24.61 O HETATM 3122 O HOH 94 7.898 -4.053 2.383 1.00 42.70 O HETATM 3123 O HOH 95 21.746 13.233 19.027 1.00 38.97 O HETATM 3124 O HOH 96 18.197 17.332 7.826 1.00 30.19 O HETATM 3125 O HOH 97 19.509 13.448 18.663 1.00 33.06 O HETATM 3126 O HOH 98 6.453 4.349 26.290 1.00 34.21 O HETATM 3127 O HOH 99 18.067 -6.044 11.871 1.00 38.71 O HETATM 3128 O HOH 100 5.941 4.134 21.835 1.00 30.14 O HETATM 3129 O HOH 101 18.558 13.736 11.757 1.00 28.33 O HETATM 3130 O HOH 102 20.385 -5.400 10.167 1.00 24.17 O HETATM 3131 O HOH 103 -2.970 1.103 10.794 1.00 40.46 O HETATM 3132 O HOH 104 10.614 -12.731 27.598 1.00 45.27 O HETATM 3133 O HOH 105 17.156 -11.518 14.301 1.00 34.92 O HETATM 3134 O HOH 106 17.232 -9.669 26.904 1.00 35.36 O HETATM 3135 O HOH 107 20.112 18.819 3.865 1.00 30.99 O HETATM 3136 O HOH 108 4.051 9.888 -1.036 1.00 44.62 O HETATM 3137 O HOH 109 -0.507 11.619 10.207 1.00 60.88 O HETATM 3138 O HOH 110 9.088 -7.946 6.950 1.00 42.20 O HETATM 3139 O HOH 111 16.456 14.860 11.923 1.00 33.97 O HETATM 3140 O HOH 112 18.763 7.732 25.766 1.00 55.84 O HETATM 3141 O HOH 113 10.442 3.766 23.637 1.00 48.98 O HETATM 3142 O HOH 114 28.902 13.928 -3.150 1.00 39.72 O HETATM 3143 O HOH 115 7.671 15.263 4.066 1.00 52.48 O HETATM 3144 O HOH 116 16.021 -8.330 3.585 1.00 49.74 O HETATM 3145 O HOH 117 13.886 -6.290 5.383 1.00 31.75 O HETATM 3146 O HOH 118 17.707 19.515 0.633 1.00 50.21 O HETATM 3147 O HOH 119 30.046 12.492 0.267 1.00 30.93 O HETATM 3148 O HOH 120 -4.597 -11.028 20.790 1.00 53.33 O HETATM 3149 O HOH 121 3.184 -7.780 5.976 1.00 41.16 O HETATM 3150 O HOH 122 3.610 11.085 9.168 1.00 46.93 O HETATM 3151 O HOH 123 9.649 -10.190 10.528 1.00 40.73 O HETATM 3152 O HOH 124 20.362 16.350 11.515 1.00 27.27 O HETATM 3153 O HOH 125 13.360 -8.315 11.712 1.00 38.45 O HETATM 3154 C1 UNN A 126 22.350 -3.835 14.251 1.00 -0.06 C HETATM 3155 C2 UNN A 126 21.463 -5.069 14.125 1.00 -0.04 C HETATM 3156 C3 UNN A 126 22.237 -6.367 14.327 1.00 -0.05 C HETATM 3157 C4 UNN A 126 23.071 -6.354 15.604 1.00 -0.05 C HETATM 3158 C5 UNN A 126 23.990 -5.134 15.643 1.00 -0.05 C HETATM 3159 C6 UNN A 126 23.183 -3.842 15.534 1.00 -0.05 C HETATM 3160 H UNN A 126 22.513 -3.770 16.391 1.00 0.03 H HETATM 3161 H UNN A 126 23.871 -2.997 15.514 1.00 0.03 H HETATM 3162 H UNN A 126 24.681 -5.188 14.802 1.00 0.03 H HETATM 3163 H UNN A 126 24.530 -5.132 16.590 1.00 0.03 H HETATM 3164 H UNN A 126 23.684 -7.255 15.632 1.00 0.03 H HETATM 3165 H UNN A 126 22.399 -6.314 16.461 1.00 0.03 H HETATM 3166 H UNN A 126 22.915 -6.490 13.483 1.00 0.03 H HETATM 3167 H UNN A 126 21.516 -7.181 14.403 1.00 0.03 H HETATM 3168 C9 UNN A 126 20.304 -4.976 15.111 1.00 -0.05 C HETATM 3169 C8 UNN A 126 19.554 -3.654 15.082 1.00 -0.01 C HETATM 3170 N7 UNN A 126 20.481 -2.526 15.170 1.00 0.42 N HETATM 3171 C10 UNN A 126 21.499 -2.573 14.122 1.00 -0.11 C HETATM 3172 H UNN A 126 21.004 -2.580 13.151 1.00 0.00 H HETATM 3173 H UNN A 126 22.145 -1.701 14.220 1.00 0.00 H HETATM 3174 C18 UNN A 126 19.705 -1.294 14.945 1.00 -0.08 C HETATM 3175 C19 UNN A 126 20.396 -0.051 15.503 1.00 0.06 C HETATM 3176 C20 UNN A 126 19.933 0.325 16.914 1.00 0.08 C HETATM 3177 N22 UNN A 126 20.844 1.307 17.483 1.00 -0.28 N HETATM 3178 C24 UNN A 126 21.605 1.070 18.543 1.00 0.22 C HETATM 3179 O25 UNN A 126 21.715 -0.032 19.059 1.00 -0.38 O HETATM 3180 C29 UNN A 126 22.386 2.192 19.144 1.00 0.07 C HETATM 3181 C30 UNN A 126 21.746 3.334 19.619 1.00 -0.03 C HETATM 3182 C31 UNN A 126 22.461 4.382 20.202 1.00 -0.05 C HETATM 3183 C32 UNN A 126 23.849 4.333 20.341 1.00 -0.01 C HETATM 3184 C33 UNN A 126 24.560 3.234 19.880 1.00 0.12 C HETATM 3185 C34 UNN A 126 23.858 2.100 19.251 1.00 0.08 C HETATM 3186 C39 UNN A 126 24.690 0.936 18.784 1.00 -0.03 C HETATM 3187 H UNN A 126 24.382 0.035 19.315 1.00 0.03 H HETATM 3188 H UNN A 126 24.546 0.795 17.713 1.00 0.03 H HETATM 3189 H UNN A 126 25.742 1.138 18.987 1.00 0.03 H HETATM 3190 H UNN A 126 23.402 1.311 18.652 1.00 0.07 H HETATM 3191 O38 UNN A 126 25.867 3.139 19.978 1.00 -0.40 O HETATM 3192 H UNN A 126 24.377 5.161 20.814 1.00 0.06 H HETATM 3193 H UNN A 126 21.922 5.260 20.557 1.00 0.07 H HETATM 3194 H UNN A 126 20.662 3.412 19.534 1.00 0.06 H HETATM 3195 H UNN A 126 20.900 2.226 17.044 1.00 0.18 H HETATM 3196 C23 UNN A 126 18.514 0.880 16.964 1.00 0.03 C HETATM 3197 S74 UNN A 126 17.721 0.415 18.473 1.00 -0.10 S HETATM 3198 C77 UNN A 126 18.140 1.622 19.582 1.00 0.02 C HETATM 3199 C78 UNN A 126 17.771 2.942 19.351 1.00 -0.05 C HETATM 3200 C79 UNN A 126 18.090 3.933 20.285 1.00 -0.07 C HETATM 3201 C80 UNN A 126 18.801 3.595 21.437 1.00 -0.07 C HETATM 3202 C81 UNN A 126 19.186 2.269 21.658 1.00 -0.07 C HETATM 3203 C82 UNN A 126 18.851 1.283 20.735 1.00 -0.05 C HETATM 3204 H UNN A 126 19.143 0.248 20.912 1.00 0.06 H HETATM 3205 H UNN A 126 19.749 2.007 22.554 1.00 0.06 H HETATM 3206 H UNN A 126 19.056 4.365 22.165 1.00 0.06 H HETATM 3207 H UNN A 126 17.784 4.965 20.114 1.00 0.06 H HETATM 3208 H UNN A 126 17.232 3.205 18.441 1.00 0.06 H HETATM 3209 H UNN A 126 17.946 0.476 16.126 1.00 0.04 H HETATM 3210 H UNN A 126 18.557 1.968 16.907 1.00 0.04 H HETATM 3211 H UNN A 126 19.936 -0.599 17.493 1.00 0.06 H HETATM 3212 O21 UNN A 126 20.135 1.001 14.571 1.00 -0.39 O HETATM 3213 H UNN A 126 19.192 1.178 14.546 1.00 0.21 H HETATM 3214 H UNN A 126 21.463 -0.242 15.613 1.00 0.06 H HETATM 3215 H UNN A 126 18.749 -1.403 15.457 1.00 0.00 H HETATM 3216 H UNN A 126 19.594 -1.160 13.869 1.00 0.00 H HETATM 3217 C11 UNN A 126 18.609 -3.628 16.258 1.00 0.16 C HETATM 3218 N12 UNN A 126 17.415 -4.157 16.061 1.00 -0.28 N HETATM 3219 C13 UNN A 126 16.217 -3.813 16.812 1.00 0.04 C HETATM 3220 C14 UNN A 126 15.436 -2.814 15.947 1.00 -0.04 C HETATM 3221 H UNN A 126 16.051 -1.933 15.767 1.00 0.03 H HETATM 3222 H UNN A 126 15.181 -3.281 14.996 1.00 0.03 H HETATM 3223 H UNN A 126 14.523 -2.522 16.466 1.00 0.03 H HETATM 3224 C15 UNN A 126 16.478 -3.194 18.196 1.00 -0.04 C HETATM 3225 H UNN A 126 17.041 -3.899 18.808 1.00 0.03 H HETATM 3226 H UNN A 126 17.051 -2.274 18.079 1.00 0.03 H HETATM 3227 H UNN A 126 15.526 -2.972 18.679 1.00 0.03 H HETATM 3228 C16 UNN A 126 15.442 -5.114 16.999 1.00 -0.04 C HETATM 3229 H UNN A 126 15.188 -5.527 16.023 1.00 0.03 H HETATM 3230 H UNN A 126 16.058 -5.827 17.548 1.00 0.03 H HETATM 3231 H UNN A 126 14.529 -4.914 17.559 1.00 0.03 H HETATM 3232 H UNN A 126 17.326 -4.860 15.327 1.00 0.19 H HETATM 3233 O17 UNN A 126 18.958 -3.152 17.326 1.00 -0.40 O HETATM 3234 H UNN A 126 19.007 -3.565 14.144 1.00 0.03 H HETATM 3235 H UNN A 126 20.727 -5.080 16.110 1.00 0.03 H HETATM 3236 H UNN A 126 19.590 -5.753 14.838 1.00 0.03 H HETATM 3237 H UNN A 126 21.074 -5.091 13.107 1.00 0.03 H HETATM 3238 H UNN A 126 23.072 -3.850 13.435 1.00 0.03 H CONECT 3154 3155 3159 3171 3238 CONECT 3155 3154 3156 3168 3237 CONECT 3156 3155 3157 3166 3167 CONECT 3157 3156 3158 3164 3165 CONECT 3158 3157 3159 3162 3163 CONECT 3159 3154 3158 3160 3161 CONECT 3160 3159 CONECT 3161 3159 CONECT 3162 3158 CONECT 3163 3158 CONECT 3164 3157 CONECT 3165 3157 CONECT 3166 3156 CONECT 3167 3156 CONECT 3168 3155 3169 3235 3236 CONECT 3169 3168 3170 3217 3234 CONECT 3170 3169 3171 3174 CONECT 3171 3154 3170 3172 3173 CONECT 3172 3171 CONECT 3173 3171 CONECT 3174 3170 3175 3215 3216 CONECT 3175 3174 3176 3212 3214 CONECT 3176 3175 3177 3196 3211 CONECT 3177 3176 3178 3195 CONECT 3178 3177 3179 3180 CONECT 3179 3178 CONECT 3180 3178 3181 3185 CONECT 3181 3180 3182 3194 CONECT 3182 3181 3183 3193 CONECT 3183 3182 3184 3192 CONECT 3184 3183 3185 3191 CONECT 3185 3180 3184 3186 3190 CONECT 3186 3185 3187 3188 3189 CONECT 3187 3186 CONECT 3188 3186 CONECT 3189 3186 CONECT 3190 3185 CONECT 3191 3184 CONECT 3192 3183 CONECT 3193 3182 CONECT 3194 3181 CONECT 3195 3177 CONECT 3196 3176 3197 3209 3210 CONECT 3197 3196 3198 CONECT 3198 3197 3199 3203 CONECT 3199 3198 3200 3208 CONECT 3200 3199 3201 3207 CONECT 3201 3200 3202 3206 CONECT 3202 3201 3203 3205 CONECT 3203 3198 3202 3204 CONECT 3204 3203 CONECT 3205 3202 CONECT 3206 3201 CONECT 3207 3200 CONECT 3208 3199 CONECT 3209 3196 CONECT 3210 3196 CONECT 3211 3176 CONECT 3212 3175 3213 CONECT 3213 3212 CONECT 3214 3175 CONECT 3215 3174 CONECT 3216 3174 CONECT 3217 3169 3218 3233 CONECT 3218 3217 3219 3232 CONECT 3219 3218 3220 3224 3228 CONECT 3220 3219 3221 3222 3223 CONECT 3221 3220 CONECT 3222 3220 CONECT 3223 3220 CONECT 3224 3219 3225 3226 3227 CONECT 3225 3224 CONECT 3226 3224 CONECT 3227 3224 CONECT 3228 3219 3229 3230 3231 CONECT 3229 3228 CONECT 3230 3228 CONECT 3231 3228 CONECT 3232 3218 CONECT 3233 3217 CONECT 3234 3169 CONECT 3235 3168 CONECT 3236 3168 CONECT 3237 3155 CONECT 3238 3154 MASTER 0 0 0 0 0 0 0 0 3236 2 85 16 END
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Related entries of code: 3el0
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Protein Sequence Similarity
1eby
RCSB PDB
PDBbind
99aa, >1EBY_1|Chains... at 90%
1hxw
RCSB PDB
PDBbind
99aa, >1HXW_1|Chains... at 90%
1izh
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PDBbind
99aa, >1IZH_1|Chains... at 90%
1k6c
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PDBbind
99aa, >1K6C_1|Chains... at 91%
1k6p
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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%
3el4
RCSB PDB
PDBbind
99aa, >3EL4_1|Chains... at 92%
3el5
RCSB PDB
PDBbind
99aa, >3EL5_1|Chains... at 91%
3kfn
RCSB PDB
PDBbind
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3m9f
RCSB PDB
PDBbind
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3tlh
RCSB PDB
PDBbind
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4eqj
RCSB PDB
PDBbind
203aa, >4EQJ_1|Chain... *
4ll3
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PDBbind
99aa, >4LL3_1|Chains... at 90%
4phv
RCSB PDB
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99aa, >4PHV_1|Chains... at 90%
5hvp
RCSB PDB
PDBbind
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5ivs
RCSB PDB
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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
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99aa, >6DGZ_1|Chains... at 91%
6dh0
RCSB PDB
PDBbind
99aa, >6DH0_1|Chains... at 90%
6dh1
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PDBbind
99aa, >6DH1_1|Chains... at 90%
6dh2
RCSB PDB
PDBbind
99aa, >6DH2_1|Chains... at 90%
6dh3
RCSB PDB
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6dh4
RCSB PDB
PDBbind
99aa, >6DH4_1|Chains... at 90%
6dh5
RCSB PDB
PDBbind
99aa, >6DH5_1|Chains... at 90%
6dh6
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PDBbind
99aa, >6DH6_1|Chains... at 90%
6dh7
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PDBbind
99aa, >6DH7_1|Chains... at 90%
6dh8
RCSB PDB
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99aa, >6DH8_1|Chains... at 90%
9hvp
RCSB PDB
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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
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1ohr
RCSB PDB
PDBbind
1UN
2pym
RCSB PDB
PDBbind
1UN
2pyn
RCSB PDB
PDBbind
1UN
2q63
RCSB PDB
PDBbind
1UN
2q64
RCSB PDB
PDBbind
1UN
2r5q
RCSB PDB
PDBbind
1UN
3ekx
RCSB PDB
PDBbind
1UN
3el5
RCSB PDB
PDBbind
1UN
Entry Information
PDB ID
3el0
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Protease(Q7K/L10I/G48V/I54V/V64I/V82A)
Ligand Name
1UN
EC.Number
E.C.3.4.23.16
Resolution
2(Å)
Affinity (Kd/Ki/IC50)
Kd=34.1nM
Release Year
2009
Protein/NA Sequence
Check fasta file
Primary Reference
(2012) Acs Chem.Biol. Vol. 7: pp. 1536-1546
Ligand Properties
Formula
C
3
2
H
4
6
N
3
O
4
S
Molecular Weight
568.790
Exact Mass
568.321
No. of atoms
86
No. of bonds
89
Polar Surface Area
125.24
LOGP Value
5.06 (
Computed with XLOGP3
)
5.06 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 13
No. of Nitrogen and Oxygen Atoms: 7
No. of Rings: 4
Canonical SMILES
O[C@@H]([C@@H](NC(=O)C1=CC=CC(=O)[C@H]1C)CSc1ccccc1)C[N@@H+]1C[C@H]2CCCC[C@H]2C[C@H]1C(=O)NC(C)(C)C
InChI String
InChI=1S/C32H45N3O4S/c1-21-25(15-10-16-28(21)36)30(38)33-26(20-40-24-13-6-5-7-14-24)29(37)19-35-18-23-12-9-8-11-22(23)17-27(35)31(39)34-32(2,3)4/h5-7,10,13-16,21-23,26-27,29,37H,8-9,11-12,17-20H2,1-4H3,(H,33,38)(H,34,39)/p+1/t21?,22-,23+,26-,27-,29+/m0/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):
P03369
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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