Browse entries in the PDBbind-CN Database
HEADER 4PHV_COMPLEX COMPND 4PHV_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 99 PRO GLN ILE THR LEU TRP GLN ARG PRO LEU VAL THR ILE SEQRES 2 A 99 LYS ILE GLY GLY GLN LEU LYS GLU ALA LEU LEU ASP THR SEQRES 3 A 99 GLY ALA ASP ASP THR VAL LEU GLU GLU MET ASN LEU PRO SEQRES 4 A 99 GLY ARG TRP LYS PRO LYS MET ILE GLY GLY ILE GLY GLY SEQRES 5 A 99 PHE ILE LYS VAL ARG GLN TYR ASP GLN ILE LEU ILE GLU SEQRES 6 A 99 ILE CYS GLY HIS LYS ALA ILE GLY THR VAL LEU VAL GLY SEQRES 7 A 99 PRO THR PRO VAL ASN ILE ILE GLY ARG ASN LEU LEU THR SEQRES 8 A 99 GLN ILE GLY CYS THR LEU ASN PHE SEQRES 1 B 99 PRO GLN ILE THR LEU TRP GLN ARG PRO LEU VAL THR ILE SEQRES 2 B 99 LYS ILE GLY GLY GLN LEU LYS GLU ALA LEU LEU ASP THR SEQRES 3 B 99 GLY ALA ASP ASP THR VAL LEU GLU GLU MET ASN LEU PRO SEQRES 4 B 99 GLY ARG TRP LYS PRO LYS MET ILE GLY GLY ILE GLY GLY SEQRES 5 B 99 PHE ILE LYS VAL ARG GLN TYR ASP GLN ILE LEU ILE GLU SEQRES 6 B 99 ILE CYS GLY HIS LYS ALA ILE GLY THR VAL LEU VAL GLY SEQRES 7 B 99 PRO THR PRO VAL ASN ILE ILE GLY ARG ASN LEU LEU THR SEQRES 8 B 99 GLN ILE GLY CYS THR LEU ASN PHE HET VAC A 303 88 ATOM 1 N PRO A 1 29.063 40.166 5.396 1.00 26.31 N ATOM 2 CA PRO A 1 29.946 39.095 4.948 1.00 26.52 C ATOM 3 C PRO A 1 29.368 38.358 3.732 1.00 25.68 C ATOM 4 O PRO A 1 28.195 38.539 3.436 1.00 25.58 O ATOM 5 CB PRO A 1 30.056 38.149 6.144 1.00 26.80 C ATOM 6 CG PRO A 1 28.875 38.429 7.014 1.00 27.03 C ATOM 7 CD PRO A 1 28.377 39.833 6.632 1.00 27.16 C ATOM 8 HA PRO A 1 30.914 39.483 4.632 1.00 0.00 H ATOM 9 HD3 PRO A 1 27.298 39.826 6.479 1.00 0.00 H ATOM 10 HD2 PRO A 1 28.627 40.552 7.412 1.00 0.00 H ATOM 11 HG3 PRO A 1 29.166 38.405 8.064 1.00 0.00 H ATOM 12 HG2 PRO A 1 28.093 37.690 6.838 1.00 0.00 H ATOM 13 HB2 PRO A 1 30.039 37.112 5.808 1.00 0.00 H ATOM 14 HB3 PRO A 1 30.980 38.338 6.690 1.00 0.00 H ATOM 15 N GLN A 2 30.238 37.604 3.110 1.00 25.19 N ATOM 16 CA GLN A 2 29.889 36.779 1.952 1.00 24.84 C ATOM 17 C GLN A 2 30.039 35.322 2.441 1.00 23.47 C ATOM 18 O GLN A 2 31.152 34.957 2.846 1.00 23.88 O ATOM 19 CB GLN A 2 30.778 36.964 0.749 1.00 26.14 C ATOM 20 CG GLN A 2 30.357 36.006 -0.354 1.00 28.06 C ATOM 21 CD GLN A 2 30.926 36.395 -1.708 1.00 29.19 C ATOM 22 OE1 GLN A 2 31.981 35.877 -2.103 1.00 29.74 O ATOM 23 NE2 GLN A 2 30.202 37.288 -2.403 1.00 29.54 N ATOM 24 HA GLN A 2 28.889 37.057 1.618 1.00 0.00 H ATOM 25 HB2 GLN A 2 30.693 37.990 0.390 1.00 0.00 H ATOM 26 HB3 GLN A 2 31.812 36.763 1.028 1.00 0.00 H ATOM 27 HG2 GLN A 2 30.707 35.005 -0.101 1.00 0.00 H ATOM 28 HG3 GLN A 2 29.269 36.003 -0.419 1.00 0.00 H ATOM 29 HE22 GLN A 2 29.326 37.675 -1.998 1.00 0.00 H ATOM 30 HE21 GLN A 2 30.518 37.592 -3.346 1.00 0.00 H ATOM 31 H GLN A 2 31.220 37.590 3.453 1.00 0.00 H ATOM 32 N ILE A 3 28.957 34.598 2.395 1.00 21.20 N ATOM 33 CA ILE A 3 28.955 33.207 2.853 1.00 19.23 C ATOM 34 C ILE A 3 28.788 32.204 1.731 1.00 18.20 C ATOM 35 O ILE A 3 27.837 32.219 0.933 1.00 17.79 O ATOM 36 CB ILE A 3 27.859 33.112 3.982 1.00 19.31 C ATOM 37 CG1 ILE A 3 28.163 34.233 5.010 1.00 20.19 C ATOM 38 CG2 ILE A 3 27.724 31.717 4.615 1.00 18.77 C ATOM 39 CD1 ILE A 3 27.044 34.496 6.067 1.00 19.93 C ATOM 40 HA ILE A 3 29.928 32.932 3.261 1.00 0.00 H ATOM 41 HB ILE A 3 26.873 33.264 3.543 1.00 0.00 H ATOM 42 HG12 ILE A 3 29.073 33.961 5.544 1.00 0.00 H ATOM 43 HG13 ILE A 3 28.329 35.159 4.459 1.00 0.00 H ATOM 44 HD11 ILE A 3 26.125 34.786 5.557 1.00 0.00 H ATOM 45 HD12 ILE A 3 26.870 33.588 6.644 1.00 0.00 H ATOM 46 HD13 ILE A 3 27.358 35.297 6.735 1.00 0.00 H ATOM 47 HG21 ILE A 3 27.454 30.995 3.845 1.00 0.00 H ATOM 48 HG22 ILE A 3 28.674 31.431 5.066 1.00 0.00 H ATOM 49 HG23 ILE A 3 26.949 31.740 5.381 1.00 0.00 H ATOM 50 H ILE A 3 28.079 35.015 2.026 1.00 0.00 H ATOM 51 N THR A 4 29.736 31.278 1.701 1.00 16.95 N ATOM 52 CA THR A 4 29.750 30.160 0.750 1.00 16.15 C ATOM 53 C THR A 4 28.881 29.050 1.329 1.00 15.13 C ATOM 54 O THR A 4 28.579 29.081 2.528 1.00 15.30 O ATOM 55 CB THR A 4 31.199 29.689 0.363 1.00 16.16 C ATOM 56 OG1 THR A 4 31.803 29.069 1.543 1.00 17.04 O ATOM 57 CG2 THR A 4 32.022 30.880 -0.131 1.00 15.94 C ATOM 58 HA THR A 4 29.333 30.485 -0.203 1.00 0.00 H ATOM 59 HB THR A 4 31.167 28.961 -0.448 1.00 0.00 H ATOM 60 HG1 THR A 4 31.255 28.294 1.824 1.00 0.00 H ATOM 61 HG23 THR A 4 31.541 31.313 -1.008 1.00 0.00 H ATOM 62 HG21 THR A 4 32.084 31.629 0.658 1.00 0.00 H ATOM 63 HG22 THR A 4 33.025 30.543 -0.394 1.00 0.00 H ATOM 64 H THR A 4 30.513 31.347 2.389 1.00 0.00 H ATOM 65 N LEU A 5 28.436 28.157 0.482 1.00 14.12 N ATOM 66 CA LEU A 5 27.553 27.080 0.880 1.00 13.38 C ATOM 67 C LEU A 5 28.223 25.728 0.860 1.00 13.09 C ATOM 68 O LEU A 5 27.431 24.757 0.831 1.00 12.73 O ATOM 69 CB LEU A 5 26.236 27.187 0.102 1.00 13.24 C ATOM 70 CG LEU A 5 25.589 28.598 0.244 1.00 13.56 C ATOM 71 CD1 LEU A 5 24.554 28.787 -0.864 1.00 13.63 C ATOM 72 CD2 LEU A 5 24.910 28.661 1.600 1.00 13.46 C ATOM 73 HA LEU A 5 27.295 27.189 1.933 1.00 0.00 H ATOM 74 HB2 LEU A 5 26.433 26.994 -0.953 1.00 0.00 H ATOM 75 HB3 LEU A 5 25.540 26.440 0.483 1.00 0.00 H ATOM 76 HG LEU A 5 26.341 29.382 0.162 1.00 0.00 H ATOM 77 HD21 LEU A 5 24.146 27.886 1.659 1.00 0.00 H ATOM 78 HD22 LEU A 5 25.651 28.503 2.384 1.00 0.00 H ATOM 79 HD23 LEU A 5 24.447 29.639 1.728 1.00 0.00 H ATOM 80 HD11 LEU A 5 25.043 28.703 -1.834 1.00 0.00 H ATOM 81 HD12 LEU A 5 23.785 28.020 -0.776 1.00 0.00 H ATOM 82 HD13 LEU A 5 24.098 29.773 -0.769 1.00 0.00 H ATOM 83 H LEU A 5 28.727 28.223 -0.514 1.00 0.00 H ATOM 84 N TRP A 6 29.539 25.670 0.944 1.00 12.64 N ATOM 85 CA TRP A 6 30.179 24.341 1.022 1.00 13.52 C ATOM 86 C TRP A 6 29.696 23.647 2.295 1.00 14.27 C ATOM 87 O TRP A 6 29.517 22.423 2.349 1.00 14.72 O ATOM 88 CB TRP A 6 31.696 24.443 1.004 1.00 13.58 C ATOM 89 CG TRP A 6 32.204 25.100 -0.235 1.00 14.84 C ATOM 90 CD1 TRP A 6 32.703 26.372 -0.370 1.00 15.30 C ATOM 91 CD2 TRP A 6 32.237 24.508 -1.549 1.00 14.62 C ATOM 92 NE1 TRP A 6 33.105 26.596 -1.683 1.00 15.70 N ATOM 93 CE2 TRP A 6 32.811 25.456 -2.406 1.00 15.49 C ATOM 94 CE3 TRP A 6 31.893 23.266 -2.040 1.00 14.86 C ATOM 95 CZ2 TRP A 6 33.026 25.207 -3.765 1.00 16.15 C ATOM 96 CZ3 TRP A 6 32.121 22.981 -3.366 1.00 14.91 C ATOM 97 CH2 TRP A 6 32.668 23.931 -4.221 1.00 15.41 C ATOM 98 HA TRP A 6 29.896 23.757 0.146 1.00 0.00 H ATOM 99 HB2 TRP A 6 32.019 25.025 1.867 1.00 0.00 H ATOM 100 HB3 TRP A 6 32.116 23.439 1.066 1.00 0.00 H ATOM 101 HE1 TRP A 6 33.546 27.462 -2.052 1.00 0.00 H ATOM 102 HD1 TRP A 6 32.774 27.102 0.436 1.00 0.00 H ATOM 103 HZ2 TRP A 6 33.447 25.961 -4.430 1.00 0.00 H ATOM 104 HH2 TRP A 6 32.822 23.678 -5.270 1.00 0.00 H ATOM 105 HZ3 TRP A 6 31.869 21.994 -3.753 1.00 0.00 H ATOM 106 HE3 TRP A 6 31.446 22.519 -1.385 1.00 0.00 H ATOM 107 H TRP A 6 30.111 26.538 0.955 1.00 0.00 H ATOM 108 N GLN A 7 29.453 24.452 3.314 1.00 14.62 N ATOM 109 CA GLN A 7 28.975 23.889 4.618 1.00 15.38 C ATOM 110 C GLN A 7 27.648 24.587 4.936 1.00 14.45 C ATOM 111 O GLN A 7 27.367 25.574 4.236 1.00 12.82 O ATOM 112 CB GLN A 7 29.993 24.223 5.717 1.00 16.86 C ATOM 113 CG GLN A 7 31.323 23.543 5.524 1.00 19.57 C ATOM 114 CD GLN A 7 32.410 24.242 4.786 1.00 21.45 C ATOM 115 OE1 GLN A 7 32.778 25.438 4.815 1.00 22.88 O ATOM 116 NE2 GLN A 7 33.140 23.420 3.998 1.00 22.76 N ATOM 117 HA GLN A 7 28.855 22.807 4.563 1.00 0.00 H ATOM 118 HB2 GLN A 7 30.153 25.301 5.724 1.00 0.00 H ATOM 119 HB3 GLN A 7 29.581 23.912 6.677 1.00 0.00 H ATOM 120 HG2 GLN A 7 31.710 23.318 6.518 1.00 0.00 H ATOM 121 HG3 GLN A 7 31.128 22.612 4.992 1.00 0.00 H ATOM 122 HE22 GLN A 7 32.891 22.413 3.926 1.00 0.00 H ATOM 123 HE21 GLN A 7 33.950 23.795 3.464 1.00 0.00 H ATOM 124 H GLN A 7 29.594 25.477 3.211 1.00 0.00 H ATOM 125 N ARG A 8 26.945 24.085 5.924 1.00 13.62 N ATOM 126 CA ARG A 8 25.676 24.756 6.312 1.00 14.06 C ATOM 127 C ARG A 8 26.040 26.174 6.748 1.00 13.86 C ATOM 128 O ARG A 8 27.090 26.330 7.403 1.00 13.78 O ATOM 129 CB ARG A 8 25.134 24.009 7.498 1.00 14.86 C ATOM 130 CG ARG A 8 24.691 22.591 7.172 1.00 15.13 C ATOM 131 CD ARG A 8 23.914 22.101 8.381 1.00 15.86 C ATOM 132 NE ARG A 8 23.202 20.927 7.943 1.00 17.25 N ATOM 133 CZ ARG A 8 22.507 20.144 8.723 1.00 18.54 C ATOM 134 NH1 ARG A 8 22.427 20.463 10.021 1.00 19.41 N ATOM 135 NH2 ARG A 8 21.863 19.066 8.277 1.00 19.12 N ATOM 136 HA ARG A 8 24.948 24.776 5.501 1.00 0.00 H ATOM 137 HB2 ARG A 8 25.911 23.961 8.260 1.00 0.00 H ATOM 138 HB3 ARG A 8 24.277 24.557 7.889 1.00 0.00 H ATOM 139 HG2 ARG A 8 24.055 22.588 6.287 1.00 0.00 H ATOM 140 HG3 ARG A 8 25.558 21.955 6.997 1.00 0.00 H ATOM 141 HD2 ARG A 8 23.214 22.866 8.718 1.00 0.00 H ATOM 142 HD3 ARG A 8 24.595 21.850 9.194 1.00 0.00 H ATOM 143 HE ARG A 8 23.245 20.686 6.932 1.00 0.00 H ATOM 144 HH12 ARG A 8 21.882 19.862 10.672 1.00 0.00 H ATOM 145 HH11 ARG A 8 22.910 21.312 10.379 1.00 0.00 H ATOM 146 HH22 ARG A 8 21.322 18.473 8.938 1.00 0.00 H ATOM 147 HH21 ARG A 8 21.901 18.818 7.268 1.00 0.00 H ATOM 148 H ARG A 8 27.269 23.234 6.426 1.00 0.00 H ATOM 149 N PRO A 9 25.224 27.137 6.414 1.00 13.24 N ATOM 150 CA PRO A 9 25.555 28.550 6.774 1.00 13.30 C ATOM 151 C PRO A 9 25.045 28.846 8.178 1.00 13.43 C ATOM 152 O PRO A 9 23.944 29.354 8.404 1.00 12.63 O ATOM 153 CB PRO A 9 24.878 29.314 5.647 1.00 12.46 C ATOM 154 CG PRO A 9 23.639 28.496 5.336 1.00 12.20 C ATOM 155 CD PRO A 9 24.008 27.043 5.611 1.00 12.75 C ATOM 156 HA PRO A 9 26.611 28.812 6.837 1.00 0.00 H ATOM 157 HD3 PRO A 9 23.215 26.539 6.164 1.00 0.00 H ATOM 158 HD2 PRO A 9 24.197 26.508 4.681 1.00 0.00 H ATOM 159 HG3 PRO A 9 23.355 28.623 4.291 1.00 0.00 H ATOM 160 HG2 PRO A 9 22.812 28.804 5.976 1.00 0.00 H ATOM 161 HB2 PRO A 9 24.607 30.320 5.969 1.00 0.00 H ATOM 162 HB3 PRO A 9 25.530 29.376 4.775 1.00 0.00 H ATOM 163 N LEU A 10 25.898 28.535 9.131 1.00 14.99 N ATOM 164 CA LEU A 10 25.602 28.686 10.559 1.00 16.78 C ATOM 165 C LEU A 10 26.167 29.972 11.113 1.00 17.27 C ATOM 166 O LEU A 10 27.342 30.232 10.782 1.00 18.08 O ATOM 167 CB LEU A 10 26.169 27.446 11.264 1.00 17.75 C ATOM 168 CG LEU A 10 25.289 26.208 11.107 1.00 18.63 C ATOM 169 CD1 LEU A 10 26.034 24.988 11.630 1.00 19.40 C ATOM 170 CD2 LEU A 10 24.037 26.385 11.953 1.00 19.41 C ATOM 171 HA LEU A 10 24.527 28.753 10.727 1.00 0.00 H ATOM 172 HB2 LEU A 10 27.151 27.228 10.845 1.00 0.00 H ATOM 173 HB3 LEU A 10 26.269 27.667 12.327 1.00 0.00 H ATOM 174 HG LEU A 10 25.034 26.076 10.055 1.00 0.00 H ATOM 175 HD21 LEU A 10 24.321 26.507 12.998 1.00 0.00 H ATOM 176 HD22 LEU A 10 23.495 27.269 11.617 1.00 0.00 H ATOM 177 HD23 LEU A 10 23.402 25.506 11.848 1.00 0.00 H ATOM 178 HD11 LEU A 10 26.955 24.855 11.062 1.00 0.00 H ATOM 179 HD12 LEU A 10 26.273 25.134 12.683 1.00 0.00 H ATOM 180 HD13 LEU A 10 25.406 24.104 11.518 1.00 0.00 H ATOM 181 H LEU A 10 26.830 28.163 8.857 1.00 0.00 H ATOM 182 N VAL A 11 25.366 30.692 11.855 1.00 17.57 N ATOM 183 CA VAL A 11 25.815 31.980 12.459 1.00 18.42 C ATOM 184 C VAL A 11 25.444 31.966 13.956 1.00 19.20 C ATOM 185 O VAL A 11 24.658 31.104 14.390 1.00 19.49 O ATOM 186 CB VAL A 11 25.272 33.199 11.720 1.00 17.81 C ATOM 187 CG1 VAL A 11 25.622 33.195 10.222 1.00 19.03 C ATOM 188 CG2 VAL A 11 23.772 33.310 11.849 1.00 17.74 C ATOM 189 HA VAL A 11 26.897 32.068 12.361 1.00 0.00 H ATOM 190 HB VAL A 11 25.754 34.054 12.194 1.00 0.00 H ATOM 191 HG11 VAL A 11 26.706 33.189 10.103 1.00 0.00 H ATOM 192 HG12 VAL A 11 25.199 32.306 9.754 1.00 0.00 H ATOM 193 HG13 VAL A 11 25.208 34.087 9.751 1.00 0.00 H ATOM 194 HG21 VAL A 11 23.306 32.419 11.429 1.00 0.00 H ATOM 195 HG22 VAL A 11 23.505 33.400 12.902 1.00 0.00 H ATOM 196 HG23 VAL A 11 23.426 34.191 11.308 1.00 0.00 H ATOM 197 H VAL A 11 24.396 30.360 12.028 1.00 0.00 H ATOM 198 N THR A 12 26.042 32.913 14.665 1.00 20.21 N ATOM 199 CA THR A 12 25.819 33.084 16.093 1.00 21.10 C ATOM 200 C THR A 12 24.753 34.165 16.208 1.00 21.49 C ATOM 201 O THR A 12 24.834 35.177 15.502 1.00 21.98 O ATOM 202 CB THR A 12 27.056 33.499 16.966 1.00 21.90 C ATOM 203 OG1 THR A 12 27.939 32.347 16.929 1.00 23.13 O ATOM 204 CG2 THR A 12 26.646 33.793 18.424 1.00 22.54 C ATOM 205 HA THR A 12 25.544 32.107 16.491 1.00 0.00 H ATOM 206 HB THR A 12 27.523 34.407 16.585 1.00 0.00 H ATOM 207 HG1 THR A 12 28.750 32.537 17.464 1.00 0.00 H ATOM 208 HG23 THR A 12 25.983 34.658 18.446 1.00 0.00 H ATOM 209 HG21 THR A 12 26.128 32.927 18.836 1.00 0.00 H ATOM 210 HG22 THR A 12 27.537 34.001 19.016 1.00 0.00 H ATOM 211 H THR A 12 26.697 33.560 14.181 1.00 0.00 H ATOM 212 N ILE A 13 23.776 33.866 17.019 1.00 21.56 N ATOM 213 CA ILE A 13 22.685 34.800 17.255 1.00 21.88 C ATOM 214 C ILE A 13 22.697 35.043 18.771 1.00 23.53 C ATOM 215 O ILE A 13 23.279 34.246 19.540 1.00 22.96 O ATOM 216 CB ILE A 13 21.330 34.353 16.644 1.00 20.88 C ATOM 217 CG1 ILE A 13 20.792 33.119 17.386 1.00 20.25 C ATOM 218 CG2 ILE A 13 21.449 34.148 15.105 1.00 20.17 C ATOM 219 CD1 ILE A 13 19.261 32.988 17.364 1.00 19.66 C ATOM 220 HA ILE A 13 22.826 35.743 16.727 1.00 0.00 H ATOM 221 HB ILE A 13 20.595 35.146 16.781 1.00 0.00 H ATOM 222 HG12 ILE A 13 21.218 32.229 16.923 1.00 0.00 H ATOM 223 HG13 ILE A 13 21.115 33.177 18.425 1.00 0.00 H ATOM 224 HD11 ILE A 13 18.816 33.864 17.835 1.00 0.00 H ATOM 225 HD12 ILE A 13 18.919 32.916 16.332 1.00 0.00 H ATOM 226 HD13 ILE A 13 18.966 32.092 17.910 1.00 0.00 H ATOM 227 HG21 ILE A 13 21.751 35.085 14.637 1.00 0.00 H ATOM 228 HG22 ILE A 13 22.195 33.381 14.899 1.00 0.00 H ATOM 229 HG23 ILE A 13 20.484 33.835 14.706 1.00 0.00 H ATOM 230 H ILE A 13 23.777 32.946 17.504 1.00 0.00 H ATOM 231 N LYS A 14 22.124 36.177 19.077 1.00 25.41 N ATOM 232 CA LYS A 14 21.991 36.640 20.480 1.00 27.37 C ATOM 233 C LYS A 14 20.514 36.957 20.656 1.00 27.32 C ATOM 234 O LYS A 14 19.939 37.801 19.952 1.00 26.75 O ATOM 235 CB LYS A 14 22.918 37.781 20.815 1.00 29.11 C ATOM 236 CG LYS A 14 22.899 38.182 22.295 1.00 31.50 C ATOM 237 CD LYS A 14 23.849 39.370 22.510 1.00 33.36 C ATOM 238 CE LYS A 14 23.208 40.280 23.581 1.00 35.12 C ATOM 239 NZ LYS A 14 23.717 41.682 23.332 1.00 36.46 N ATOM 240 HA LYS A 14 22.303 35.876 21.192 1.00 0.00 H ATOM 241 HB2 LYS A 14 23.934 37.487 20.552 1.00 0.00 H ATOM 242 HB3 LYS A 14 22.626 38.647 20.221 1.00 0.00 H ATOM 243 HG2 LYS A 14 21.887 38.468 22.582 1.00 0.00 H ATOM 244 HG3 LYS A 14 23.225 37.340 22.905 1.00 0.00 H ATOM 245 HD2 LYS A 14 24.820 39.014 22.854 1.00 0.00 H ATOM 246 HD3 LYS A 14 23.975 39.921 21.578 1.00 0.00 H ATOM 247 HE2 LYS A 14 23.498 39.948 24.578 1.00 0.00 H ATOM 248 HE3 LYS A 14 22.122 40.255 23.493 1.00 0.00 H ATOM 249 HZ1 LYS A 14 24.754 41.693 23.413 1.00 0.00 H ATOM 250 HZ2 LYS A 14 23.439 41.986 22.377 1.00 0.00 H ATOM 251 HZ3 LYS A 14 23.307 42.329 24.036 1.00 0.00 H ATOM 252 H LYS A 14 21.749 36.774 18.312 1.00 0.00 H ATOM 253 N ILE A 15 19.932 36.176 21.539 1.00 28.18 N ATOM 254 CA ILE A 15 18.498 36.299 21.830 1.00 29.63 C ATOM 255 C ILE A 15 18.312 36.126 23.338 1.00 31.23 C ATOM 256 O ILE A 15 18.796 35.154 23.950 1.00 31.32 O ATOM 257 CB ILE A 15 17.658 35.302 20.965 1.00 28.67 C ATOM 258 CG1 ILE A 15 16.164 35.607 21.175 1.00 28.38 C ATOM 259 CG2 ILE A 15 18.011 33.818 21.237 1.00 28.73 C ATOM 260 CD1 ILE A 15 15.234 34.863 20.181 1.00 28.32 C ATOM 261 HA ILE A 15 18.122 37.284 21.552 1.00 0.00 H ATOM 262 HB ILE A 15 17.908 35.451 19.915 1.00 0.00 H ATOM 263 HG12 ILE A 15 15.891 35.314 22.189 1.00 0.00 H ATOM 264 HG13 ILE A 15 16.010 36.679 21.055 1.00 0.00 H ATOM 265 HD11 ILE A 15 15.487 35.154 19.161 1.00 0.00 H ATOM 266 HD12 ILE A 15 15.367 33.787 20.296 1.00 0.00 H ATOM 267 HD13 ILE A 15 14.197 35.126 20.389 1.00 0.00 H ATOM 268 HG21 ILE A 15 19.064 33.649 21.010 1.00 0.00 H ATOM 269 HG22 ILE A 15 17.823 33.587 22.286 1.00 0.00 H ATOM 270 HG23 ILE A 15 17.394 33.178 20.606 1.00 0.00 H ATOM 271 H ILE A 15 20.496 35.460 22.039 1.00 0.00 H ATOM 272 N GLY A 16 17.631 37.143 23.829 1.00 33.08 N ATOM 273 CA GLY A 16 17.311 37.249 25.279 1.00 35.28 C ATOM 274 C GLY A 16 18.638 37.118 26.056 1.00 36.15 C ATOM 275 O GLY A 16 18.717 36.339 27.022 1.00 36.59 O ATOM 276 HA3 GLY A 16 16.629 36.450 25.569 1.00 0.00 H ATOM 277 HA2 GLY A 16 16.850 38.214 25.489 1.00 0.00 H ATOM 278 H GLY A 16 17.308 37.893 23.185 1.00 0.00 H ATOM 279 N GLY A 17 19.620 37.874 25.566 1.00 36.61 N ATOM 280 CA GLY A 17 20.947 37.772 26.199 1.00 37.21 C ATOM 281 C GLY A 17 21.501 36.356 25.946 1.00 37.64 C ATOM 282 O GLY A 17 22.716 36.150 26.254 1.00 38.79 O ATOM 283 HA3 GLY A 17 20.858 37.946 27.271 1.00 0.00 H ATOM 284 HA2 GLY A 17 21.619 38.513 25.766 1.00 0.00 H ATOM 285 H GLY A 17 19.455 38.515 24.764 1.00 0.00 H ATOM 286 N GLN A 18 20.756 35.396 25.421 1.00 36.81 N ATOM 287 CA GLN A 18 21.406 34.085 25.194 1.00 36.20 C ATOM 288 C GLN A 18 22.043 34.093 23.801 1.00 34.66 C ATOM 289 O GLN A 18 21.366 34.430 22.828 1.00 34.36 O ATOM 290 CB GLN A 18 20.486 32.914 25.370 1.00 37.63 C ATOM 291 CG GLN A 18 19.807 32.859 26.724 1.00 39.55 C ATOM 292 CD GLN A 18 18.855 31.688 26.808 1.00 41.12 C ATOM 293 OE1 GLN A 18 19.022 30.619 26.190 1.00 42.09 O ATOM 294 NE2 GLN A 18 17.788 31.850 27.608 1.00 42.04 N ATOM 295 HA GLN A 18 22.170 33.953 25.960 1.00 0.00 H ATOM 296 HB2 GLN A 18 19.715 32.966 24.602 1.00 0.00 H ATOM 297 HB3 GLN A 18 21.066 32.000 25.240 1.00 0.00 H ATOM 298 HG2 GLN A 18 20.566 32.757 27.499 1.00 0.00 H ATOM 299 HG3 GLN A 18 19.250 33.783 26.881 1.00 0.00 H ATOM 300 HE22 GLN A 18 17.654 32.745 28.121 1.00 0.00 H ATOM 301 HE21 GLN A 18 17.096 31.081 27.714 1.00 0.00 H ATOM 302 H GLN A 18 19.757 35.556 25.178 1.00 0.00 H ATOM 303 N LEU A 19 23.274 33.679 23.754 1.00 33.08 N ATOM 304 CA LEU A 19 24.108 33.534 22.557 1.00 32.12 C ATOM 305 C LEU A 19 23.830 32.172 21.878 1.00 30.99 C ATOM 306 O LEU A 19 24.099 31.192 22.606 1.00 31.13 O ATOM 307 CB LEU A 19 25.543 33.526 23.068 1.00 32.56 C ATOM 308 CG LEU A 19 26.454 34.692 22.887 1.00 33.17 C ATOM 309 CD1 LEU A 19 27.889 34.170 22.664 1.00 33.61 C ATOM 310 CD2 LEU A 19 26.020 35.532 21.698 1.00 33.65 C ATOM 311 HA LEU A 19 23.913 34.329 21.837 1.00 0.00 H ATOM 312 HB2 LEU A 19 25.483 33.349 24.142 1.00 0.00 H ATOM 313 HB3 LEU A 19 26.033 32.679 22.588 1.00 0.00 H ATOM 314 HG LEU A 19 26.417 35.319 23.778 1.00 0.00 H ATOM 315 HD21 LEU A 19 26.044 34.922 20.795 1.00 0.00 H ATOM 316 HD22 LEU A 19 25.007 35.898 21.864 1.00 0.00 H ATOM 317 HD23 LEU A 19 26.699 36.377 21.585 1.00 0.00 H ATOM 318 HD11 LEU A 19 28.201 33.587 23.531 1.00 0.00 H ATOM 319 HD12 LEU A 19 27.911 33.541 21.774 1.00 0.00 H ATOM 320 HD13 LEU A 19 28.565 35.015 22.530 1.00 0.00 H ATOM 321 H LEU A 19 23.714 33.424 24.661 1.00 0.00 H ATOM 322 N LYS A 20 23.401 32.081 20.628 1.00 28.94 N ATOM 323 CA LYS A 20 23.115 30.791 20.011 1.00 27.34 C ATOM 324 C LYS A 20 23.628 30.632 18.585 1.00 26.02 C ATOM 325 O LYS A 20 24.173 31.537 17.953 1.00 25.84 O ATOM 326 CB LYS A 20 21.613 30.467 19.940 1.00 27.67 C ATOM 327 CG LYS A 20 20.847 30.892 21.170 1.00 29.33 C ATOM 328 CD LYS A 20 19.695 29.998 21.536 1.00 30.66 C ATOM 329 CE LYS A 20 19.313 29.982 22.998 1.00 31.73 C ATOM 330 NZ LYS A 20 18.295 28.898 23.322 1.00 32.56 N ATOM 331 HA LYS A 20 23.645 30.111 20.678 1.00 0.00 H ATOM 332 HB2 LYS A 20 21.190 30.979 19.076 1.00 0.00 H ATOM 333 HB3 LYS A 20 21.497 29.390 19.816 1.00 0.00 H ATOM 334 HG2 LYS A 20 21.540 30.914 22.011 1.00 0.00 H ATOM 335 HG3 LYS A 20 20.457 31.895 20.997 1.00 0.00 H ATOM 336 HD2 LYS A 20 18.825 30.324 20.966 1.00 0.00 H ATOM 337 HD3 LYS A 20 19.957 28.980 21.247 1.00 0.00 H ATOM 338 HE2 LYS A 20 18.888 30.951 23.259 1.00 0.00 H ATOM 339 HE3 LYS A 20 20.210 29.808 23.592 1.00 0.00 H ATOM 340 HZ1 LYS A 20 17.431 29.058 22.766 1.00 0.00 H ATOM 341 HZ2 LYS A 20 18.694 27.967 23.084 1.00 0.00 H ATOM 342 HZ3 LYS A 20 18.067 28.930 24.336 1.00 0.00 H ATOM 343 H LYS A 20 23.265 32.950 20.073 1.00 0.00 H ATOM 344 N GLU A 21 23.441 29.390 18.133 1.00 24.48 N ATOM 345 CA GLU A 21 23.841 29.079 16.761 1.00 23.65 C ATOM 346 C GLU A 21 22.603 28.799 15.920 1.00 20.32 C ATOM 347 O GLU A 21 21.684 28.151 16.422 1.00 19.12 O ATOM 348 CB GLU A 21 24.831 27.988 16.565 1.00 26.98 C ATOM 349 CG GLU A 21 26.254 28.630 16.412 1.00 31.90 C ATOM 350 CD GLU A 21 27.275 27.545 16.104 1.00 34.95 C ATOM 351 OE1 GLU A 21 26.902 26.381 15.818 1.00 36.09 O ATOM 352 OE2 GLU A 21 28.447 28.029 16.188 1.00 36.48 O ATOM 353 HA GLU A 21 24.374 29.974 16.439 1.00 0.00 H ATOM 354 HB2 GLU A 21 24.819 27.321 17.427 1.00 0.00 H ATOM 355 HB3 GLU A 21 24.583 27.423 15.666 1.00 0.00 H ATOM 356 HG2 GLU A 21 26.239 29.355 15.599 1.00 0.00 H ATOM 357 HG3 GLU A 21 26.527 29.132 17.340 1.00 0.00 H ATOM 358 H GLU A 21 23.020 28.660 18.743 1.00 0.00 H ATOM 359 N ALA A 22 22.673 29.410 14.731 1.00 16.91 N ATOM 360 CA ALA A 22 21.497 29.210 13.845 1.00 14.32 C ATOM 361 C ALA A 22 21.917 29.191 12.389 1.00 12.55 C ATOM 362 O ALA A 22 22.940 29.694 11.971 1.00 11.67 O ATOM 363 CB ALA A 22 20.502 30.278 14.206 1.00 13.71 C ATOM 364 HA ALA A 22 21.023 28.239 13.990 1.00 0.00 H ATOM 365 HB1 ALA A 22 20.222 30.173 15.254 1.00 0.00 H ATOM 366 HB2 ALA A 22 20.949 31.259 14.045 1.00 0.00 H ATOM 367 HB3 ALA A 22 19.616 30.174 13.580 1.00 0.00 H ATOM 368 H ALA A 22 23.493 29.984 14.447 1.00 0.00 H ATOM 369 N LEU A 23 21.016 28.615 11.631 1.00 11.78 N ATOM 370 CA LEU A 23 21.088 28.413 10.203 1.00 11.24 C ATOM 371 C LEU A 23 20.439 29.532 9.399 1.00 10.91 C ATOM 372 O LEU A 23 19.232 29.691 9.663 1.00 11.42 O ATOM 373 CB LEU A 23 20.261 27.126 10.014 1.00 11.28 C ATOM 374 CG LEU A 23 20.373 26.488 8.644 1.00 11.74 C ATOM 375 CD1 LEU A 23 21.786 25.935 8.447 1.00 12.02 C ATOM 376 CD2 LEU A 23 19.350 25.357 8.599 1.00 11.67 C ATOM 377 HA LEU A 23 22.121 28.373 9.858 1.00 0.00 H ATOM 378 HB2 LEU A 23 20.593 26.398 10.754 1.00 0.00 H ATOM 379 HB3 LEU A 23 19.213 27.368 10.190 1.00 0.00 H ATOM 380 HG LEU A 23 20.183 27.212 7.852 1.00 0.00 H ATOM 381 HD21 LEU A 23 19.575 24.634 9.383 1.00 0.00 H ATOM 382 HD22 LEU A 23 18.352 25.765 8.756 1.00 0.00 H ATOM 383 HD23 LEU A 23 19.395 24.867 7.627 1.00 0.00 H ATOM 384 HD11 LEU A 23 22.508 26.748 8.528 1.00 0.00 H ATOM 385 HD12 LEU A 23 21.992 25.187 9.213 1.00 0.00 H ATOM 386 HD13 LEU A 23 21.861 25.477 7.461 1.00 0.00 H ATOM 387 H LEU A 23 20.160 28.267 12.108 1.00 0.00 H ATOM 388 N LEU A 24 21.159 30.179 8.509 1.00 10.29 N ATOM 389 CA LEU A 24 20.484 31.239 7.643 1.00 10.60 C ATOM 390 C LEU A 24 19.722 30.416 6.600 1.00 10.36 C ATOM 391 O LEU A 24 20.424 29.750 5.795 1.00 10.95 O ATOM 392 CB LEU A 24 21.551 32.148 7.090 1.00 10.44 C ATOM 393 CG LEU A 24 22.390 32.880 8.131 1.00 11.37 C ATOM 394 CD1 LEU A 24 23.412 33.797 7.487 1.00 12.17 C ATOM 395 CD2 LEU A 24 21.441 33.619 9.090 1.00 11.19 C ATOM 396 HA LEU A 24 19.790 31.907 8.154 1.00 0.00 H ATOM 397 HB2 LEU A 24 22.223 31.545 6.479 1.00 0.00 H ATOM 398 HB3 LEU A 24 21.065 32.896 6.463 1.00 0.00 H ATOM 399 HG LEU A 24 22.976 32.162 8.706 1.00 0.00 H ATOM 400 HD21 LEU A 24 20.840 34.333 8.526 1.00 0.00 H ATOM 401 HD22 LEU A 24 20.786 32.898 9.579 1.00 0.00 H ATOM 402 HD23 LEU A 24 22.026 34.148 9.842 1.00 0.00 H ATOM 403 HD11 LEU A 24 24.081 33.209 6.859 1.00 0.00 H ATOM 404 HD12 LEU A 24 22.898 34.540 6.877 1.00 0.00 H ATOM 405 HD13 LEU A 24 23.988 34.299 8.264 1.00 0.00 H ATOM 406 H LEU A 24 22.172 29.972 8.397 1.00 0.00 H ATOM 407 N ASP A 25 18.430 30.369 6.675 1.00 9.71 N ATOM 408 CA ASP A 25 17.629 29.472 5.796 1.00 9.52 C ATOM 409 C ASP A 25 16.736 30.206 4.823 1.00 8.07 C ATOM 410 O ASP A 25 15.665 30.604 5.248 1.00 8.52 O ATOM 411 CB ASP A 25 16.914 28.540 6.778 1.00 10.27 C ATOM 412 CG ASP A 25 16.284 27.340 6.097 1.00 11.76 C ATOM 413 OD1 ASP A 25 15.988 27.390 4.893 1.00 12.21 O ATOM 414 OD2 ASP A 25 16.104 26.309 6.742 1.00 13.03 O ATOM 415 HA ASP A 25 18.246 28.904 5.100 1.00 0.00 H ATOM 416 HB2 ASP A 25 17.638 28.184 7.511 1.00 0.00 H ATOM 417 HB3 ASP A 25 16.131 29.103 7.286 1.00 0.00 H ATOM 418 H ASP A 25 17.940 30.972 7.366 1.00 0.00 H ATOM 419 N THR A 26 17.080 30.340 3.557 1.00 6.62 N ATOM 420 CA THR A 26 16.241 31.078 2.611 1.00 5.55 C ATOM 421 C THR A 26 15.015 30.298 2.218 1.00 5.00 C ATOM 422 O THR A 26 14.053 30.926 1.685 1.00 4.39 O ATOM 423 CB THR A 26 17.066 31.533 1.348 1.00 4.97 C ATOM 424 OG1 THR A 26 17.388 30.244 0.746 1.00 4.88 O ATOM 425 CG2 THR A 26 18.312 32.343 1.689 1.00 4.98 C ATOM 426 HA THR A 26 15.895 31.977 3.121 1.00 0.00 H ATOM 427 HB THR A 26 16.519 32.215 0.697 1.00 0.00 H ATOM 428 HG1 THR A 26 16.550 29.768 0.520 1.00 0.00 H ATOM 429 HG23 THR A 26 18.016 33.293 2.134 1.00 0.00 H ATOM 430 HG21 THR A 26 18.925 31.784 2.396 1.00 0.00 H ATOM 431 HG22 THR A 26 18.883 32.529 0.779 1.00 0.00 H ATOM 432 H THR A 26 17.967 29.912 3.223 1.00 0.00 H ATOM 433 N GLY A 27 15.034 29.019 2.522 1.00 4.44 N ATOM 434 CA GLY A 27 13.880 28.141 2.221 1.00 4.50 C ATOM 435 C GLY A 27 12.851 28.251 3.341 1.00 5.26 C ATOM 436 O GLY A 27 11.717 27.758 3.189 1.00 5.08 O ATOM 437 HA3 GLY A 27 14.220 27.109 2.140 1.00 0.00 H ATOM 438 HA2 GLY A 27 13.426 28.448 1.279 1.00 0.00 H ATOM 439 H GLY A 27 15.875 28.616 2.982 1.00 0.00 H ATOM 440 N ALA A 28 13.213 28.900 4.460 1.00 5.42 N ATOM 441 CA ALA A 28 12.263 29.070 5.593 1.00 6.06 C ATOM 442 C ALA A 28 11.515 30.387 5.567 1.00 6.36 C ATOM 443 O ALA A 28 12.150 31.456 5.617 1.00 6.58 O ATOM 444 CB ALA A 28 13.018 28.965 6.939 1.00 5.65 C ATOM 445 HA ALA A 28 11.528 28.272 5.486 1.00 0.00 H ATOM 446 HB1 ALA A 28 13.493 27.986 7.013 1.00 0.00 H ATOM 447 HB2 ALA A 28 13.779 29.744 6.989 1.00 0.00 H ATOM 448 HB3 ALA A 28 12.313 29.091 7.761 1.00 0.00 H ATOM 449 H ALA A 28 14.174 29.291 4.536 1.00 0.00 H ATOM 450 N ASP A 29 10.193 30.371 5.555 1.00 7.93 N ATOM 451 CA ASP A 29 9.394 31.606 5.568 1.00 9.35 C ATOM 452 C ASP A 29 9.487 32.348 6.919 1.00 10.28 C ATOM 453 O ASP A 29 9.510 33.584 6.925 1.00 9.65 O ATOM 454 CB ASP A 29 7.962 31.275 5.282 1.00 10.63 C ATOM 455 CG ASP A 29 7.722 30.753 3.879 1.00 11.82 C ATOM 456 OD1 ASP A 29 8.362 31.151 2.931 1.00 11.64 O ATOM 457 OD2 ASP A 29 6.817 29.918 3.785 1.00 13.65 O ATOM 458 HA ASP A 29 9.796 32.266 4.800 1.00 0.00 H ATOM 459 HB2 ASP A 29 7.636 30.515 5.992 1.00 0.00 H ATOM 460 HB3 ASP A 29 7.366 32.178 5.420 1.00 0.00 H ATOM 461 H ASP A 29 9.702 29.455 5.536 1.00 0.00 H ATOM 462 N ASP A 30 9.553 31.552 7.994 1.00 10.24 N ATOM 463 CA ASP A 30 9.608 32.100 9.341 1.00 11.56 C ATOM 464 C ASP A 30 10.886 31.685 10.070 1.00 10.86 C ATOM 465 O ASP A 30 11.677 30.870 9.587 1.00 11.47 O ATOM 466 CB ASP A 30 8.415 31.637 10.179 1.00 13.15 C ATOM 467 CG ASP A 30 7.103 32.001 9.502 1.00 16.30 C ATOM 468 OD1 ASP A 30 6.801 33.170 9.189 1.00 17.43 O ATOM 469 OD2 ASP A 30 6.333 31.024 9.273 1.00 18.20 O ATOM 470 HA ASP A 30 9.587 33.184 9.228 1.00 0.00 H ATOM 471 HB2 ASP A 30 8.464 30.555 10.304 1.00 0.00 H ATOM 472 HB3 ASP A 30 8.458 32.117 11.157 1.00 0.00 H ATOM 473 H ASP A 30 9.565 30.520 7.863 1.00 0.00 H ATOM 474 N THR A 31 11.009 32.311 11.225 1.00 10.00 N ATOM 475 CA THR A 31 12.104 32.017 12.163 1.00 9.05 C ATOM 476 C THR A 31 11.539 31.135 13.313 1.00 8.98 C ATOM 477 O THR A 31 10.512 31.449 13.931 1.00 7.89 O ATOM 478 CB THR A 31 12.786 33.297 12.694 1.00 8.62 C ATOM 479 OG1 THR A 31 13.310 33.924 11.497 1.00 8.02 O ATOM 480 CG2 THR A 31 13.901 32.931 13.750 1.00 8.39 C ATOM 481 HA THR A 31 12.889 31.473 11.638 1.00 0.00 H ATOM 482 HB THR A 31 12.116 33.969 13.230 1.00 0.00 H ATOM 483 HG1 THR A 31 12.564 34.124 10.877 1.00 0.00 H ATOM 484 HG23 THR A 31 13.437 32.466 14.620 1.00 0.00 H ATOM 485 HG21 THR A 31 14.611 32.237 13.301 1.00 0.00 H ATOM 486 HG22 THR A 31 14.421 33.838 14.056 1.00 0.00 H ATOM 487 H THR A 31 10.309 33.036 11.481 1.00 0.00 H ATOM 488 N VAL A 32 12.253 30.042 13.507 1.00 9.61 N ATOM 489 CA VAL A 32 11.860 29.094 14.557 1.00 11.48 C ATOM 490 C VAL A 32 13.078 28.687 15.366 1.00 12.95 C ATOM 491 O VAL A 32 14.108 28.336 14.737 1.00 13.81 O ATOM 492 CB VAL A 32 11.053 27.915 13.976 1.00 11.06 C ATOM 493 CG1 VAL A 32 11.791 27.141 12.906 1.00 10.20 C ATOM 494 CG2 VAL A 32 10.555 26.987 15.082 1.00 10.26 C ATOM 495 HA VAL A 32 11.177 29.577 15.255 1.00 0.00 H ATOM 496 HB VAL A 32 10.191 28.362 13.481 1.00 0.00 H ATOM 497 HG11 VAL A 32 12.033 27.808 12.079 1.00 0.00 H ATOM 498 HG12 VAL A 32 12.710 26.731 13.325 1.00 0.00 H ATOM 499 HG13 VAL A 32 11.160 26.328 12.546 1.00 0.00 H ATOM 500 HG21 VAL A 32 11.408 26.588 15.631 1.00 0.00 H ATOM 501 HG22 VAL A 32 9.913 27.546 15.762 1.00 0.00 H ATOM 502 HG23 VAL A 32 9.990 26.167 14.639 1.00 0.00 H ATOM 503 H VAL A 32 13.090 29.853 12.919 1.00 0.00 H ATOM 504 N LEU A 33 12.968 28.818 16.697 1.00 14.52 N ATOM 505 CA LEU A 33 14.062 28.419 17.609 1.00 15.52 C ATOM 506 C LEU A 33 13.571 27.237 18.459 1.00 17.03 C ATOM 507 O LEU A 33 12.375 26.959 18.646 1.00 15.75 O ATOM 508 CB LEU A 33 14.563 29.583 18.426 1.00 16.39 C ATOM 509 CG LEU A 33 14.880 30.861 17.609 1.00 17.10 C ATOM 510 CD1 LEU A 33 14.890 32.055 18.557 1.00 17.58 C ATOM 511 CD2 LEU A 33 16.181 30.668 16.868 1.00 17.05 C ATOM 512 HA LEU A 33 14.931 28.093 17.037 1.00 0.00 H ATOM 513 HB2 LEU A 33 13.801 29.832 19.164 1.00 0.00 H ATOM 514 HB3 LEU A 33 15.474 29.272 18.937 1.00 0.00 H ATOM 515 HG LEU A 33 14.118 31.055 16.854 1.00 0.00 H ATOM 516 HD21 LEU A 33 16.982 30.484 17.584 1.00 0.00 H ATOM 517 HD22 LEU A 33 16.091 29.816 16.194 1.00 0.00 H ATOM 518 HD23 LEU A 33 16.406 31.566 16.292 1.00 0.00 H ATOM 519 HD11 LEU A 33 13.913 32.150 19.030 1.00 0.00 H ATOM 520 HD12 LEU A 33 15.652 31.904 19.321 1.00 0.00 H ATOM 521 HD13 LEU A 33 15.112 32.962 17.995 1.00 0.00 H ATOM 522 H LEU A 33 12.092 29.210 17.097 1.00 0.00 H ATOM 523 N GLU A 34 14.575 26.510 18.932 1.00 19.40 N ATOM 524 CA GLU A 34 14.320 25.341 19.817 1.00 21.58 C ATOM 525 C GLU A 34 13.676 25.876 21.091 1.00 21.39 C ATOM 526 O GLU A 34 13.856 27.049 21.439 1.00 19.51 O ATOM 527 CB GLU A 34 15.647 24.653 20.094 1.00 23.97 C ATOM 528 CG GLU A 34 16.155 23.856 18.872 1.00 28.00 C ATOM 529 CD GLU A 34 17.619 23.565 18.828 1.00 30.32 C ATOM 530 OE1 GLU A 34 18.434 23.917 19.682 1.00 32.07 O ATOM 531 OE2 GLU A 34 17.994 22.894 17.815 1.00 31.62 O ATOM 532 HA GLU A 34 13.653 24.608 19.363 1.00 0.00 H ATOM 533 HB2 GLU A 34 16.388 25.409 20.353 1.00 0.00 H ATOM 534 HB3 GLU A 34 15.520 23.968 20.932 1.00 0.00 H ATOM 535 HG2 GLU A 34 15.627 22.903 18.855 1.00 0.00 H ATOM 536 HG3 GLU A 34 15.903 24.425 17.977 1.00 0.00 H ATOM 537 H GLU A 34 15.553 26.760 18.681 1.00 0.00 H ATOM 538 N GLU A 35 12.871 25.063 21.712 1.00 22.44 N ATOM 539 CA GLU A 35 12.130 25.344 22.926 1.00 23.98 C ATOM 540 C GLU A 35 12.894 26.169 23.926 1.00 24.22 C ATOM 541 O GLU A 35 13.955 25.793 24.434 1.00 24.01 O ATOM 542 CB GLU A 35 11.692 24.045 23.627 1.00 25.51 C ATOM 543 CG GLU A 35 10.187 23.761 23.359 1.00 28.05 C ATOM 544 CD GLU A 35 9.346 24.952 23.708 1.00 29.45 C ATOM 545 OE1 GLU A 35 10.004 25.908 24.207 1.00 30.46 O ATOM 546 OE2 GLU A 35 8.158 25.046 23.527 1.00 30.84 O ATOM 547 HA GLU A 35 11.266 25.920 22.594 1.00 0.00 H ATOM 548 HB2 GLU A 35 12.287 23.214 23.248 1.00 0.00 H ATOM 549 HB3 GLU A 35 11.853 24.145 24.700 1.00 0.00 H ATOM 550 HG2 GLU A 35 10.051 23.525 22.304 1.00 0.00 H ATOM 551 HG3 GLU A 35 9.871 22.911 23.964 1.00 0.00 H ATOM 552 H GLU A 35 12.747 24.118 21.296 1.00 0.00 H ATOM 553 N MET A 36 12.352 27.332 24.186 1.00 24.98 N ATOM 554 CA MET A 36 12.894 28.353 25.075 1.00 26.55 C ATOM 555 C MET A 36 11.707 29.246 25.477 1.00 27.49 C ATOM 556 O MET A 36 10.588 29.170 24.984 1.00 27.12 O ATOM 557 CB MET A 36 14.013 29.193 24.520 1.00 26.96 C ATOM 558 CG MET A 36 13.577 30.145 23.440 1.00 27.69 C ATOM 559 SD MET A 36 15.102 30.921 22.731 1.00 29.42 S ATOM 560 CE MET A 36 15.406 32.165 24.003 1.00 28.70 C ATOM 561 HA MET A 36 13.362 27.840 25.915 1.00 0.00 H ATOM 562 HB2 MET A 36 14.446 29.772 25.336 1.00 0.00 H ATOM 563 HB3 MET A 36 14.771 28.527 24.107 1.00 0.00 H ATOM 564 HG2 MET A 36 12.929 30.914 23.861 1.00 0.00 H ATOM 565 HG3 MET A 36 13.038 29.604 22.662 1.00 0.00 H ATOM 566 HE1 MET A 36 14.548 32.834 24.067 1.00 0.00 H ATOM 567 HE2 MET A 36 15.556 31.672 24.963 1.00 0.00 H ATOM 568 HE3 MET A 36 16.297 32.738 23.744 1.00 0.00 H ATOM 569 H MET A 36 11.451 27.548 23.714 1.00 0.00 H ATOM 570 N ASN A 37 12.077 30.097 26.389 1.00 29.72 N ATOM 571 CA ASN A 37 11.045 31.036 26.975 1.00 31.70 C ATOM 572 C ASN A 37 11.287 32.465 26.551 1.00 31.04 C ATOM 573 O ASN A 37 12.393 33.014 26.700 1.00 31.16 O ATOM 574 CB ASN A 37 11.168 30.723 28.443 1.00 34.06 C ATOM 575 CG ASN A 37 10.216 31.340 29.415 1.00 35.92 C ATOM 576 OD1 ASN A 37 10.608 32.347 30.063 1.00 37.41 O ATOM 577 ND2 ASN A 37 9.066 30.661 29.551 1.00 36.58 N ATOM 578 HA ASN A 37 10.018 30.905 26.634 1.00 0.00 H ATOM 579 HB2 ASN A 37 11.068 29.642 28.545 1.00 0.00 H ATOM 580 HB3 ASN A 37 12.170 31.024 28.748 1.00 0.00 H ATOM 581 HD22 ASN A 37 8.871 29.841 28.942 1.00 0.00 H ATOM 582 HD21 ASN A 37 8.370 30.955 30.265 1.00 0.00 H ATOM 583 H ASN A 37 13.066 30.131 26.710 1.00 0.00 H ATOM 584 N LEU A 38 10.260 33.036 25.964 1.00 30.63 N ATOM 585 CA LEU A 38 10.355 34.437 25.523 1.00 30.54 C ATOM 586 C LEU A 38 9.331 35.126 26.414 1.00 31.33 C ATOM 587 O LEU A 38 8.425 34.483 26.941 1.00 30.98 O ATOM 588 CB LEU A 38 10.164 34.576 24.029 1.00 29.89 C ATOM 589 CG LEU A 38 11.381 34.035 23.262 1.00 29.89 C ATOM 590 CD1 LEU A 38 11.260 34.256 21.785 1.00 29.43 C ATOM 591 CD2 LEU A 38 12.584 34.793 23.854 1.00 29.72 C ATOM 592 HA LEU A 38 11.335 34.899 25.640 1.00 0.00 H ATOM 593 HB2 LEU A 38 9.277 34.017 23.730 1.00 0.00 H ATOM 594 HB3 LEU A 38 10.028 35.629 23.784 1.00 0.00 H ATOM 595 HG LEU A 38 11.481 32.955 23.373 1.00 0.00 H ATOM 596 HD21 LEU A 38 12.450 35.863 23.698 1.00 0.00 H ATOM 597 HD22 LEU A 38 12.653 34.586 24.922 1.00 0.00 H ATOM 598 HD23 LEU A 38 13.498 34.465 23.359 1.00 0.00 H ATOM 599 HD11 LEU A 38 10.370 33.747 21.414 1.00 0.00 H ATOM 600 HD12 LEU A 38 11.179 35.324 21.584 1.00 0.00 H ATOM 601 HD13 LEU A 38 12.143 33.857 21.286 1.00 0.00 H ATOM 602 H LEU A 38 9.382 32.500 25.811 1.00 0.00 H ATOM 603 N PRO A 39 9.572 36.391 26.547 1.00 32.64 N ATOM 604 CA PRO A 39 8.690 37.242 27.374 1.00 33.12 C ATOM 605 C PRO A 39 7.530 37.628 26.471 1.00 33.15 C ATOM 606 O PRO A 39 7.781 37.836 25.269 1.00 32.81 O ATOM 607 CB PRO A 39 9.620 38.425 27.664 1.00 33.57 C ATOM 608 CG PRO A 39 10.327 38.630 26.314 1.00 33.68 C ATOM 609 CD PRO A 39 10.665 37.185 25.916 1.00 33.43 C ATOM 610 HA PRO A 39 8.273 36.816 28.287 1.00 0.00 H ATOM 611 HD3 PRO A 39 10.659 37.066 24.832 1.00 0.00 H ATOM 612 HD2 PRO A 39 11.639 36.889 26.307 1.00 0.00 H ATOM 613 HG3 PRO A 39 11.228 39.233 26.425 1.00 0.00 H ATOM 614 HG2 PRO A 39 9.665 39.099 25.586 1.00 0.00 H ATOM 615 HB2 PRO A 39 9.054 39.311 27.951 1.00 0.00 H ATOM 616 HB3 PRO A 39 10.334 38.182 28.450 1.00 0.00 H ATOM 617 N GLY A 40 6.355 37.710 27.055 1.00 33.53 N ATOM 618 CA GLY A 40 5.175 38.141 26.290 1.00 34.06 C ATOM 619 C GLY A 40 4.115 37.064 26.141 1.00 34.28 C ATOM 620 O GLY A 40 4.202 35.946 26.641 1.00 33.95 O ATOM 621 HA3 GLY A 40 5.501 38.442 25.295 1.00 0.00 H ATOM 622 HA2 GLY A 40 4.728 38.995 26.799 1.00 0.00 H ATOM 623 H GLY A 40 6.259 37.469 28.062 1.00 0.00 H ATOM 624 N ARG A 41 3.072 37.496 25.439 1.00 35.02 N ATOM 625 CA ARG A 41 1.966 36.546 25.170 1.00 36.16 C ATOM 626 C ARG A 41 2.396 35.867 23.863 1.00 34.10 C ATOM 627 O ARG A 41 3.123 36.495 23.077 1.00 33.52 O ATOM 628 CB ARG A 41 0.618 37.231 25.061 1.00 39.42 C ATOM 629 CG ARG A 41 0.057 37.698 26.421 1.00 43.46 C ATOM 630 CD ARG A 41 -1.372 38.140 26.311 1.00 46.32 C ATOM 631 NE ARG A 41 -2.290 37.038 25.993 1.00 49.03 N ATOM 632 CZ ARG A 41 -2.752 36.110 26.845 1.00 50.18 C ATOM 633 NH1 ARG A 41 -2.362 36.079 28.134 1.00 51.02 N ATOM 634 NH2 ARG A 41 -3.678 35.226 26.416 1.00 50.63 N ATOM 635 HA ARG A 41 1.816 35.835 25.982 1.00 0.00 H ATOM 636 HB2 ARG A 41 0.723 38.101 24.413 1.00 0.00 H ATOM 637 HB3 ARG A 41 -0.090 36.532 24.616 1.00 0.00 H ATOM 638 HG2 ARG A 41 0.118 36.873 27.130 1.00 0.00 H ATOM 639 HG3 ARG A 41 0.658 38.532 26.783 1.00 0.00 H ATOM 640 HD2 ARG A 41 -1.444 38.891 25.524 1.00 0.00 H ATOM 641 HD3 ARG A 41 -1.674 38.581 27.261 1.00 0.00 H ATOM 642 HE ARG A 41 -2.615 36.970 25.007 1.00 0.00 H ATOM 643 HH12 ARG A 41 -2.736 35.349 28.773 1.00 0.00 H ATOM 644 HH11 ARG A 41 -1.687 36.786 28.490 1.00 0.00 H ATOM 645 HH22 ARG A 41 -4.045 34.501 27.065 1.00 0.00 H ATOM 646 HH21 ARG A 41 -4.024 35.270 25.436 1.00 0.00 H ATOM 647 H ARG A 41 3.033 38.474 25.088 1.00 0.00 H ATOM 648 N TRP A 42 1.997 34.629 23.717 1.00 31.93 N ATOM 649 CA TRP A 42 2.323 33.910 22.462 1.00 29.88 C ATOM 650 C TRP A 42 0.990 33.354 21.971 1.00 28.75 C ATOM 651 O TRP A 42 0.007 33.317 22.717 1.00 28.41 O ATOM 652 CB TRP A 42 3.426 32.901 22.683 1.00 29.49 C ATOM 653 CG TRP A 42 2.992 31.993 23.776 1.00 29.53 C ATOM 654 CD1 TRP A 42 3.257 32.150 25.097 1.00 29.73 C ATOM 655 CD2 TRP A 42 2.141 30.845 23.652 1.00 30.02 C ATOM 656 NE1 TRP A 42 2.659 31.133 25.800 1.00 30.12 N ATOM 657 CE2 TRP A 42 1.971 30.317 24.953 1.00 29.93 C ATOM 658 CE3 TRP A 42 1.529 30.201 22.576 1.00 29.97 C ATOM 659 CZ2 TRP A 42 1.200 29.196 25.214 1.00 29.97 C ATOM 660 CZ3 TRP A 42 0.772 29.073 22.838 1.00 29.98 C ATOM 661 CH2 TRP A 42 0.586 28.585 24.126 1.00 30.09 C ATOM 662 HA TRP A 42 2.745 34.545 21.683 1.00 0.00 H ATOM 663 HB2 TRP A 42 3.596 32.330 21.770 1.00 0.00 H ATOM 664 HB3 TRP A 42 4.346 33.412 22.967 1.00 0.00 H ATOM 665 HE1 TRP A 42 2.722 31.004 26.830 1.00 0.00 H ATOM 666 HD1 TRP A 42 3.850 32.955 25.531 1.00 0.00 H ATOM 667 HZ2 TRP A 42 1.080 28.810 26.226 1.00 0.00 H ATOM 668 HH2 TRP A 42 -0.049 27.713 24.285 1.00 0.00 H ATOM 669 HZ3 TRP A 42 0.305 28.548 22.005 1.00 0.00 H ATOM 670 HE3 TRP A 42 1.644 30.576 21.559 1.00 0.00 H ATOM 671 H TRP A 42 1.459 34.156 24.471 1.00 0.00 H ATOM 672 N LYS A 43 0.966 32.967 20.733 1.00 27.72 N ATOM 673 CA LYS A 43 -0.145 32.374 20.022 1.00 27.16 C ATOM 674 C LYS A 43 0.379 31.036 19.434 1.00 25.34 C ATOM 675 O LYS A 43 1.520 30.984 18.961 1.00 24.83 O ATOM 676 CB LYS A 43 -0.552 33.149 18.783 1.00 29.10 C ATOM 677 CG LYS A 43 -1.269 34.448 19.025 1.00 32.06 C ATOM 678 CD LYS A 43 -1.473 35.164 17.682 1.00 34.42 C ATOM 679 CE LYS A 43 -2.214 34.355 16.644 1.00 36.41 C ATOM 680 NZ LYS A 43 -3.494 33.693 17.085 1.00 37.56 N ATOM 681 HA LYS A 43 -0.978 32.315 20.722 1.00 0.00 H ATOM 682 HB2 LYS A 43 0.352 33.367 18.214 1.00 0.00 H ATOM 683 HB3 LYS A 43 -1.208 32.511 18.190 1.00 0.00 H ATOM 684 HG2 LYS A 43 -2.237 34.251 19.485 1.00 0.00 H ATOM 685 HG3 LYS A 43 -0.674 35.076 19.688 1.00 0.00 H ATOM 686 HD2 LYS A 43 -2.036 36.079 17.866 1.00 0.00 H ATOM 687 HD3 LYS A 43 -0.492 35.418 17.279 1.00 0.00 H ATOM 688 HE2 LYS A 43 -1.541 33.572 16.294 1.00 0.00 H ATOM 689 HE3 LYS A 43 -2.456 35.022 15.816 1.00 0.00 H ATOM 690 HZ1 LYS A 43 -3.292 33.035 17.864 1.00 0.00 H ATOM 691 HZ2 LYS A 43 -4.165 34.419 17.408 1.00 0.00 H ATOM 692 HZ3 LYS A 43 -3.906 33.170 16.286 1.00 0.00 H ATOM 693 H LYS A 43 1.844 33.098 20.191 1.00 0.00 H ATOM 694 N PRO A 44 -0.493 30.062 19.458 1.00 23.68 N ATOM 695 CA PRO A 44 -0.152 28.752 18.886 1.00 22.27 C ATOM 696 C PRO A 44 -0.280 28.884 17.365 1.00 20.51 C ATOM 697 O PRO A 44 -1.135 29.599 16.843 1.00 19.27 O ATOM 698 CB PRO A 44 -1.149 27.807 19.480 1.00 22.60 C ATOM 699 CG PRO A 44 -2.253 28.628 20.063 1.00 23.13 C ATOM 700 CD PRO A 44 -1.860 30.082 19.973 1.00 23.48 C ATOM 701 HA PRO A 44 0.856 28.396 19.098 1.00 0.00 H ATOM 702 HD3 PRO A 44 -2.521 30.618 19.292 1.00 0.00 H ATOM 703 HD2 PRO A 44 -1.895 30.552 20.956 1.00 0.00 H ATOM 704 HG3 PRO A 44 -2.407 28.351 21.106 1.00 0.00 H ATOM 705 HG2 PRO A 44 -3.173 28.459 19.504 1.00 0.00 H ATOM 706 HB2 PRO A 44 -1.543 27.147 18.707 1.00 0.00 H ATOM 707 HB3 PRO A 44 -0.677 27.209 20.260 1.00 0.00 H ATOM 708 N LYS A 45 0.610 28.167 16.728 1.00 19.82 N ATOM 709 CA LYS A 45 0.655 28.129 15.242 1.00 19.44 C ATOM 710 C LYS A 45 1.138 26.761 14.793 1.00 18.72 C ATOM 711 O LYS A 45 1.761 26.036 15.564 1.00 18.94 O ATOM 712 CB LYS A 45 1.564 29.223 14.733 1.00 19.79 C ATOM 713 CG LYS A 45 1.685 29.427 13.228 1.00 20.78 C ATOM 714 CD LYS A 45 2.672 30.571 13.015 1.00 21.84 C ATOM 715 CE LYS A 45 3.045 30.807 11.564 1.00 22.87 C ATOM 716 NZ LYS A 45 2.206 31.889 10.994 1.00 23.07 N ATOM 717 HA LYS A 45 -0.341 28.298 14.832 1.00 0.00 H ATOM 718 HB2 LYS A 45 1.207 30.161 15.157 1.00 0.00 H ATOM 719 HB3 LYS A 45 2.564 29.012 15.111 1.00 0.00 H ATOM 720 HG2 LYS A 45 2.056 28.518 12.755 1.00 0.00 H ATOM 721 HG3 LYS A 45 0.714 29.685 12.805 1.00 0.00 H ATOM 722 HD2 LYS A 45 2.226 31.485 13.407 1.00 0.00 H ATOM 723 HD3 LYS A 45 3.582 30.345 13.570 1.00 0.00 H ATOM 724 HE2 LYS A 45 2.887 29.890 10.997 1.00 0.00 H ATOM 725 HE3 LYS A 45 4.095 31.094 11.503 1.00 0.00 H ATOM 726 HZ1 LYS A 45 1.204 31.615 11.050 1.00 0.00 H ATOM 727 HZ2 LYS A 45 2.358 32.765 11.534 1.00 0.00 H ATOM 728 HZ3 LYS A 45 2.469 32.043 10.000 1.00 0.00 H ATOM 729 H LYS A 45 1.301 27.612 17.272 1.00 0.00 H ATOM 730 N MET A 46 0.823 26.403 13.568 1.00 18.12 N ATOM 731 CA MET A 46 1.303 25.165 12.960 1.00 17.99 C ATOM 732 C MET A 46 2.150 25.480 11.729 1.00 15.75 C ATOM 733 O MET A 46 1.590 26.208 10.882 1.00 15.36 O ATOM 734 CB MET A 46 0.139 24.228 12.624 1.00 20.09 C ATOM 735 CG MET A 46 0.774 22.912 13.159 1.00 24.20 C ATOM 736 SD MET A 46 -0.568 22.205 14.065 1.00 27.64 S ATOM 737 CE MET A 46 0.251 21.585 15.520 1.00 27.98 C ATOM 738 HA MET A 46 1.934 24.643 13.679 1.00 0.00 H ATOM 739 HB2 MET A 46 -0.775 24.494 13.156 1.00 0.00 H ATOM 740 HB3 MET A 46 -0.064 24.186 11.554 1.00 0.00 H ATOM 741 HG2 MET A 46 1.626 23.117 13.807 1.00 0.00 H ATOM 742 HG3 MET A 46 1.088 22.262 12.342 1.00 0.00 H ATOM 743 HE1 MET A 46 1.002 20.851 15.228 1.00 0.00 H ATOM 744 HE2 MET A 46 0.732 22.411 16.044 1.00 0.00 H ATOM 745 HE3 MET A 46 -0.482 21.115 16.175 1.00 0.00 H ATOM 746 H MET A 46 0.207 27.027 13.009 1.00 0.00 H ATOM 747 N ILE A 47 3.381 25.006 11.662 1.00 13.73 N ATOM 748 CA ILE A 47 4.234 25.265 10.484 1.00 12.32 C ATOM 749 C ILE A 47 4.574 23.906 9.884 1.00 12.43 C ATOM 750 O ILE A 47 4.765 22.941 10.660 1.00 13.61 O ATOM 751 CB ILE A 47 5.478 26.133 10.805 1.00 12.30 C ATOM 752 CG1 ILE A 47 6.338 25.345 11.823 1.00 12.32 C ATOM 753 CG2 ILE A 47 5.143 27.569 11.276 1.00 10.69 C ATOM 754 CD1 ILE A 47 7.633 26.070 12.271 1.00 13.38 C ATOM 755 HA ILE A 47 3.698 25.872 9.754 1.00 0.00 H ATOM 756 HB ILE A 47 6.041 26.305 9.888 1.00 0.00 H ATOM 757 HG12 ILE A 47 5.730 25.156 12.708 1.00 0.00 H ATOM 758 HG13 ILE A 47 6.620 24.396 11.368 1.00 0.00 H ATOM 759 HD11 ILE A 47 8.263 26.256 11.401 1.00 0.00 H ATOM 760 HD12 ILE A 47 7.373 27.018 12.743 1.00 0.00 H ATOM 761 HD13 ILE A 47 8.171 25.444 12.983 1.00 0.00 H ATOM 762 HG21 ILE A 47 4.584 28.085 10.495 1.00 0.00 H ATOM 763 HG22 ILE A 47 4.542 27.521 12.184 1.00 0.00 H ATOM 764 HG23 ILE A 47 6.068 28.108 11.479 1.00 0.00 H ATOM 765 H ILE A 47 3.756 24.442 12.451 1.00 0.00 H ATOM 766 N GLY A 48 4.588 23.792 8.591 1.00 11.45 N ATOM 767 CA GLY A 48 4.835 22.510 7.911 1.00 12.09 C ATOM 768 C GLY A 48 6.121 22.584 7.123 1.00 12.30 C ATOM 769 O GLY A 48 6.520 23.675 6.647 1.00 13.30 O ATOM 770 HA3 GLY A 48 4.008 22.295 7.234 1.00 0.00 H ATOM 771 HA2 GLY A 48 4.911 21.716 8.654 1.00 0.00 H ATOM 772 H GLY A 48 4.418 24.640 8.013 1.00 0.00 H ATOM 773 N GLY A 49 6.787 21.483 7.014 1.00 12.01 N ATOM 774 CA GLY A 49 8.051 21.384 6.264 1.00 12.10 C ATOM 775 C GLY A 49 8.050 19.949 5.704 1.00 12.85 C ATOM 776 O GLY A 49 6.999 19.304 5.614 1.00 13.28 O ATOM 777 HA3 GLY A 49 8.905 21.541 6.923 1.00 0.00 H ATOM 778 HA2 GLY A 49 8.079 22.114 5.455 1.00 0.00 H ATOM 779 H GLY A 49 6.415 20.629 7.476 1.00 0.00 H ATOM 780 N ILE A 50 9.268 19.537 5.480 1.00 13.37 N ATOM 781 CA ILE A 50 9.527 18.166 5.019 1.00 14.32 C ATOM 782 C ILE A 50 9.255 17.293 6.247 1.00 14.99 C ATOM 783 O ILE A 50 9.864 17.612 7.331 1.00 15.85 O ATOM 784 CB ILE A 50 11.059 18.090 4.678 1.00 14.17 C ATOM 785 CG1 ILE A 50 11.184 18.882 3.358 1.00 14.25 C ATOM 786 CG2 ILE A 50 11.549 16.637 4.744 1.00 14.24 C ATOM 787 CD1 ILE A 50 11.908 18.184 2.232 1.00 15.24 C ATOM 788 HA ILE A 50 8.932 17.865 4.157 1.00 0.00 H ATOM 789 HB ILE A 50 11.746 18.551 5.388 1.00 0.00 H ATOM 790 HG12 ILE A 50 10.177 19.116 3.013 1.00 0.00 H ATOM 791 HG13 ILE A 50 11.717 19.808 3.574 1.00 0.00 H ATOM 792 HD11 ILE A 50 12.926 17.953 2.544 1.00 0.00 H ATOM 793 HD12 ILE A 50 11.385 17.261 1.983 1.00 0.00 H ATOM 794 HD13 ILE A 50 11.933 18.836 1.359 1.00 0.00 H ATOM 795 HG21 ILE A 50 11.388 16.246 5.749 1.00 0.00 H ATOM 796 HG22 ILE A 50 10.994 16.035 4.025 1.00 0.00 H ATOM 797 HG23 ILE A 50 12.612 16.602 4.505 1.00 0.00 H ATOM 798 H ILE A 50 10.066 20.187 5.630 1.00 0.00 H ATOM 799 N GLY A 51 8.393 16.331 6.038 1.00 14.67 N ATOM 800 CA GLY A 51 8.117 15.476 7.237 1.00 14.72 C ATOM 801 C GLY A 51 6.805 15.895 7.832 1.00 14.61 C ATOM 802 O GLY A 51 6.303 15.059 8.608 1.00 16.08 O ATOM 803 HA3 GLY A 51 8.912 15.606 7.972 1.00 0.00 H ATOM 804 HA2 GLY A 51 8.067 14.429 6.938 1.00 0.00 H ATOM 805 H GLY A 51 7.937 16.173 5.117 1.00 0.00 H ATOM 806 N GLY A 52 6.219 17.014 7.485 1.00 13.48 N ATOM 807 CA GLY A 52 4.919 17.370 8.042 1.00 12.51 C ATOM 808 C GLY A 52 5.012 18.631 8.886 1.00 13.11 C ATOM 809 O GLY A 52 5.971 19.417 8.846 1.00 13.54 O ATOM 810 HA3 GLY A 52 4.562 16.550 8.665 1.00 0.00 H ATOM 811 HA2 GLY A 52 4.216 17.538 7.226 1.00 0.00 H ATOM 812 H GLY A 52 6.684 17.652 6.808 1.00 0.00 H ATOM 813 N PHE A 53 3.974 18.805 9.670 1.00 13.37 N ATOM 814 CA PHE A 53 3.745 19.933 10.551 1.00 13.70 C ATOM 815 C PHE A 53 4.175 19.773 11.977 1.00 14.52 C ATOM 816 O PHE A 53 4.138 18.627 12.492 1.00 15.90 O ATOM 817 CB PHE A 53 2.211 20.193 10.514 1.00 12.40 C ATOM 818 CG PHE A 53 1.869 20.907 9.264 1.00 12.20 C ATOM 819 CD1 PHE A 53 1.738 20.178 8.064 1.00 12.51 C ATOM 820 CD2 PHE A 53 1.736 22.284 9.276 1.00 11.92 C ATOM 821 CE1 PHE A 53 1.427 20.901 6.901 1.00 12.33 C ATOM 822 CE2 PHE A 53 1.415 23.003 8.143 1.00 11.94 C ATOM 823 CZ PHE A 53 1.254 22.294 6.951 1.00 12.11 C ATOM 824 HA PHE A 53 4.363 20.753 10.185 1.00 0.00 H ATOM 825 HB2 PHE A 53 1.679 19.242 10.549 1.00 0.00 H ATOM 826 HB3 PHE A 53 1.923 20.801 11.372 1.00 0.00 H ATOM 827 HD2 PHE A 53 1.890 22.819 10.213 1.00 0.00 H ATOM 828 HE2 PHE A 53 1.292 24.085 8.177 1.00 0.00 H ATOM 829 HZ PHE A 53 0.989 22.832 6.041 1.00 0.00 H ATOM 830 HE1 PHE A 53 1.319 20.377 5.951 1.00 0.00 H ATOM 831 HD1 PHE A 53 1.873 19.097 8.040 1.00 0.00 H ATOM 832 H PHE A 53 3.246 18.062 9.658 1.00 0.00 H ATOM 833 N ILE A 54 4.505 20.896 12.594 1.00 14.42 N ATOM 834 CA ILE A 54 4.856 20.978 14.013 1.00 13.71 C ATOM 835 C ILE A 54 4.063 22.199 14.577 1.00 13.73 C ATOM 836 O ILE A 54 3.708 23.166 13.903 1.00 12.33 O ATOM 837 CB ILE A 54 6.359 21.055 14.396 1.00 13.52 C ATOM 838 CG1 ILE A 54 7.129 22.177 13.643 1.00 12.93 C ATOM 839 CG2 ILE A 54 7.087 19.702 14.262 1.00 13.11 C ATOM 840 CD1 ILE A 54 8.398 22.682 14.365 1.00 12.12 C ATOM 841 HA ILE A 54 4.584 20.021 14.459 1.00 0.00 H ATOM 842 HB ILE A 54 6.360 21.321 15.453 1.00 0.00 H ATOM 843 HG12 ILE A 54 7.423 21.792 12.667 1.00 0.00 H ATOM 844 HG13 ILE A 54 6.454 23.022 13.510 1.00 0.00 H ATOM 845 HD11 ILE A 54 8.124 23.085 15.340 1.00 0.00 H ATOM 846 HD12 ILE A 54 9.094 21.853 14.496 1.00 0.00 H ATOM 847 HD13 ILE A 54 8.869 23.462 13.767 1.00 0.00 H ATOM 848 HG21 ILE A 54 6.615 18.970 14.918 1.00 0.00 H ATOM 849 HG22 ILE A 54 7.026 19.359 13.229 1.00 0.00 H ATOM 850 HG23 ILE A 54 8.133 19.824 14.544 1.00 0.00 H ATOM 851 H ILE A 54 4.516 21.774 12.037 1.00 0.00 H ATOM 852 N LYS A 55 3.780 22.057 15.851 1.00 14.28 N ATOM 853 CA LYS A 55 3.060 23.071 16.642 1.00 14.94 C ATOM 854 C LYS A 55 4.153 23.894 17.331 1.00 13.69 C ATOM 855 O LYS A 55 5.051 23.276 17.940 1.00 13.76 O ATOM 856 CB LYS A 55 2.100 22.482 17.660 1.00 17.09 C ATOM 857 CG LYS A 55 1.111 23.552 18.134 1.00 20.41 C ATOM 858 CD LYS A 55 0.156 23.043 19.206 1.00 23.31 C ATOM 859 CE LYS A 55 0.300 23.935 20.454 1.00 25.46 C ATOM 860 NZ LYS A 55 -1.053 24.270 21.008 1.00 27.02 N ATOM 861 HA LYS A 55 2.425 23.672 15.991 1.00 0.00 H ATOM 862 HB2 LYS A 55 1.550 21.660 17.203 1.00 0.00 H ATOM 863 HB3 LYS A 55 2.665 22.109 18.514 1.00 0.00 H ATOM 864 HG2 LYS A 55 1.675 24.392 18.540 1.00 0.00 H ATOM 865 HG3 LYS A 55 0.526 23.889 17.278 1.00 0.00 H ATOM 866 HD2 LYS A 55 -0.869 23.089 18.837 1.00 0.00 H ATOM 867 HD3 LYS A 55 0.404 22.012 19.460 1.00 0.00 H ATOM 868 HE2 LYS A 55 0.816 24.856 20.182 1.00 0.00 H ATOM 869 HE3 LYS A 55 0.879 23.406 21.211 1.00 0.00 H ATOM 870 HZ1 LYS A 55 -1.605 24.777 20.287 1.00 0.00 H ATOM 871 HZ2 LYS A 55 -1.546 23.393 21.270 1.00 0.00 H ATOM 872 HZ3 LYS A 55 -0.943 24.872 21.849 1.00 0.00 H ATOM 873 H LYS A 55 4.080 21.183 16.327 1.00 0.00 H ATOM 874 N VAL A 56 4.065 25.195 17.175 1.00 12.15 N ATOM 875 CA VAL A 56 5.058 26.086 17.772 1.00 11.91 C ATOM 876 C VAL A 56 4.280 27.186 18.505 1.00 12.07 C ATOM 877 O VAL A 56 3.072 27.316 18.327 1.00 11.48 O ATOM 878 CB VAL A 56 5.998 26.648 16.671 1.00 11.05 C ATOM 879 CG1 VAL A 56 6.784 25.611 15.915 1.00 10.36 C ATOM 880 CG2 VAL A 56 5.200 27.555 15.727 1.00 10.22 C ATOM 881 HA VAL A 56 5.702 25.566 18.481 1.00 0.00 H ATOM 882 HB VAL A 56 6.761 27.229 17.188 1.00 0.00 H ATOM 883 HG11 VAL A 56 7.414 25.056 16.610 1.00 0.00 H ATOM 884 HG12 VAL A 56 6.096 24.926 15.419 1.00 0.00 H ATOM 885 HG13 VAL A 56 7.409 26.103 15.170 1.00 0.00 H ATOM 886 HG21 VAL A 56 4.400 26.979 15.262 1.00 0.00 H ATOM 887 HG22 VAL A 56 4.772 28.381 16.295 1.00 0.00 H ATOM 888 HG23 VAL A 56 5.863 27.947 14.956 1.00 0.00 H ATOM 889 H VAL A 56 3.281 25.595 16.621 1.00 0.00 H ATOM 890 N ARG A 57 5.015 27.989 19.215 1.00 13.01 N ATOM 891 CA ARG A 57 4.363 29.140 19.945 1.00 14.87 C ATOM 892 C ARG A 57 4.830 30.372 19.233 1.00 14.21 C ATOM 893 O ARG A 57 6.042 30.479 19.000 1.00 14.52 O ATOM 894 CB ARG A 57 4.772 29.066 21.417 1.00 16.90 C ATOM 895 CG ARG A 57 4.216 27.808 22.139 1.00 19.21 C ATOM 896 CD ARG A 57 4.603 27.883 23.586 1.00 20.46 C ATOM 897 NE ARG A 57 6.039 27.477 23.739 1.00 22.12 N ATOM 898 CZ ARG A 57 6.776 28.380 24.411 1.00 22.98 C ATOM 899 NH1 ARG A 57 6.137 29.521 24.741 1.00 23.30 N ATOM 900 NH2 ARG A 57 8.001 28.073 24.773 1.00 23.55 N ATOM 901 HA ARG A 57 3.273 29.127 19.941 1.00 0.00 H ATOM 902 HB2 ARG A 57 5.860 29.047 21.475 1.00 0.00 H ATOM 903 HB3 ARG A 57 4.397 29.954 21.927 1.00 0.00 H ATOM 904 HG2 ARG A 57 3.130 27.781 22.049 1.00 0.00 H ATOM 905 HG3 ARG A 57 4.639 26.909 21.691 1.00 0.00 H ATOM 906 HD2 ARG A 57 3.971 27.212 24.167 1.00 0.00 H ATOM 907 HD3 ARG A 57 4.473 28.904 23.945 1.00 0.00 H ATOM 908 HE ARG A 57 6.426 26.588 23.364 1.00 0.00 H ATOM 909 HH12 ARG A 57 6.641 30.267 25.262 1.00 0.00 H ATOM 910 HH11 ARG A 57 5.141 29.655 24.475 1.00 0.00 H ATOM 911 HH22 ARG A 57 8.578 28.764 25.293 1.00 0.00 H ATOM 912 HH21 ARG A 57 8.393 27.139 24.540 1.00 0.00 H ATOM 913 H ARG A 57 6.042 27.841 19.280 1.00 0.00 H ATOM 914 N GLN A 58 4.016 31.273 18.836 1.00 15.03 N ATOM 915 CA GLN A 58 4.438 32.478 18.101 1.00 16.15 C ATOM 916 C GLN A 58 4.536 33.704 19.000 1.00 16.89 C ATOM 917 O GLN A 58 3.533 34.092 19.605 1.00 16.42 O ATOM 918 CB GLN A 58 3.416 32.714 17.004 1.00 16.21 C ATOM 919 CG GLN A 58 3.543 34.068 16.375 1.00 17.87 C ATOM 920 CD GLN A 58 2.357 34.374 15.480 1.00 19.35 C ATOM 921 OE1 GLN A 58 1.679 33.480 14.971 1.00 20.62 O ATOM 922 NE2 GLN A 58 2.146 35.665 15.264 1.00 19.76 N ATOM 923 HA GLN A 58 5.436 32.319 17.693 1.00 0.00 H ATOM 924 HB2 GLN A 58 3.552 31.957 16.232 1.00 0.00 H ATOM 925 HB3 GLN A 58 2.418 32.620 17.431 1.00 0.00 H ATOM 926 HG2 GLN A 58 3.599 34.821 17.161 1.00 0.00 H ATOM 927 HG3 GLN A 58 4.455 34.099 15.779 1.00 0.00 H ATOM 928 HE22 GLN A 58 2.752 36.375 15.722 1.00 0.00 H ATOM 929 HE21 GLN A 58 1.374 35.968 14.636 1.00 0.00 H ATOM 930 H GLN A 58 3.004 31.150 19.042 1.00 0.00 H ATOM 931 N TYR A 59 5.696 34.319 19.015 1.00 17.89 N ATOM 932 CA TYR A 59 5.916 35.572 19.770 1.00 19.51 C ATOM 933 C TYR A 59 6.145 36.703 18.771 1.00 20.74 C ATOM 934 O TYR A 59 7.008 36.533 17.891 1.00 20.96 O ATOM 935 CB TYR A 59 7.162 35.459 20.667 1.00 19.33 C ATOM 936 CG TYR A 59 7.081 34.478 21.811 1.00 19.83 C ATOM 937 CD1 TYR A 59 7.409 33.126 21.683 1.00 19.77 C ATOM 938 CD2 TYR A 59 6.678 34.938 23.079 1.00 19.93 C ATOM 939 CE1 TYR A 59 7.344 32.249 22.768 1.00 20.19 C ATOM 940 CE2 TYR A 59 6.622 34.068 24.161 1.00 20.36 C ATOM 941 CZ TYR A 59 6.940 32.733 24.006 1.00 20.52 C ATOM 942 OH TYR A 59 6.865 31.944 25.126 1.00 21.41 O ATOM 943 HA TYR A 59 5.045 35.765 20.396 1.00 0.00 H ATOM 944 HB3 TYR A 59 7.357 36.445 21.089 1.00 0.00 H ATOM 945 HB2 TYR A 59 8.000 35.163 20.035 1.00 0.00 H ATOM 946 HD2 TYR A 59 6.408 35.985 23.213 1.00 0.00 H ATOM 947 HE2 TYR A 59 6.325 34.442 25.141 1.00 0.00 H ATOM 948 HE1 TYR A 59 7.607 31.198 22.645 1.00 0.00 H ATOM 949 HD1 TYR A 59 7.724 32.746 20.711 1.00 0.00 H ATOM 950 HH TYR A 59 7.114 31.015 24.891 1.00 0.00 H ATOM 951 H TYR A 59 6.487 33.911 18.478 1.00 0.00 H ATOM 952 N ASP A 60 5.498 37.827 18.910 1.00 22.98 N ATOM 953 CA ASP A 60 5.723 38.956 17.977 1.00 25.21 C ATOM 954 C ASP A 60 6.715 39.948 18.549 1.00 26.25 C ATOM 955 O ASP A 60 6.960 40.062 19.760 1.00 26.87 O ATOM 956 CB ASP A 60 4.400 39.613 17.631 1.00 26.52 C ATOM 957 CG ASP A 60 3.419 38.611 17.048 1.00 27.85 C ATOM 958 OD1 ASP A 60 3.745 37.842 16.141 1.00 28.55 O ATOM 959 OD2 ASP A 60 2.270 38.603 17.552 1.00 29.31 O ATOM 960 HA ASP A 60 6.160 38.571 17.056 1.00 0.00 H ATOM 961 HB2 ASP A 60 3.971 40.045 18.535 1.00 0.00 H ATOM 962 HB3 ASP A 60 4.576 40.403 16.901 1.00 0.00 H ATOM 963 H ASP A 60 4.814 37.932 19.687 1.00 0.00 H ATOM 964 N GLN A 61 7.295 40.701 17.650 1.00 27.41 N ATOM 965 CA GLN A 61 8.233 41.767 17.981 1.00 28.39 C ATOM 966 C GLN A 61 9.370 41.392 18.884 1.00 27.38 C ATOM 967 O GLN A 61 9.665 42.130 19.863 1.00 27.83 O ATOM 968 CB GLN A 61 7.433 42.963 18.598 1.00 30.89 C ATOM 969 CG GLN A 61 6.587 43.627 17.513 1.00 34.29 C ATOM 970 CD GLN A 61 5.598 44.646 17.993 1.00 36.39 C ATOM 971 OE1 GLN A 61 4.635 44.998 17.270 1.00 38.21 O ATOM 972 NE2 GLN A 61 5.754 45.175 19.217 1.00 37.11 N ATOM 973 HA GLN A 61 8.717 42.032 17.041 1.00 0.00 H ATOM 974 HB2 GLN A 61 6.782 42.594 19.391 1.00 0.00 H ATOM 975 HB3 GLN A 61 8.130 43.692 19.011 1.00 0.00 H ATOM 976 HG2 GLN A 61 7.264 44.120 16.815 1.00 0.00 H ATOM 977 HG3 GLN A 61 6.036 42.844 16.992 1.00 0.00 H ATOM 978 HE22 GLN A 61 6.554 44.880 19.813 1.00 0.00 H ATOM 979 HE21 GLN A 61 5.075 45.880 19.569 1.00 0.00 H ATOM 980 H GLN A 61 7.076 40.530 16.648 1.00 0.00 H ATOM 981 N ILE A 62 10.066 40.322 18.597 1.00 25.58 N ATOM 982 CA ILE A 62 11.217 39.915 19.404 1.00 23.90 C ATOM 983 C ILE A 62 12.440 40.520 18.756 1.00 23.72 C ATOM 984 O ILE A 62 12.480 40.587 17.533 1.00 23.47 O ATOM 985 CB ILE A 62 11.254 38.346 19.428 1.00 23.52 C ATOM 986 CG1 ILE A 62 9.920 37.853 20.026 1.00 22.91 C ATOM 987 CG2 ILE A 62 12.481 37.837 20.215 1.00 23.78 C ATOM 988 CD1 ILE A 62 9.816 38.189 21.543 1.00 23.21 C ATOM 989 HA ILE A 62 11.167 40.259 20.437 1.00 0.00 H ATOM 990 HB ILE A 62 11.361 37.946 18.420 1.00 0.00 H ATOM 991 HG12 ILE A 62 9.096 38.334 19.499 1.00 0.00 H ATOM 992 HG13 ILE A 62 9.851 36.773 19.897 1.00 0.00 H ATOM 993 HD11 ILE A 62 10.634 37.706 22.078 1.00 0.00 H ATOM 994 HD12 ILE A 62 9.878 39.269 21.680 1.00 0.00 H ATOM 995 HD13 ILE A 62 8.863 37.827 21.930 1.00 0.00 H ATOM 996 HG21 ILE A 62 13.392 38.203 19.741 1.00 0.00 H ATOM 997 HG22 ILE A 62 12.431 38.203 21.240 1.00 0.00 H ATOM 998 HG23 ILE A 62 12.483 36.747 20.217 1.00 0.00 H ATOM 999 H ILE A 62 9.794 39.746 17.775 1.00 0.00 H ATOM 1000 N LEU A 63 13.392 40.962 19.528 1.00 24.32 N ATOM 1001 CA LEU A 63 14.633 41.512 18.967 1.00 24.73 C ATOM 1002 C LEU A 63 15.677 40.395 18.922 1.00 24.23 C ATOM 1003 O LEU A 63 15.826 39.639 19.884 1.00 24.07 O ATOM 1004 CB LEU A 63 15.093 42.755 19.735 1.00 26.11 C ATOM 1005 CG LEU A 63 16.569 43.138 19.514 1.00 27.21 C ATOM 1006 CD1 LEU A 63 16.861 43.544 18.077 1.00 27.37 C ATOM 1007 CD2 LEU A 63 16.911 44.329 20.426 1.00 28.08 C ATOM 1008 HA LEU A 63 14.468 41.862 17.948 1.00 0.00 H ATOM 1009 HB2 LEU A 63 14.473 43.596 19.423 1.00 0.00 H ATOM 1010 HB3 LEU A 63 14.945 42.571 20.799 1.00 0.00 H ATOM 1011 HG LEU A 63 17.172 42.260 19.745 1.00 0.00 H ATOM 1012 HD21 LEU A 63 16.267 45.173 20.176 1.00 0.00 H ATOM 1013 HD22 LEU A 63 16.753 44.045 21.467 1.00 0.00 H ATOM 1014 HD23 LEU A 63 17.954 44.610 20.279 1.00 0.00 H ATOM 1015 HD11 LEU A 63 16.628 42.713 17.411 1.00 0.00 H ATOM 1016 HD12 LEU A 63 16.248 44.406 17.813 1.00 0.00 H ATOM 1017 HD13 LEU A 63 17.915 43.803 17.981 1.00 0.00 H ATOM 1018 H LEU A 63 13.271 40.925 20.560 1.00 0.00 H ATOM 1019 N ILE A 64 16.359 40.301 17.824 1.00 24.12 N ATOM 1020 CA ILE A 64 17.420 39.329 17.628 1.00 25.55 C ATOM 1021 C ILE A 64 18.603 40.128 17.016 1.00 26.16 C ATOM 1022 O ILE A 64 18.376 41.089 16.300 1.00 26.29 O ATOM 1023 CB ILE A 64 17.158 38.076 16.748 1.00 24.98 C ATOM 1024 CG1 ILE A 64 16.003 37.196 17.290 1.00 25.32 C ATOM 1025 CG2 ILE A 64 18.415 37.156 16.613 1.00 24.21 C ATOM 1026 CD1 ILE A 64 16.264 35.698 16.871 1.00 25.91 C ATOM 1027 HA ILE A 64 17.583 38.881 18.608 1.00 0.00 H ATOM 1028 HB ILE A 64 16.891 38.486 15.774 1.00 0.00 H ATOM 1029 HG12 ILE A 64 15.964 37.271 18.377 1.00 0.00 H ATOM 1030 HG13 ILE A 64 15.056 37.534 16.869 1.00 0.00 H ATOM 1031 HD11 ILE A 64 16.303 35.628 15.784 1.00 0.00 H ATOM 1032 HD12 ILE A 64 17.212 35.364 17.293 1.00 0.00 H ATOM 1033 HD13 ILE A 64 15.456 35.071 17.248 1.00 0.00 H ATOM 1034 HG21 ILE A 64 19.229 37.720 16.157 1.00 0.00 H ATOM 1035 HG22 ILE A 64 18.719 36.812 17.601 1.00 0.00 H ATOM 1036 HG23 ILE A 64 18.170 36.298 15.987 1.00 0.00 H ATOM 1037 H ILE A 64 16.136 40.953 17.045 1.00 0.00 H ATOM 1038 N GLU A 65 19.739 39.609 17.326 1.00 27.52 N ATOM 1039 CA GLU A 65 21.014 40.197 16.840 1.00 30.06 C ATOM 1040 C GLU A 65 21.648 39.109 16.001 1.00 30.09 C ATOM 1041 O GLU A 65 21.916 38.005 16.522 1.00 30.25 O ATOM 1042 CB GLU A 65 21.745 40.585 18.104 1.00 31.77 C ATOM 1043 CG GLU A 65 23.050 41.333 18.103 1.00 34.72 C ATOM 1044 CD GLU A 65 23.067 42.504 19.068 1.00 36.73 C ATOM 1045 OE1 GLU A 65 22.473 42.477 20.153 1.00 37.90 O ATOM 1046 OE2 GLU A 65 23.702 43.500 18.596 1.00 37.63 O ATOM 1047 HA GLU A 65 20.968 41.085 16.209 1.00 0.00 H ATOM 1048 HB2 GLU A 65 21.049 41.198 18.677 1.00 0.00 H ATOM 1049 HB3 GLU A 65 21.933 39.654 18.639 1.00 0.00 H ATOM 1050 HG2 GLU A 65 23.846 40.642 18.381 1.00 0.00 H ATOM 1051 HG3 GLU A 65 23.233 41.710 17.097 1.00 0.00 H ATOM 1052 H GLU A 65 19.765 38.762 17.928 1.00 0.00 H ATOM 1053 N ILE A 66 21.803 39.313 14.715 1.00 30.54 N ATOM 1054 CA ILE A 66 22.376 38.292 13.824 1.00 31.28 C ATOM 1055 C ILE A 66 23.725 38.784 13.342 1.00 32.33 C ATOM 1056 O ILE A 66 23.798 39.711 12.522 1.00 32.52 O ATOM 1057 CB ILE A 66 21.433 37.877 12.654 1.00 30.93 C ATOM 1058 CG1 ILE A 66 20.099 37.305 13.167 1.00 30.49 C ATOM 1059 CG2 ILE A 66 22.167 36.834 11.741 1.00 31.12 C ATOM 1060 CD1 ILE A 66 18.805 38.009 12.793 1.00 30.08 C ATOM 1061 HA ILE A 66 22.503 37.370 14.391 1.00 0.00 H ATOM 1062 HB ILE A 66 21.194 38.768 12.074 1.00 0.00 H ATOM 1063 HG12 ILE A 66 20.026 36.282 12.797 1.00 0.00 H ATOM 1064 HG13 ILE A 66 20.154 37.293 14.256 1.00 0.00 H ATOM 1065 HD11 ILE A 66 18.828 39.032 13.168 1.00 0.00 H ATOM 1066 HD12 ILE A 66 18.700 38.021 11.708 1.00 0.00 H ATOM 1067 HD13 ILE A 66 17.963 37.477 13.235 1.00 0.00 H ATOM 1068 HG21 ILE A 66 23.075 37.282 11.337 1.00 0.00 H ATOM 1069 HG22 ILE A 66 22.426 35.955 12.331 1.00 0.00 H ATOM 1070 HG23 ILE A 66 21.509 36.543 10.922 1.00 0.00 H ATOM 1071 H ILE A 66 21.511 40.226 14.312 1.00 0.00 H ATOM 1072 N CYS A 67 24.760 38.192 13.912 1.00 33.93 N ATOM 1073 CA CYS A 67 26.106 38.643 13.482 1.00 35.69 C ATOM 1074 C CYS A 67 26.199 40.156 13.622 1.00 35.90 C ATOM 1075 O CYS A 67 26.483 40.897 12.652 1.00 36.43 O ATOM 1076 CB CYS A 67 26.267 38.211 12.019 1.00 36.66 C ATOM 1077 SG CYS A 67 27.184 36.658 11.870 1.00 39.53 S ATOM 1078 HA CYS A 67 26.897 38.207 14.092 1.00 0.00 H ATOM 1079 HB2 CYS A 67 26.804 38.991 11.478 1.00 0.00 H ATOM 1080 HB3 CYS A 67 25.278 38.080 11.579 1.00 0.00 H ATOM 1081 HG CYS A 67 27.298 36.319 10.537 1.00 0.00 H ATOM 1082 H CYS A 67 24.637 37.447 14.627 1.00 0.00 H ATOM 1083 N GLY A 68 25.940 40.629 14.833 1.00 35.68 N ATOM 1084 CA GLY A 68 26.049 42.057 15.145 1.00 35.09 C ATOM 1085 C GLY A 68 24.887 42.895 14.713 1.00 34.81 C ATOM 1086 O GLY A 68 24.621 43.932 15.361 1.00 35.21 O ATOM 1087 HA3 GLY A 68 26.943 42.442 14.655 1.00 0.00 H ATOM 1088 HA2 GLY A 68 26.156 42.159 16.225 1.00 0.00 H ATOM 1089 H GLY A 68 25.651 39.968 15.583 1.00 0.00 H ATOM 1090 N HIS A 69 24.177 42.462 13.684 1.00 34.43 N ATOM 1091 CA HIS A 69 23.009 43.227 13.210 1.00 33.85 C ATOM 1092 C HIS A 69 21.741 42.934 14.016 1.00 32.93 C ATOM 1093 O HIS A 69 21.288 41.777 14.127 1.00 32.45 O ATOM 1094 CB HIS A 69 22.684 42.956 11.729 1.00 34.91 C ATOM 1095 CG HIS A 69 23.806 43.067 10.751 1.00 35.63 C ATOM 1096 ND1 HIS A 69 24.942 42.275 10.755 1.00 35.55 N ATOM 1097 CD2 HIS A 69 23.910 43.910 9.675 1.00 35.76 C ATOM 1098 CE1 HIS A 69 25.712 42.654 9.744 1.00 35.72 C ATOM 1099 NE2 HIS A 69 25.113 43.637 9.080 1.00 35.85 N ATOM 1100 HA HIS A 69 23.300 44.269 13.343 1.00 0.00 H ATOM 1101 HB2 HIS A 69 22.288 41.943 11.660 1.00 0.00 H ATOM 1102 HB3 HIS A 69 21.914 43.666 11.427 1.00 0.00 H ATOM 1103 HD2 HIS A 69 23.178 44.652 9.356 1.00 0.00 H ATOM 1104 HE1 HIS A 69 26.684 42.226 9.497 1.00 0.00 H ATOM 1105 H HIS A 69 24.444 41.577 13.207 1.00 0.00 H ATOM 1106 N LYS A 70 21.144 44.009 14.507 1.00 31.67 N ATOM 1107 CA LYS A 70 19.875 43.907 15.254 1.00 30.84 C ATOM 1108 C LYS A 70 18.743 43.787 14.213 1.00 29.37 C ATOM 1109 O LYS A 70 18.802 44.416 13.141 1.00 29.36 O ATOM 1110 CB LYS A 70 19.661 45.077 16.186 1.00 32.11 C ATOM 1111 CG LYS A 70 20.597 45.100 17.401 1.00 33.46 C ATOM 1112 CD LYS A 70 20.406 46.375 18.234 1.00 34.76 C ATOM 1113 CE LYS A 70 21.614 46.739 19.079 1.00 35.50 C ATOM 1114 NZ LYS A 70 22.930 46.513 18.387 1.00 36.08 N ATOM 1115 HA LYS A 70 19.893 43.030 15.901 1.00 0.00 H ATOM 1116 HB2 LYS A 70 19.814 45.996 15.620 1.00 0.00 H ATOM 1117 HB3 LYS A 70 18.633 45.041 16.548 1.00 0.00 H ATOM 1118 HG2 LYS A 70 20.387 44.233 18.027 1.00 0.00 H ATOM 1119 HG3 LYS A 70 21.629 45.054 17.054 1.00 0.00 H ATOM 1120 HD2 LYS A 70 20.199 47.202 17.555 1.00 0.00 H ATOM 1121 HD3 LYS A 70 19.553 46.229 18.897 1.00 0.00 H ATOM 1122 HE2 LYS A 70 21.594 46.134 19.986 1.00 0.00 H ATOM 1123 HE3 LYS A 70 21.542 47.794 19.345 1.00 0.00 H ATOM 1124 HZ1 LYS A 70 23.020 45.508 18.136 1.00 0.00 H ATOM 1125 HZ2 LYS A 70 22.971 47.092 17.524 1.00 0.00 H ATOM 1126 HZ3 LYS A 70 23.706 46.783 19.024 1.00 0.00 H ATOM 1127 H LYS A 70 21.578 44.943 14.364 1.00 0.00 H ATOM 1128 N ALA A 71 17.769 42.969 14.517 1.00 26.74 N ATOM 1129 CA ALA A 71 16.608 42.685 13.676 1.00 25.36 C ATOM 1130 C ALA A 71 15.395 42.484 14.584 1.00 24.55 C ATOM 1131 O ALA A 71 15.573 42.004 15.713 1.00 25.23 O ATOM 1132 CB ALA A 71 16.874 41.431 12.831 1.00 24.94 C ATOM 1133 HA ALA A 71 16.417 43.514 12.995 1.00 0.00 H ATOM 1134 HB1 ALA A 71 17.746 41.599 12.199 1.00 0.00 H ATOM 1135 HB2 ALA A 71 17.059 40.583 13.490 1.00 0.00 H ATOM 1136 HB3 ALA A 71 16.005 41.224 12.206 1.00 0.00 H ATOM 1137 H ALA A 71 17.825 42.480 15.433 1.00 0.00 H ATOM 1138 N ILE A 72 14.217 42.850 14.149 1.00 22.98 N ATOM 1139 CA ILE A 72 12.989 42.677 14.912 1.00 20.99 C ATOM 1140 C ILE A 72 11.996 41.924 14.041 1.00 19.41 C ATOM 1141 O ILE A 72 11.974 42.198 12.832 1.00 18.33 O ATOM 1142 CB ILE A 72 12.354 44.069 15.278 1.00 22.35 C ATOM 1143 CG1 ILE A 72 13.528 44.918 15.801 1.00 23.91 C ATOM 1144 CG2 ILE A 72 11.207 43.918 16.303 1.00 22.69 C ATOM 1145 CD1 ILE A 72 13.234 45.870 16.995 1.00 25.37 C ATOM 1146 HA ILE A 72 13.216 42.136 15.831 1.00 0.00 H ATOM 1147 HB ILE A 72 11.882 44.549 14.421 1.00 0.00 H ATOM 1148 HG12 ILE A 72 14.316 44.233 16.113 1.00 0.00 H ATOM 1149 HG13 ILE A 72 13.886 45.530 14.973 1.00 0.00 H ATOM 1150 HD11 ILE A 72 12.461 46.583 16.708 1.00 0.00 H ATOM 1151 HD12 ILE A 72 12.891 45.285 17.849 1.00 0.00 H ATOM 1152 HD13 ILE A 72 14.144 46.407 17.263 1.00 0.00 H ATOM 1153 HG21 ILE A 72 10.427 43.283 15.883 1.00 0.00 H ATOM 1154 HG22 ILE A 72 11.594 43.465 17.216 1.00 0.00 H ATOM 1155 HG23 ILE A 72 10.793 44.900 16.531 1.00 0.00 H ATOM 1156 H ILE A 72 14.154 43.288 13.208 1.00 0.00 H ATOM 1157 N GLY A 73 11.231 41.063 14.691 1.00 17.96 N ATOM 1158 CA GLY A 73 10.183 40.318 13.985 1.00 16.77 C ATOM 1159 C GLY A 73 9.623 39.201 14.847 1.00 15.95 C ATOM 1160 O GLY A 73 10.046 39.004 15.990 1.00 15.62 O ATOM 1161 HA3 GLY A 73 10.604 39.888 13.076 1.00 0.00 H ATOM 1162 HA2 GLY A 73 9.376 41.002 13.722 1.00 0.00 H ATOM 1163 H GLY A 73 11.373 40.913 15.710 1.00 0.00 H ATOM 1164 N THR A 74 8.707 38.478 14.252 1.00 15.32 N ATOM 1165 CA THR A 74 8.081 37.303 14.872 1.00 14.85 C ATOM 1166 C THR A 74 9.084 36.169 14.978 1.00 14.53 C ATOM 1167 O THR A 74 9.816 35.894 14.013 1.00 15.04 O ATOM 1168 CB THR A 74 6.892 36.817 13.959 1.00 14.99 C ATOM 1169 OG1 THR A 74 6.022 37.981 14.014 1.00 16.00 O ATOM 1170 CG2 THR A 74 6.157 35.565 14.387 1.00 15.07 C ATOM 1171 HA THR A 74 7.726 37.576 15.866 1.00 0.00 H ATOM 1172 HB THR A 74 7.251 36.510 12.977 1.00 0.00 H ATOM 1173 HG1 THR A 74 5.760 38.152 14.953 1.00 0.00 H ATOM 1174 HG23 THR A 74 6.834 34.712 14.335 1.00 0.00 H ATOM 1175 HG21 THR A 74 5.801 35.686 15.410 1.00 0.00 H ATOM 1176 HG22 THR A 74 5.309 35.398 13.723 1.00 0.00 H ATOM 1177 H THR A 74 8.408 38.749 13.293 1.00 0.00 H ATOM 1178 N VAL A 75 9.050 35.486 16.103 1.00 13.56 N ATOM 1179 CA VAL A 75 9.907 34.342 16.387 1.00 11.88 C ATOM 1180 C VAL A 75 9.012 33.198 16.853 1.00 11.06 C ATOM 1181 O VAL A 75 8.150 33.459 17.709 1.00 11.88 O ATOM 1182 CB VAL A 75 11.004 34.692 17.404 1.00 11.27 C ATOM 1183 CG1 VAL A 75 11.781 33.437 17.797 1.00 11.63 C ATOM 1184 CG2 VAL A 75 11.939 35.701 16.816 1.00 10.51 C ATOM 1185 HA VAL A 75 10.443 34.036 15.488 1.00 0.00 H ATOM 1186 HB VAL A 75 10.535 35.111 18.295 1.00 0.00 H ATOM 1187 HG11 VAL A 75 11.099 32.714 18.243 1.00 0.00 H ATOM 1188 HG12 VAL A 75 12.242 33.004 16.909 1.00 0.00 H ATOM 1189 HG13 VAL A 75 12.555 33.701 18.518 1.00 0.00 H ATOM 1190 HG21 VAL A 75 12.399 35.289 15.918 1.00 0.00 H ATOM 1191 HG22 VAL A 75 11.384 36.603 16.560 1.00 0.00 H ATOM 1192 HG23 VAL A 75 12.714 35.944 17.543 1.00 0.00 H ATOM 1193 H VAL A 75 8.371 35.781 16.833 1.00 0.00 H ATOM 1194 N LEU A 76 9.195 32.039 16.275 1.00 9.87 N ATOM 1195 CA LEU A 76 8.445 30.847 16.634 1.00 8.58 C ATOM 1196 C LEU A 76 9.377 30.022 17.531 1.00 8.62 C ATOM 1197 O LEU A 76 10.583 29.997 17.308 1.00 7.73 O ATOM 1198 CB LEU A 76 8.021 30.080 15.399 1.00 7.67 C ATOM 1199 CG LEU A 76 7.422 30.938 14.289 1.00 8.10 C ATOM 1200 CD1 LEU A 76 7.037 30.002 13.144 1.00 7.77 C ATOM 1201 CD2 LEU A 76 6.165 31.619 14.834 1.00 7.22 C ATOM 1202 HA LEU A 76 7.521 31.092 17.157 1.00 0.00 H ATOM 1203 HB2 LEU A 76 8.897 29.570 14.999 1.00 0.00 H ATOM 1204 HB3 LEU A 76 7.277 29.342 15.697 1.00 0.00 H ATOM 1205 HG LEU A 76 8.127 31.694 13.943 1.00 0.00 H ATOM 1206 HD21 LEU A 76 5.449 30.860 15.148 1.00 0.00 H ATOM 1207 HD22 LEU A 76 6.432 32.243 15.687 1.00 0.00 H ATOM 1208 HD23 LEU A 76 5.721 32.238 14.054 1.00 0.00 H ATOM 1209 HD11 LEU A 76 7.926 29.482 12.787 1.00 0.00 H ATOM 1210 HD12 LEU A 76 6.307 29.275 13.501 1.00 0.00 H ATOM 1211 HD13 LEU A 76 6.604 30.584 12.331 1.00 0.00 H ATOM 1212 H LEU A 76 9.910 31.967 15.524 1.00 0.00 H ATOM 1213 N VAL A 77 8.727 29.349 18.472 1.00 9.37 N ATOM 1214 CA VAL A 77 9.477 28.476 19.406 1.00 11.13 C ATOM 1215 C VAL A 77 8.757 27.124 19.439 1.00 11.23 C ATOM 1216 O VAL A 77 7.540 27.066 19.569 1.00 11.00 O ATOM 1217 CB VAL A 77 9.650 29.193 20.757 1.00 11.87 C ATOM 1218 CG1 VAL A 77 10.123 28.210 21.814 1.00 12.39 C ATOM 1219 CG2 VAL A 77 10.560 30.398 20.543 1.00 11.88 C ATOM 1220 HA VAL A 77 10.499 28.272 19.087 1.00 0.00 H ATOM 1221 HB VAL A 77 8.704 29.577 21.140 1.00 0.00 H ATOM 1222 HG11 VAL A 77 9.387 27.414 21.923 1.00 0.00 H ATOM 1223 HG12 VAL A 77 11.079 27.784 21.510 1.00 0.00 H ATOM 1224 HG13 VAL A 77 10.241 28.730 22.765 1.00 0.00 H ATOM 1225 HG21 VAL A 77 11.527 30.060 20.171 1.00 0.00 H ATOM 1226 HG22 VAL A 77 10.105 31.071 19.816 1.00 0.00 H ATOM 1227 HG23 VAL A 77 10.696 30.921 21.489 1.00 0.00 H ATOM 1228 H VAL A 77 7.694 29.434 18.554 1.00 0.00 H ATOM 1229 N GLY A 78 9.578 26.083 19.258 1.00 11.79 N ATOM 1230 CA GLY A 78 8.985 24.731 19.208 1.00 12.03 C ATOM 1231 C GLY A 78 10.079 23.683 19.017 1.00 12.32 C ATOM 1232 O GLY A 78 11.306 23.931 19.104 1.00 13.23 O ATOM 1233 HA3 GLY A 78 8.283 24.676 18.376 1.00 0.00 H ATOM 1234 HA2 GLY A 78 8.456 24.534 20.141 1.00 0.00 H ATOM 1235 H GLY A 78 10.604 26.222 19.156 1.00 0.00 H ATOM 1236 N PRO A 79 9.572 22.489 18.766 1.00 12.55 N ATOM 1237 CA PRO A 79 10.441 21.319 18.596 1.00 13.65 C ATOM 1238 C PRO A 79 11.157 21.236 17.280 1.00 14.30 C ATOM 1239 O PRO A 79 11.132 20.178 16.587 1.00 14.69 O ATOM 1240 CB PRO A 79 9.520 20.161 18.964 1.00 13.50 C ATOM 1241 CG PRO A 79 8.165 20.617 18.478 1.00 13.35 C ATOM 1242 CD PRO A 79 8.158 22.125 18.700 1.00 12.65 C ATOM 1243 HA PRO A 79 11.324 21.340 19.234 1.00 0.00 H ATOM 1244 HD3 PRO A 79 7.666 22.635 17.872 1.00 0.00 H ATOM 1245 HD2 PRO A 79 7.651 22.376 19.632 1.00 0.00 H ATOM 1246 HG3 PRO A 79 7.371 20.140 19.052 1.00 0.00 H ATOM 1247 HG2 PRO A 79 8.038 20.384 17.421 1.00 0.00 H ATOM 1248 HB2 PRO A 79 9.826 19.244 18.460 1.00 0.00 H ATOM 1249 HB3 PRO A 79 9.512 19.997 20.042 1.00 0.00 H ATOM 1250 N THR A 80 11.871 22.307 16.923 1.00 14.72 N ATOM 1251 CA THR A 80 12.666 22.308 15.679 1.00 14.83 C ATOM 1252 C THR A 80 14.006 21.630 16.030 1.00 15.71 C ATOM 1253 O THR A 80 14.542 21.824 17.155 1.00 15.91 O ATOM 1254 CB THR A 80 12.925 23.768 15.145 1.00 13.98 C ATOM 1255 OG1 THR A 80 13.860 23.599 14.036 1.00 14.07 O ATOM 1256 CG2 THR A 80 13.624 24.647 16.214 1.00 13.96 C ATOM 1257 HA THR A 80 12.131 21.782 14.888 1.00 0.00 H ATOM 1258 HB THR A 80 11.986 24.250 14.873 1.00 0.00 H ATOM 1259 HG1 THR A 80 14.691 23.176 14.368 1.00 0.00 H ATOM 1260 HG23 THR A 80 12.951 24.793 17.059 1.00 0.00 H ATOM 1261 HG21 THR A 80 14.533 24.150 16.554 1.00 0.00 H ATOM 1262 HG22 THR A 80 13.878 25.613 15.778 1.00 0.00 H ATOM 1263 H THR A 80 11.867 23.152 17.530 1.00 0.00 H ATOM 1264 N PRO A 81 14.531 20.875 15.065 1.00 15.88 N ATOM 1265 CA PRO A 81 15.811 20.191 15.234 1.00 15.48 C ATOM 1266 C PRO A 81 16.971 21.185 15.216 1.00 15.46 C ATOM 1267 O PRO A 81 18.075 20.818 15.720 1.00 15.84 O ATOM 1268 CB PRO A 81 15.870 19.204 14.054 1.00 15.37 C ATOM 1269 CG PRO A 81 15.050 19.884 13.001 1.00 16.14 C ATOM 1270 CD PRO A 81 13.928 20.614 13.733 1.00 15.88 C ATOM 1271 HA PRO A 81 15.895 19.679 16.192 1.00 0.00 H ATOM 1272 HD3 PRO A 81 13.668 21.545 13.229 1.00 0.00 H ATOM 1273 HD2 PRO A 81 13.040 19.988 13.818 1.00 0.00 H ATOM 1274 HG3 PRO A 81 14.635 19.148 12.312 1.00 0.00 H ATOM 1275 HG2 PRO A 81 15.663 20.594 12.446 1.00 0.00 H ATOM 1276 HB2 PRO A 81 16.896 19.057 13.717 1.00 0.00 H ATOM 1277 HB3 PRO A 81 15.437 18.241 14.327 1.00 0.00 H ATOM 1278 N VAL A 82 16.797 22.374 14.666 1.00 13.52 N ATOM 1279 CA VAL A 82 17.954 23.336 14.641 1.00 12.99 C ATOM 1280 C VAL A 82 17.302 24.705 14.717 1.00 11.91 C ATOM 1281 O VAL A 82 16.078 24.781 14.425 1.00 11.75 O ATOM 1282 CB VAL A 82 18.895 22.945 13.518 1.00 14.13 C ATOM 1283 CG1 VAL A 82 18.246 22.065 12.431 1.00 15.32 C ATOM 1284 CG2 VAL A 82 19.546 24.021 12.663 1.00 14.59 C ATOM 1285 HA VAL A 82 18.663 23.330 15.469 1.00 0.00 H ATOM 1286 HB VAL A 82 19.638 22.467 14.156 1.00 0.00 H ATOM 1287 HG11 VAL A 82 17.882 21.142 12.882 1.00 0.00 H ATOM 1288 HG12 VAL A 82 17.413 22.603 11.979 1.00 0.00 H ATOM 1289 HG13 VAL A 82 18.986 21.830 11.666 1.00 0.00 H ATOM 1290 HG21 VAL A 82 18.772 24.607 12.167 1.00 0.00 H ATOM 1291 HG22 VAL A 82 20.147 24.673 13.297 1.00 0.00 H ATOM 1292 HG23 VAL A 82 20.184 23.552 11.914 1.00 0.00 H ATOM 1293 H VAL A 82 15.878 22.640 14.258 1.00 0.00 H ATOM 1294 N ASN A 83 18.016 25.686 15.179 1.00 10.66 N ATOM 1295 CA ASN A 83 17.463 27.060 15.258 1.00 10.92 C ATOM 1296 C ASN A 83 17.466 27.589 13.809 1.00 10.61 C ATOM 1297 O ASN A 83 18.539 27.436 13.184 1.00 11.40 O ATOM 1298 CB ASN A 83 18.337 27.925 16.174 1.00 11.36 C ATOM 1299 CG ASN A 83 18.288 27.476 17.632 1.00 11.16 C ATOM 1300 OD1 ASN A 83 17.194 27.206 18.119 1.00 11.77 O ATOM 1301 ND2 ASN A 83 19.452 27.425 18.238 1.00 11.62 N ATOM 1302 HA ASN A 83 16.458 27.081 15.679 1.00 0.00 H ATOM 1303 HB2 ASN A 83 19.369 27.869 15.826 1.00 0.00 H ATOM 1304 HB3 ASN A 83 17.990 28.957 16.115 1.00 0.00 H ATOM 1305 HD22 ASN A 83 20.319 27.678 17.722 1.00 0.00 H ATOM 1306 HD21 ASN A 83 19.507 27.131 19.234 1.00 0.00 H ATOM 1307 H ASN A 83 18.989 25.506 15.498 1.00 0.00 H ATOM 1308 N ILE A 84 16.403 28.158 13.300 1.00 9.99 N ATOM 1309 CA ILE A 84 16.505 28.616 11.873 1.00 9.67 C ATOM 1310 C ILE A 84 16.139 30.072 11.751 1.00 9.27 C ATOM 1311 O ILE A 84 15.136 30.436 12.356 1.00 9.13 O ATOM 1312 CB ILE A 84 15.450 27.714 11.128 1.00 9.76 C ATOM 1313 CG1 ILE A 84 16.006 26.242 11.111 1.00 9.74 C ATOM 1314 CG2 ILE A 84 14.995 28.199 9.764 1.00 9.54 C ATOM 1315 CD1 ILE A 84 14.802 25.327 10.714 1.00 10.45 C ATOM 1316 HA ILE A 84 17.512 28.524 11.466 1.00 0.00 H ATOM 1317 HB ILE A 84 14.518 27.770 11.691 1.00 0.00 H ATOM 1318 HG12 ILE A 84 16.809 26.149 10.380 1.00 0.00 H ATOM 1319 HG13 ILE A 84 16.381 25.968 12.097 1.00 0.00 H ATOM 1320 HD11 ILE A 84 14.005 25.438 11.449 1.00 0.00 H ATOM 1321 HD12 ILE A 84 14.434 25.620 9.731 1.00 0.00 H ATOM 1322 HD13 ILE A 84 15.131 24.288 10.686 1.00 0.00 H ATOM 1323 HG21 ILE A 84 14.533 29.181 9.865 1.00 0.00 H ATOM 1324 HG22 ILE A 84 15.855 28.267 9.098 1.00 0.00 H ATOM 1325 HG23 ILE A 84 14.271 27.496 9.353 1.00 0.00 H ATOM 1326 H ILE A 84 15.533 28.286 13.855 1.00 0.00 H ATOM 1327 N ILE A 85 16.899 30.837 11.006 1.00 9.19 N ATOM 1328 CA ILE A 85 16.626 32.251 10.745 1.00 8.51 C ATOM 1329 C ILE A 85 15.997 32.202 9.304 1.00 8.59 C ATOM 1330 O ILE A 85 16.753 31.880 8.376 1.00 8.82 O ATOM 1331 CB ILE A 85 17.841 33.207 10.761 1.00 9.00 C ATOM 1332 CG1 ILE A 85 18.796 33.005 11.986 1.00 9.11 C ATOM 1333 CG2 ILE A 85 17.451 34.720 10.687 1.00 7.61 C ATOM 1334 CD1 ILE A 85 17.937 33.300 13.305 1.00 10.36 C ATOM 1335 HA ILE A 85 16.002 32.664 11.538 1.00 0.00 H ATOM 1336 HB ILE A 85 18.375 32.931 9.852 1.00 0.00 H ATOM 1337 HG12 ILE A 85 19.170 31.981 12.004 1.00 0.00 H ATOM 1338 HG13 ILE A 85 19.636 33.697 11.924 1.00 0.00 H ATOM 1339 HD11 ILE A 85 17.563 34.323 13.272 1.00 0.00 H ATOM 1340 HD12 ILE A 85 17.097 32.607 13.353 1.00 0.00 H ATOM 1341 HD13 ILE A 85 18.568 33.170 14.184 1.00 0.00 H ATOM 1342 HG21 ILE A 85 16.902 34.908 9.764 1.00 0.00 H ATOM 1343 HG22 ILE A 85 16.825 34.975 11.542 1.00 0.00 H ATOM 1344 HG23 ILE A 85 18.355 35.328 10.703 1.00 0.00 H ATOM 1345 H ILE A 85 17.746 30.414 10.575 1.00 0.00 H ATOM 1346 N GLY A 86 14.740 32.443 9.227 1.00 7.67 N ATOM 1347 CA GLY A 86 13.941 32.428 8.008 1.00 7.82 C ATOM 1348 C GLY A 86 13.923 33.849 7.377 1.00 7.72 C ATOM 1349 O GLY A 86 14.607 34.749 7.863 1.00 6.38 O ATOM 1350 HA3 GLY A 86 12.922 32.124 8.246 1.00 0.00 H ATOM 1351 HA2 GLY A 86 14.374 31.722 7.299 1.00 0.00 H ATOM 1352 H GLY A 86 14.246 32.669 10.114 1.00 0.00 H ATOM 1353 N ARG A 87 13.158 33.954 6.324 1.00 7.74 N ATOM 1354 CA ARG A 87 13.063 35.165 5.495 1.00 8.19 C ATOM 1355 C ARG A 87 12.599 36.416 6.218 1.00 8.17 C ATOM 1356 O ARG A 87 13.083 37.521 5.863 1.00 8.42 O ATOM 1357 CB ARG A 87 12.202 34.895 4.255 1.00 7.08 C ATOM 1358 CG ARG A 87 12.914 34.005 3.254 1.00 8.16 C ATOM 1359 CD ARG A 87 12.198 33.891 1.944 1.00 7.85 C ATOM 1360 NE ARG A 87 10.812 33.521 2.090 1.00 7.82 N ATOM 1361 CZ ARG A 87 9.780 34.359 2.111 1.00 8.06 C ATOM 1362 NH1 ARG A 87 9.879 35.670 1.886 1.00 7.80 N ATOM 1363 NH2 ARG A 87 8.551 33.856 2.349 1.00 8.36 N ATOM 1364 HA ARG A 87 14.088 35.389 5.199 1.00 0.00 H ATOM 1365 HB2 ARG A 87 11.279 34.407 4.566 1.00 0.00 H ATOM 1366 HB3 ARG A 87 11.966 35.845 3.776 1.00 0.00 H ATOM 1367 HG2 ARG A 87 13.907 34.416 3.071 1.00 0.00 H ATOM 1368 HG3 ARG A 87 13.009 33.008 3.684 1.00 0.00 H ATOM 1369 HD2 ARG A 87 12.698 33.134 1.339 1.00 0.00 H ATOM 1370 HD3 ARG A 87 12.249 34.853 1.435 1.00 0.00 H ATOM 1371 HE ARG A 87 10.601 32.507 2.188 1.00 0.00 H ATOM 1372 HH12 ARG A 87 9.029 36.269 1.918 1.00 0.00 H ATOM 1373 HH11 ARG A 87 10.806 36.093 1.679 1.00 0.00 H ATOM 1374 HH22 ARG A 87 7.726 34.488 2.371 1.00 0.00 H ATOM 1375 HH21 ARG A 87 8.429 32.836 2.510 1.00 0.00 H ATOM 1376 H ARG A 87 12.581 33.132 6.055 1.00 0.00 H ATOM 1377 N ASN A 88 11.715 36.279 7.171 1.00 8.47 N ATOM 1378 CA ASN A 88 11.147 37.395 7.940 1.00 9.14 C ATOM 1379 C ASN A 88 12.239 38.214 8.607 1.00 9.63 C ATOM 1380 O ASN A 88 12.022 39.445 8.804 1.00 10.95 O ATOM 1381 CB ASN A 88 10.007 36.926 8.846 1.00 9.33 C ATOM 1382 CG ASN A 88 10.607 36.215 10.101 1.00 10.20 C ATOM 1383 OD1 ASN A 88 11.366 35.256 10.000 1.00 9.22 O ATOM 1384 ND2 ASN A 88 10.260 36.820 11.243 1.00 10.66 N ATOM 1385 HA ASN A 88 10.666 38.099 7.261 1.00 0.00 H ATOM 1386 HB2 ASN A 88 9.415 37.785 9.162 1.00 0.00 H ATOM 1387 HB3 ASN A 88 9.371 36.229 8.301 1.00 0.00 H ATOM 1388 HD22 ASN A 88 9.607 37.629 11.225 1.00 0.00 H ATOM 1389 HD21 ASN A 88 10.643 36.481 12.148 1.00 0.00 H ATOM 1390 H ASN A 88 11.392 35.317 7.400 1.00 0.00 H ATOM 1391 N LEU A 89 13.383 37.649 8.937 1.00 9.14 N ATOM 1392 CA LEU A 89 14.507 38.354 9.554 1.00 9.09 C ATOM 1393 C LEU A 89 15.705 38.475 8.613 1.00 9.07 C ATOM 1394 O LEU A 89 16.494 39.416 8.821 1.00 9.40 O ATOM 1395 CB LEU A 89 14.910 37.721 10.905 1.00 9.24 C ATOM 1396 CG LEU A 89 13.899 37.597 12.033 1.00 9.50 C ATOM 1397 CD1 LEU A 89 14.484 36.788 13.207 1.00 10.01 C ATOM 1398 CD2 LEU A 89 13.530 38.998 12.523 1.00 9.43 C ATOM 1399 HA LEU A 89 14.162 39.368 9.758 1.00 0.00 H ATOM 1400 HB2 LEU A 89 15.258 36.712 10.685 1.00 0.00 H ATOM 1401 HB3 LEU A 89 15.739 38.313 11.292 1.00 0.00 H ATOM 1402 HG LEU A 89 13.016 37.078 11.660 1.00 0.00 H ATOM 1403 HD21 LEU A 89 14.426 39.503 12.884 1.00 0.00 H ATOM 1404 HD22 LEU A 89 13.097 39.567 11.700 1.00 0.00 H ATOM 1405 HD23 LEU A 89 12.805 38.919 13.333 1.00 0.00 H ATOM 1406 HD11 LEU A 89 14.750 35.789 12.861 1.00 0.00 H ATOM 1407 HD12 LEU A 89 15.374 37.291 13.586 1.00 0.00 H ATOM 1408 HD13 LEU A 89 13.741 36.714 14.001 1.00 0.00 H ATOM 1409 H LEU A 89 13.494 36.633 8.746 1.00 0.00 H ATOM 1410 N LEU A 90 15.871 37.590 7.634 1.00 8.10 N ATOM 1411 CA LEU A 90 17.032 37.717 6.729 1.00 7.93 C ATOM 1412 C LEU A 90 16.846 39.032 5.948 1.00 7.58 C ATOM 1413 O LEU A 90 17.837 39.673 5.638 1.00 7.33 O ATOM 1414 CB LEU A 90 17.125 36.466 5.838 1.00 8.22 C ATOM 1415 CG LEU A 90 17.472 35.105 6.438 1.00 8.61 C ATOM 1416 CD1 LEU A 90 17.321 33.975 5.430 1.00 8.18 C ATOM 1417 CD2 LEU A 90 18.951 35.115 6.861 1.00 8.94 C ATOM 1418 HA LEU A 90 17.982 37.768 7.261 1.00 0.00 H ATOM 1419 HB2 LEU A 90 16.154 36.355 5.355 1.00 0.00 H ATOM 1420 HB3 LEU A 90 17.883 36.676 5.084 1.00 0.00 H ATOM 1421 HG LEU A 90 16.792 34.939 7.274 1.00 0.00 H ATOM 1422 HD21 LEU A 90 19.576 35.306 5.988 1.00 0.00 H ATOM 1423 HD22 LEU A 90 19.110 35.898 7.602 1.00 0.00 H ATOM 1424 HD23 LEU A 90 19.211 34.148 7.291 1.00 0.00 H ATOM 1425 HD11 LEU A 90 16.289 33.938 5.080 1.00 0.00 H ATOM 1426 HD12 LEU A 90 17.987 34.152 4.585 1.00 0.00 H ATOM 1427 HD13 LEU A 90 17.579 33.029 5.905 1.00 0.00 H ATOM 1428 H LEU A 90 15.189 36.815 7.507 1.00 0.00 H ATOM 1429 N THR A 91 15.637 39.404 5.662 1.00 8.32 N ATOM 1430 CA THR A 91 15.344 40.623 4.924 1.00 10.30 C ATOM 1431 C THR A 91 15.784 41.830 5.775 1.00 11.53 C ATOM 1432 O THR A 91 16.325 42.838 5.220 1.00 12.42 O ATOM 1433 CB THR A 91 13.819 40.778 4.565 1.00 10.82 C ATOM 1434 OG1 THR A 91 13.041 40.812 5.818 1.00 9.81 O ATOM 1435 CG2 THR A 91 13.252 39.756 3.570 1.00 10.63 C ATOM 1436 HA THR A 91 15.890 40.573 3.982 1.00 0.00 H ATOM 1437 HB THR A 91 13.728 41.718 4.021 1.00 0.00 H ATOM 1438 HG1 THR A 91 12.079 40.909 5.605 1.00 0.00 H ATOM 1439 HG23 THR A 91 13.854 39.763 2.661 1.00 0.00 H ATOM 1440 HG21 THR A 91 13.278 38.762 4.017 1.00 0.00 H ATOM 1441 HG22 THR A 91 12.223 40.020 3.327 1.00 0.00 H ATOM 1442 H THR A 91 14.845 38.807 5.973 1.00 0.00 H ATOM 1443 N GLN A 92 15.561 41.740 7.064 1.00 10.98 N ATOM 1444 CA GLN A 92 15.880 42.909 7.947 1.00 11.29 C ATOM 1445 C GLN A 92 17.343 43.236 8.050 1.00 11.77 C ATOM 1446 O GLN A 92 17.816 44.344 8.412 1.00 12.40 O ATOM 1447 CB GLN A 92 15.163 42.706 9.287 1.00 10.73 C ATOM 1448 CG GLN A 92 13.668 42.482 9.230 1.00 10.17 C ATOM 1449 CD GLN A 92 12.981 43.732 8.690 1.00 11.27 C ATOM 1450 OE1 GLN A 92 12.550 43.717 7.536 1.00 12.37 O ATOM 1451 NE2 GLN A 92 12.902 44.771 9.497 1.00 9.88 N ATOM 1452 HA GLN A 92 15.496 43.818 7.484 1.00 0.00 H ATOM 1453 HB2 GLN A 92 15.609 41.838 9.773 1.00 0.00 H ATOM 1454 HB3 GLN A 92 15.342 43.593 9.895 1.00 0.00 H ATOM 1455 HG2 GLN A 92 13.453 41.638 8.575 1.00 0.00 H ATOM 1456 HG3 GLN A 92 13.295 42.267 10.231 1.00 0.00 H ATOM 1457 HE22 GLN A 92 13.289 44.712 10.461 1.00 0.00 H ATOM 1458 HE21 GLN A 92 12.453 45.650 9.170 1.00 0.00 H ATOM 1459 H GLN A 92 15.167 40.867 7.470 1.00 0.00 H ATOM 1460 N ILE A 93 18.204 42.251 7.774 1.00 12.60 N ATOM 1461 CA ILE A 93 19.658 42.453 7.845 1.00 12.31 C ATOM 1462 C ILE A 93 20.216 42.633 6.435 1.00 12.24 C ATOM 1463 O ILE A 93 21.431 42.686 6.321 1.00 13.00 O ATOM 1464 CB ILE A 93 20.415 41.383 8.666 1.00 12.49 C ATOM 1465 CG1 ILE A 93 20.430 40.040 7.910 1.00 12.22 C ATOM 1466 CG2 ILE A 93 19.835 41.207 10.107 1.00 12.73 C ATOM 1467 CD1 ILE A 93 21.363 38.990 8.546 1.00 12.30 C ATOM 1468 HA ILE A 93 19.831 43.368 8.412 1.00 0.00 H ATOM 1469 HB ILE A 93 21.440 41.735 8.786 1.00 0.00 H ATOM 1470 HG12 ILE A 93 19.416 39.639 7.897 1.00 0.00 H ATOM 1471 HG13 ILE A 93 20.761 40.222 6.887 1.00 0.00 H ATOM 1472 HD11 ILE A 93 22.384 39.372 8.557 1.00 0.00 H ATOM 1473 HD12 ILE A 93 21.038 38.788 9.567 1.00 0.00 H ATOM 1474 HD13 ILE A 93 21.324 38.070 7.962 1.00 0.00 H ATOM 1475 HG21 ILE A 93 19.906 42.153 10.644 1.00 0.00 H ATOM 1476 HG22 ILE A 93 18.791 40.902 10.042 1.00 0.00 H ATOM 1477 HG23 ILE A 93 20.405 40.444 10.636 1.00 0.00 H ATOM 1478 H ILE A 93 17.835 41.317 7.502 1.00 0.00 H ATOM 1479 N GLY A 94 19.357 42.735 5.452 1.00 12.30 N ATOM 1480 CA GLY A 94 19.776 42.959 4.081 1.00 13.64 C ATOM 1481 C GLY A 94 20.386 41.756 3.378 1.00 14.19 C ATOM 1482 O GLY A 94 21.232 41.919 2.451 1.00 14.41 O ATOM 1483 HA3 GLY A 94 20.517 43.759 4.082 1.00 0.00 H ATOM 1484 HA2 GLY A 94 18.903 43.275 3.510 1.00 0.00 H ATOM 1485 H GLY A 94 18.341 42.653 5.661 1.00 0.00 H ATOM 1486 N CYS A 95 20.000 40.569 3.768 1.00 13.86 N ATOM 1487 CA CYS A 95 20.554 39.371 3.131 1.00 15.08 C ATOM 1488 C CYS A 95 20.022 39.148 1.731 1.00 14.15 C ATOM 1489 O CYS A 95 18.828 39.346 1.411 1.00 14.41 O ATOM 1490 CB CYS A 95 20.269 38.203 4.103 1.00 16.43 C ATOM 1491 SG CYS A 95 21.260 36.755 3.679 1.00 20.70 S ATOM 1492 HA CYS A 95 21.627 39.471 2.968 1.00 0.00 H ATOM 1493 HB2 CYS A 95 19.212 37.941 4.047 1.00 0.00 H ATOM 1494 HB3 CYS A 95 20.511 38.516 5.119 1.00 0.00 H ATOM 1495 HG CYS A 95 20.982 35.734 4.564 1.00 0.00 H ATOM 1496 H CYS A 95 19.299 40.475 4.531 1.00 0.00 H ATOM 1497 N THR A 96 20.907 38.740 0.827 1.00 13.18 N ATOM 1498 CA THR A 96 20.510 38.399 -0.525 1.00 12.62 C ATOM 1499 C THR A 96 21.290 37.136 -0.963 1.00 13.15 C ATOM 1500 O THR A 96 22.328 36.884 -0.358 1.00 12.87 O ATOM 1501 CB THR A 96 20.760 39.563 -1.582 1.00 12.12 C ATOM 1502 OG1 THR A 96 22.211 39.632 -1.678 1.00 10.70 O ATOM 1503 CG2 THR A 96 20.055 40.854 -1.232 1.00 11.07 C ATOM 1504 HA THR A 96 19.434 38.226 -0.508 1.00 0.00 H ATOM 1505 HB THR A 96 20.320 39.363 -2.559 1.00 0.00 H ATOM 1506 HG1 THR A 96 22.562 38.760 -1.988 1.00 0.00 H ATOM 1507 HG23 THR A 96 18.980 40.679 -1.189 1.00 0.00 H ATOM 1508 HG21 THR A 96 20.406 41.207 -0.262 1.00 0.00 H ATOM 1509 HG22 THR A 96 20.273 41.603 -1.993 1.00 0.00 H ATOM 1510 H THR A 96 21.909 38.664 1.096 1.00 0.00 H ATOM 1511 N LEU A 97 20.782 36.518 -1.999 1.00 13.65 N ATOM 1512 CA LEU A 97 21.319 35.363 -2.712 1.00 14.86 C ATOM 1513 C LEU A 97 21.923 35.894 -4.043 1.00 15.63 C ATOM 1514 O LEU A 97 21.203 36.588 -4.794 1.00 14.70 O ATOM 1515 CB LEU A 97 20.119 34.475 -3.049 1.00 15.47 C ATOM 1516 CG LEU A 97 20.099 33.072 -2.551 1.00 16.65 C ATOM 1517 CD1 LEU A 97 21.069 32.797 -1.416 1.00 17.13 C ATOM 1518 CD2 LEU A 97 18.666 32.803 -2.093 1.00 16.66 C ATOM 1519 HA LEU A 97 22.068 34.821 -2.135 1.00 0.00 H ATOM 1520 HB2 LEU A 97 19.233 34.969 -2.650 1.00 0.00 H ATOM 1521 HB3 LEU A 97 20.049 34.430 -4.136 1.00 0.00 H ATOM 1522 HG LEU A 97 20.421 32.411 -3.356 1.00 0.00 H ATOM 1523 HD21 LEU A 97 18.401 33.504 -1.302 1.00 0.00 H ATOM 1524 HD22 LEU A 97 17.987 32.930 -2.936 1.00 0.00 H ATOM 1525 HD23 LEU A 97 18.592 31.783 -1.716 1.00 0.00 H ATOM 1526 HD11 LEU A 97 22.086 33.002 -1.751 1.00 0.00 H ATOM 1527 HD12 LEU A 97 20.827 33.440 -0.569 1.00 0.00 H ATOM 1528 HD13 LEU A 97 20.988 31.752 -1.116 1.00 0.00 H ATOM 1529 H LEU A 97 19.883 36.897 -2.359 1.00 0.00 H ATOM 1530 N ASN A 98 23.170 35.565 -4.267 1.00 16.50 N ATOM 1531 CA ASN A 98 23.925 35.986 -5.423 1.00 18.25 C ATOM 1532 C ASN A 98 24.673 34.828 -6.113 1.00 18.63 C ATOM 1533 O ASN A 98 25.442 34.100 -5.478 1.00 18.50 O ATOM 1534 CB ASN A 98 24.960 37.101 -5.106 1.00 19.01 C ATOM 1535 CG ASN A 98 24.350 38.283 -4.386 1.00 20.35 C ATOM 1536 OD1 ASN A 98 23.965 38.204 -3.198 1.00 21.18 O ATOM 1537 ND2 ASN A 98 24.209 39.403 -5.073 1.00 20.65 N ATOM 1538 HA ASN A 98 23.165 36.380 -6.097 1.00 0.00 H ATOM 1539 HB2 ASN A 98 25.745 36.679 -4.479 1.00 0.00 H ATOM 1540 HB3 ASN A 98 25.393 37.450 -6.043 1.00 0.00 H ATOM 1541 HD22 ASN A 98 24.534 39.452 -6.060 1.00 0.00 H ATOM 1542 HD21 ASN A 98 23.773 40.235 -4.627 1.00 0.00 H ATOM 1543 H ASN A 98 23.647 34.962 -3.567 1.00 0.00 H ATOM 1544 N PHE A 99 24.449 34.799 -7.413 1.00 19.16 N ATOM 1545 CA PHE A 99 25.108 33.882 -8.357 1.00 20.03 C ATOM 1546 C PHE A 99 25.150 34.585 -9.735 1.00 21.19 C ATOM 1547 O PHE A 99 25.865 34.063 -10.633 1.00 22.46 O ATOM 1548 CB PHE A 99 24.463 32.532 -8.430 1.00 19.21 C ATOM 1549 CG PHE A 99 23.018 32.550 -8.842 1.00 19.32 C ATOM 1550 CD1 PHE A 99 22.027 32.965 -7.970 1.00 19.49 C ATOM 1551 CD2 PHE A 99 22.646 32.091 -10.100 1.00 19.54 C ATOM 1552 CE1 PHE A 99 20.680 32.986 -8.331 1.00 19.40 C ATOM 1553 CE2 PHE A 99 21.316 32.067 -10.484 1.00 19.75 C ATOM 1554 CZ PHE A 99 20.329 32.507 -9.594 1.00 19.53 C ATOM 1555 HA PHE A 99 26.118 33.673 -8.004 1.00 0.00 H ATOM 1556 OXT PHE A 99 24.474 35.600 -9.955 1.00 21.54 O ATOM 1557 HB2 PHE A 99 25.015 31.930 -9.152 1.00 0.00 H ATOM 1558 HB3 PHE A 99 24.530 32.069 -7.445 1.00 0.00 H ATOM 1559 HD2 PHE A 99 23.412 31.745 -10.794 1.00 0.00 H ATOM 1560 HE2 PHE A 99 21.039 31.707 -11.475 1.00 0.00 H ATOM 1561 HZ PHE A 99 19.280 32.475 -9.889 1.00 0.00 H ATOM 1562 HE1 PHE A 99 19.922 33.366 -7.646 1.00 0.00 H ATOM 1563 HD1 PHE A 99 22.309 33.286 -6.967 1.00 0.00 H ATOM 1564 H PHE A 99 23.757 35.473 -7.798 1.00 0.00 H TER 1565 PHE A 99 ATOM 1566 N PRO B 1 22.274 36.785 -10.929 1.00 26.87 N ATOM 1567 CA PRO B 1 21.393 37.812 -10.358 1.00 26.50 C ATOM 1568 C PRO B 1 21.599 38.005 -8.872 1.00 25.74 C ATOM 1569 O PRO B 1 22.383 37.284 -8.221 1.00 25.64 O ATOM 1570 CB PRO B 1 19.989 37.253 -10.658 1.00 26.80 C ATOM 1571 CG PRO B 1 20.171 35.746 -10.605 1.00 26.84 C ATOM 1572 CD PRO B 1 21.518 35.560 -11.295 1.00 26.95 C ATOM 1573 HA PRO B 1 21.578 38.800 -10.780 1.00 0.00 H ATOM 1574 HD3 PRO B 1 22.023 34.667 -10.927 1.00 0.00 H ATOM 1575 HD2 PRO B 1 21.395 35.487 -12.376 1.00 0.00 H ATOM 1576 HG3 PRO B 1 19.376 35.232 -11.145 1.00 0.00 H ATOM 1577 HG2 PRO B 1 20.201 35.387 -9.576 1.00 0.00 H ATOM 1578 HB2 PRO B 1 19.272 37.583 -9.906 1.00 0.00 H ATOM 1579 HB3 PRO B 1 19.650 37.568 -11.645 1.00 0.00 H ATOM 1580 N GLN B 2 20.918 38.984 -8.323 1.00 24.66 N ATOM 1581 CA GLN B 2 20.978 39.233 -6.866 1.00 23.71 C ATOM 1582 C GLN B 2 19.523 39.078 -6.420 1.00 22.50 C ATOM 1583 O GLN B 2 18.667 39.846 -6.928 1.00 23.32 O ATOM 1584 CB GLN B 2 21.551 40.557 -6.470 1.00 25.15 C ATOM 1585 CG GLN B 2 21.173 40.824 -5.027 1.00 27.56 C ATOM 1586 CD GLN B 2 21.837 42.050 -4.483 1.00 29.21 C ATOM 1587 OE1 GLN B 2 21.133 43.053 -4.269 1.00 30.83 O ATOM 1588 NE2 GLN B 2 23.151 41.977 -4.293 1.00 29.63 N ATOM 1589 HA GLN B 2 21.665 38.539 -6.382 1.00 0.00 H ATOM 1590 HB2 GLN B 2 22.636 40.534 -6.569 1.00 0.00 H ATOM 1591 HB3 GLN B 2 21.145 41.341 -7.109 1.00 0.00 H ATOM 1592 HG2 GLN B 2 20.092 40.954 -4.966 1.00 0.00 H ATOM 1593 HG3 GLN B 2 21.470 39.967 -4.422 1.00 0.00 H ATOM 1594 HE22 GLN B 2 23.658 41.093 -4.500 1.00 0.00 H ATOM 1595 HE21 GLN B 2 23.672 42.804 -3.937 1.00 0.00 H ATOM 1596 H GLN B 2 20.327 39.595 -8.922 1.00 0.00 H ATOM 1597 N ILE B 3 19.237 38.099 -5.620 1.00 20.17 N ATOM 1598 CA ILE B 3 17.863 37.838 -5.172 1.00 18.17 C ATOM 1599 C ILE B 3 17.642 38.277 -3.718 1.00 16.95 C ATOM 1600 O ILE B 3 18.397 37.862 -2.793 1.00 15.88 O ATOM 1601 CB ILE B 3 17.514 36.307 -5.382 1.00 17.66 C ATOM 1602 CG1 ILE B 3 17.893 35.802 -6.779 1.00 17.88 C ATOM 1603 CG2 ILE B 3 16.035 36.012 -5.073 1.00 17.18 C ATOM 1604 CD1 ILE B 3 17.619 34.321 -7.123 1.00 16.98 C ATOM 1605 HA ILE B 3 17.183 38.436 -5.779 1.00 0.00 H ATOM 1606 HB ILE B 3 18.124 35.756 -4.667 1.00 0.00 H ATOM 1607 HG12 ILE B 3 17.345 36.408 -7.501 1.00 0.00 H ATOM 1608 HG13 ILE B 3 18.963 35.970 -6.904 1.00 0.00 H ATOM 1609 HD11 ILE B 3 18.171 33.681 -6.434 1.00 0.00 H ATOM 1610 HD12 ILE B 3 16.552 34.120 -7.032 1.00 0.00 H ATOM 1611 HD13 ILE B 3 17.942 34.121 -8.145 1.00 0.00 H ATOM 1612 HG21 ILE B 3 15.823 36.274 -4.036 1.00 0.00 H ATOM 1613 HG22 ILE B 3 15.402 36.603 -5.735 1.00 0.00 H ATOM 1614 HG23 ILE B 3 15.837 34.952 -5.229 1.00 0.00 H ATOM 1615 H ILE B 3 20.003 37.480 -5.286 1.00 0.00 H ATOM 1616 N THR B 4 16.595 39.071 -3.542 1.00 15.48 N ATOM 1617 CA THR B 4 16.226 39.561 -2.191 1.00 14.54 C ATOM 1618 C THR B 4 15.224 38.570 -1.617 1.00 14.04 C ATOM 1619 O THR B 4 14.694 37.703 -2.360 1.00 13.43 O ATOM 1620 CB THR B 4 15.717 41.035 -2.208 1.00 15.12 C ATOM 1621 OG1 THR B 4 14.542 41.063 -3.070 1.00 15.52 O ATOM 1622 CG2 THR B 4 16.764 42.068 -2.661 1.00 14.69 C ATOM 1623 HA THR B 4 17.102 39.604 -1.544 1.00 0.00 H ATOM 1624 HB THR B 4 15.483 41.333 -1.186 1.00 0.00 H ATOM 1625 HG1 THR B 4 13.851 40.456 -2.704 1.00 0.00 H ATOM 1626 HG23 THR B 4 17.628 42.022 -1.998 1.00 0.00 H ATOM 1627 HG21 THR B 4 17.075 41.845 -3.681 1.00 0.00 H ATOM 1628 HG22 THR B 4 16.328 43.066 -2.623 1.00 0.00 H ATOM 1629 H THR B 4 16.024 39.355 -4.363 1.00 0.00 H ATOM 1630 N LEU B 5 14.932 38.690 -0.319 1.00 13.02 N ATOM 1631 CA LEU B 5 14.062 37.667 0.292 1.00 11.50 C ATOM 1632 C LEU B 5 12.728 38.121 0.786 1.00 11.82 C ATOM 1633 O LEU B 5 12.163 37.420 1.661 1.00 11.47 O ATOM 1634 CB LEU B 5 14.958 36.941 1.316 1.00 10.93 C ATOM 1635 CG LEU B 5 16.238 36.319 0.761 1.00 10.23 C ATOM 1636 CD1 LEU B 5 17.176 35.977 1.896 1.00 9.75 C ATOM 1637 CD2 LEU B 5 15.885 35.054 -0.041 1.00 9.38 C ATOM 1638 HA LEU B 5 13.699 36.977 -0.469 1.00 0.00 H ATOM 1639 HB2 LEU B 5 15.242 37.662 2.082 1.00 0.00 H ATOM 1640 HB3 LEU B 5 14.369 36.144 1.770 1.00 0.00 H ATOM 1641 HG LEU B 5 16.734 37.031 0.102 1.00 0.00 H ATOM 1642 HD21 LEU B 5 15.385 34.339 0.612 1.00 0.00 H ATOM 1643 HD22 LEU B 5 15.222 35.320 -0.864 1.00 0.00 H ATOM 1644 HD23 LEU B 5 16.798 34.610 -0.437 1.00 0.00 H ATOM 1645 HD11 LEU B 5 17.425 36.885 2.446 1.00 0.00 H ATOM 1646 HD12 LEU B 5 16.691 35.267 2.565 1.00 0.00 H ATOM 1647 HD13 LEU B 5 18.086 35.534 1.492 1.00 0.00 H ATOM 1648 H LEU B 5 15.307 39.480 0.244 1.00 0.00 H ATOM 1649 N TRP B 6 12.206 39.190 0.216 1.00 11.61 N ATOM 1650 CA TRP B 6 10.877 39.692 0.595 1.00 12.08 C ATOM 1651 C TRP B 6 9.851 38.651 0.191 1.00 12.99 C ATOM 1652 O TRP B 6 8.796 38.568 0.827 1.00 14.13 O ATOM 1653 CB TRP B 6 10.633 41.108 0.038 1.00 11.17 C ATOM 1654 CG TRP B 6 11.711 42.021 0.519 1.00 11.53 C ATOM 1655 CD1 TRP B 6 12.842 42.376 -0.173 1.00 11.42 C ATOM 1656 CD2 TRP B 6 11.831 42.620 1.819 1.00 11.73 C ATOM 1657 NE1 TRP B 6 13.612 43.225 0.594 1.00 12.11 N ATOM 1658 CE2 TRP B 6 13.015 43.373 1.842 1.00 11.65 C ATOM 1659 CE3 TRP B 6 10.985 42.638 2.937 1.00 11.96 C ATOM 1660 CZ2 TRP B 6 13.409 44.128 2.908 1.00 11.30 C ATOM 1661 CZ3 TRP B 6 11.387 43.377 4.041 1.00 11.22 C ATOM 1662 CH2 TRP B 6 12.571 44.092 4.017 1.00 11.46 C ATOM 1663 HA TRP B 6 10.793 39.825 1.674 1.00 0.00 H ATOM 1664 HB2 TRP B 6 10.641 41.077 -1.052 1.00 0.00 H ATOM 1665 HB3 TRP B 6 9.666 41.473 0.383 1.00 0.00 H ATOM 1666 HE1 TRP B 6 14.496 43.681 0.289 1.00 0.00 H ATOM 1667 HD1 TRP B 6 13.094 42.038 -1.178 1.00 0.00 H ATOM 1668 HZ2 TRP B 6 14.323 44.722 2.891 1.00 0.00 H ATOM 1669 HH2 TRP B 6 12.860 44.652 4.907 1.00 0.00 H ATOM 1670 HZ3 TRP B 6 10.764 43.394 4.935 1.00 0.00 H ATOM 1671 HE3 TRP B 6 10.043 42.090 2.939 1.00 0.00 H ATOM 1672 H TRP B 6 12.747 39.689 -0.519 1.00 0.00 H ATOM 1673 N GLN B 7 10.131 37.864 -0.811 1.00 13.66 N ATOM 1674 CA GLN B 7 9.288 36.775 -1.299 1.00 13.98 C ATOM 1675 C GLN B 7 10.157 35.519 -1.345 1.00 12.22 C ATOM 1676 O GLN B 7 11.378 35.558 -1.195 1.00 11.86 O ATOM 1677 CB GLN B 7 8.814 37.025 -2.713 1.00 18.11 C ATOM 1678 CG GLN B 7 8.181 38.350 -3.044 1.00 23.36 C ATOM 1679 CD GLN B 7 7.699 38.399 -4.495 1.00 26.96 C ATOM 1680 OE1 GLN B 7 8.390 38.016 -5.501 1.00 29.12 O ATOM 1681 NE2 GLN B 7 6.434 38.877 -4.642 1.00 28.16 N ATOM 1682 HA GLN B 7 8.423 36.683 -0.643 1.00 0.00 H ATOM 1683 HB2 GLN B 7 9.680 36.912 -3.366 1.00 0.00 H ATOM 1684 HB3 GLN B 7 8.081 36.253 -2.946 1.00 0.00 H ATOM 1685 HG2 GLN B 7 7.329 38.510 -2.383 1.00 0.00 H ATOM 1686 HG3 GLN B 7 8.914 39.141 -2.888 1.00 0.00 H ATOM 1687 HE22 GLN B 7 5.893 39.182 -3.808 1.00 0.00 H ATOM 1688 HE21 GLN B 7 6.008 38.937 -5.589 1.00 0.00 H ATOM 1689 H GLN B 7 11.032 38.026 -1.305 1.00 0.00 H ATOM 1690 N ARG B 8 9.553 34.415 -1.607 1.00 10.88 N ATOM 1691 CA ARG B 8 10.272 33.119 -1.700 1.00 10.76 C ATOM 1692 C ARG B 8 11.205 33.208 -2.897 1.00 9.52 C ATOM 1693 O ARG B 8 10.683 33.675 -3.921 1.00 9.79 O ATOM 1694 CB ARG B 8 9.202 32.022 -1.981 1.00 10.67 C ATOM 1695 CG ARG B 8 8.549 31.605 -0.680 1.00 11.66 C ATOM 1696 CD ARG B 8 7.797 30.337 -0.857 1.00 12.82 C ATOM 1697 NE ARG B 8 7.265 29.918 0.456 1.00 13.90 N ATOM 1698 CZ ARG B 8 6.211 29.101 0.487 1.00 14.66 C ATOM 1699 NH1 ARG B 8 5.728 28.629 -0.680 1.00 14.96 N ATOM 1700 NH2 ARG B 8 5.625 28.720 1.615 1.00 14.84 N ATOM 1701 HA ARG B 8 10.831 32.891 -0.792 1.00 0.00 H ATOM 1702 HB2 ARG B 8 8.444 32.418 -2.657 1.00 0.00 H ATOM 1703 HB3 ARG B 8 9.681 31.157 -2.441 1.00 0.00 H ATOM 1704 HG2 ARG B 8 9.319 31.463 0.078 1.00 0.00 H ATOM 1705 HG3 ARG B 8 7.862 32.387 -0.356 1.00 0.00 H ATOM 1706 HD2 ARG B 8 8.462 29.567 -1.247 1.00 0.00 H ATOM 1707 HD3 ARG B 8 6.974 30.492 -1.555 1.00 0.00 H ATOM 1708 HE ARG B 8 7.703 30.253 1.338 1.00 0.00 H ATOM 1709 HH12 ARG B 8 4.907 27.990 -0.683 1.00 0.00 H ATOM 1710 HH11 ARG B 8 6.176 28.903 -1.577 1.00 0.00 H ATOM 1711 HH22 ARG B 8 4.805 28.081 1.585 1.00 0.00 H ATOM 1712 HH21 ARG B 8 5.986 29.061 2.529 1.00 0.00 H ATOM 1713 H ARG B 8 8.524 34.430 -1.759 1.00 0.00 H ATOM 1714 N PRO B 9 12.440 32.818 -2.738 1.00 8.61 N ATOM 1715 CA PRO B 9 13.375 32.830 -3.870 1.00 8.66 C ATOM 1716 C PRO B 9 13.034 31.689 -4.829 1.00 9.29 C ATOM 1717 O PRO B 9 13.768 30.707 -4.829 1.00 8.81 O ATOM 1718 CB PRO B 9 14.742 32.643 -3.238 1.00 7.78 C ATOM 1719 CG PRO B 9 14.451 31.805 -2.013 1.00 7.43 C ATOM 1720 CD PRO B 9 13.095 32.298 -1.524 1.00 7.83 C ATOM 1721 HA PRO B 9 13.332 33.748 -4.456 1.00 0.00 H ATOM 1722 HD3 PRO B 9 12.518 31.480 -1.093 1.00 0.00 H ATOM 1723 HD2 PRO B 9 13.215 33.087 -0.781 1.00 0.00 H ATOM 1724 HG3 PRO B 9 15.215 31.959 -1.251 1.00 0.00 H ATOM 1725 HG2 PRO B 9 14.406 30.747 -2.272 1.00 0.00 H ATOM 1726 HB2 PRO B 9 15.417 32.121 -3.916 1.00 0.00 H ATOM 1727 HB3 PRO B 9 15.178 33.603 -2.960 1.00 0.00 H ATOM 1728 N LEU B 10 11.958 31.804 -5.593 1.00 10.86 N ATOM 1729 CA LEU B 10 11.571 30.786 -6.591 1.00 12.62 C ATOM 1730 C LEU B 10 12.280 31.038 -7.917 1.00 13.20 C ATOM 1731 O LEU B 10 12.440 32.237 -8.312 1.00 14.09 O ATOM 1732 CB LEU B 10 10.047 30.876 -6.812 1.00 14.04 C ATOM 1733 CG LEU B 10 9.259 30.353 -5.620 1.00 15.20 C ATOM 1734 CD1 LEU B 10 7.807 30.681 -5.788 1.00 15.73 C ATOM 1735 CD2 LEU B 10 9.477 28.829 -5.629 1.00 16.77 C ATOM 1736 HA LEU B 10 11.853 29.798 -6.226 1.00 0.00 H ATOM 1737 HB2 LEU B 10 9.778 31.919 -6.980 1.00 0.00 H ATOM 1738 HB3 LEU B 10 9.785 30.288 -7.691 1.00 0.00 H ATOM 1739 HG LEU B 10 9.582 30.799 -4.679 1.00 0.00 H ATOM 1740 HD21 LEU B 10 9.107 28.416 -6.567 1.00 0.00 H ATOM 1741 HD22 LEU B 10 10.541 28.615 -5.531 1.00 0.00 H ATOM 1742 HD23 LEU B 10 8.937 28.381 -4.795 1.00 0.00 H ATOM 1743 HD11 LEU B 10 7.685 31.762 -5.855 1.00 0.00 H ATOM 1744 HD12 LEU B 10 7.434 30.215 -6.700 1.00 0.00 H ATOM 1745 HD13 LEU B 10 7.249 30.304 -4.931 1.00 0.00 H ATOM 1746 H LEU B 10 11.360 32.648 -5.486 1.00 0.00 H ATOM 1747 N VAL B 11 12.754 29.986 -8.564 1.00 12.21 N ATOM 1748 CA VAL B 11 13.425 30.165 -9.860 1.00 11.92 C ATOM 1749 C VAL B 11 12.909 29.084 -10.801 1.00 12.79 C ATOM 1750 O VAL B 11 12.305 28.096 -10.315 1.00 12.92 O ATOM 1751 CB VAL B 11 14.944 30.280 -9.753 1.00 11.88 C ATOM 1752 CG1 VAL B 11 15.340 31.535 -8.983 1.00 11.20 C ATOM 1753 CG2 VAL B 11 15.540 28.989 -9.266 1.00 11.65 C ATOM 1754 HA VAL B 11 13.169 31.134 -10.288 1.00 0.00 H ATOM 1755 HB VAL B 11 15.384 30.424 -10.740 1.00 0.00 H ATOM 1756 HG11 VAL B 11 14.956 32.414 -9.501 1.00 0.00 H ATOM 1757 HG12 VAL B 11 14.919 31.491 -7.979 1.00 0.00 H ATOM 1758 HG13 VAL B 11 16.427 31.594 -8.921 1.00 0.00 H ATOM 1759 HG21 VAL B 11 15.133 28.751 -8.283 1.00 0.00 H ATOM 1760 HG22 VAL B 11 15.294 28.190 -9.966 1.00 0.00 H ATOM 1761 HG23 VAL B 11 16.623 29.093 -9.197 1.00 0.00 H ATOM 1762 H VAL B 11 12.652 29.034 -8.157 1.00 0.00 H ATOM 1763 N THR B 12 13.114 29.305 -12.091 1.00 12.85 N ATOM 1764 CA THR B 12 12.635 28.257 -13.031 1.00 13.49 C ATOM 1765 C THR B 12 13.800 27.302 -13.208 1.00 12.73 C ATOM 1766 O THR B 12 14.921 27.840 -13.308 1.00 13.04 O ATOM 1767 CB THR B 12 12.256 28.831 -14.467 1.00 14.27 C ATOM 1768 OG1 THR B 12 10.993 29.530 -14.186 1.00 15.13 O ATOM 1769 CG2 THR B 12 11.970 27.717 -15.488 1.00 14.61 C ATOM 1770 HA THR B 12 11.735 27.797 -12.623 1.00 0.00 H ATOM 1771 HB THR B 12 13.057 29.436 -14.893 1.00 0.00 H ATOM 1772 HG1 THR B 12 10.650 29.938 -15.020 1.00 0.00 H ATOM 1773 HG23 THR B 12 12.895 27.185 -15.711 1.00 0.00 H ATOM 1774 HG21 THR B 12 11.241 27.022 -15.071 1.00 0.00 H ATOM 1775 HG22 THR B 12 11.573 28.157 -16.403 1.00 0.00 H ATOM 1776 H THR B 12 13.586 30.168 -12.429 1.00 0.00 H ATOM 1777 N ILE B 13 13.499 26.033 -13.263 1.00 12.25 N ATOM 1778 CA ILE B 13 14.580 25.064 -13.533 1.00 12.02 C ATOM 1779 C ILE B 13 14.098 24.252 -14.745 1.00 12.69 C ATOM 1780 O ILE B 13 12.891 24.131 -15.038 1.00 11.93 O ATOM 1781 CB ILE B 13 14.885 24.166 -12.276 1.00 11.69 C ATOM 1782 CG1 ILE B 13 13.624 23.369 -11.844 1.00 12.38 C ATOM 1783 CG2 ILE B 13 15.399 25.011 -11.094 1.00 11.33 C ATOM 1784 CD1 ILE B 13 13.913 21.997 -11.181 1.00 13.09 C ATOM 1785 HA ILE B 13 15.528 25.557 -13.747 1.00 0.00 H ATOM 1786 HB ILE B 13 15.666 23.462 -12.563 1.00 0.00 H ATOM 1787 HG12 ILE B 13 13.066 23.978 -11.133 1.00 0.00 H ATOM 1788 HG13 ILE B 13 13.013 23.195 -12.730 1.00 0.00 H ATOM 1789 HD11 ILE B 13 14.459 21.365 -11.881 1.00 0.00 H ATOM 1790 HD12 ILE B 13 14.512 22.148 -10.283 1.00 0.00 H ATOM 1791 HD13 ILE B 13 12.971 21.518 -10.915 1.00 0.00 H ATOM 1792 HG21 ILE B 13 16.316 25.522 -11.386 1.00 0.00 H ATOM 1793 HG22 ILE B 13 14.643 25.747 -10.819 1.00 0.00 H ATOM 1794 HG23 ILE B 13 15.600 24.360 -10.243 1.00 0.00 H ATOM 1795 H ILE B 13 12.520 25.712 -13.120 1.00 0.00 H ATOM 1796 N LYS B 14 15.054 23.640 -15.415 1.00 13.01 N ATOM 1797 CA LYS B 14 14.645 22.790 -16.568 1.00 14.27 C ATOM 1798 C LYS B 14 15.248 21.428 -16.266 1.00 14.22 C ATOM 1799 O LYS B 14 16.457 21.406 -16.007 1.00 13.17 O ATOM 1800 CB LYS B 14 15.154 23.409 -17.840 1.00 15.34 C ATOM 1801 CG LYS B 14 14.821 22.610 -19.087 1.00 17.57 C ATOM 1802 CD LYS B 14 15.030 23.545 -20.267 1.00 19.36 C ATOM 1803 CE LYS B 14 15.500 22.744 -21.462 1.00 21.44 C ATOM 1804 NZ LYS B 14 15.826 23.675 -22.598 1.00 22.46 N ATOM 1805 HA LYS B 14 13.567 22.698 -16.703 1.00 0.00 H ATOM 1806 HB2 LYS B 14 14.714 24.401 -17.940 1.00 0.00 H ATOM 1807 HB3 LYS B 14 16.238 23.499 -17.769 1.00 0.00 H ATOM 1808 HG2 LYS B 14 15.481 21.746 -19.169 1.00 0.00 H ATOM 1809 HG3 LYS B 14 13.785 22.272 -19.053 1.00 0.00 H ATOM 1810 HD2 LYS B 14 14.091 24.043 -20.508 1.00 0.00 H ATOM 1811 HD3 LYS B 14 15.781 24.293 -20.011 1.00 0.00 H ATOM 1812 HE2 LYS B 14 14.712 22.057 -21.771 1.00 0.00 H ATOM 1813 HE3 LYS B 14 16.390 22.176 -21.191 1.00 0.00 H ATOM 1814 HZ1 LYS B 14 14.976 24.215 -22.857 1.00 0.00 H ATOM 1815 HZ2 LYS B 14 16.578 24.330 -22.303 1.00 0.00 H ATOM 1816 HZ3 LYS B 14 16.148 23.121 -23.417 1.00 0.00 H ATOM 1817 H LYS B 14 16.054 23.746 -15.149 1.00 0.00 H ATOM 1818 N ILE B 15 14.440 20.415 -16.257 1.00 15.36 N ATOM 1819 CA ILE B 15 14.976 19.043 -15.998 1.00 17.32 C ATOM 1820 C ILE B 15 14.162 18.133 -16.899 1.00 18.54 C ATOM 1821 O ILE B 15 12.921 18.292 -16.984 1.00 18.50 O ATOM 1822 CB ILE B 15 14.924 18.741 -14.467 1.00 17.35 C ATOM 1823 CG1 ILE B 15 15.355 17.273 -14.238 1.00 18.36 C ATOM 1824 CG2 ILE B 15 13.550 19.044 -13.824 1.00 17.07 C ATOM 1825 CD1 ILE B 15 15.657 16.913 -12.761 1.00 18.82 C ATOM 1826 HA ILE B 15 16.029 18.902 -16.240 1.00 0.00 H ATOM 1827 HB ILE B 15 15.618 19.415 -13.965 1.00 0.00 H ATOM 1828 HG12 ILE B 15 14.553 16.624 -14.589 1.00 0.00 H ATOM 1829 HG13 ILE B 15 16.255 17.087 -14.825 1.00 0.00 H ATOM 1830 HD11 ILE B 15 16.467 17.542 -12.393 1.00 0.00 H ATOM 1831 HD12 ILE B 15 14.764 17.079 -12.158 1.00 0.00 H ATOM 1832 HD13 ILE B 15 15.951 15.865 -12.697 1.00 0.00 H ATOM 1833 HG21 ILE B 15 13.313 20.100 -13.957 1.00 0.00 H ATOM 1834 HG22 ILE B 15 12.784 18.435 -14.303 1.00 0.00 H ATOM 1835 HG23 ILE B 15 13.589 18.810 -12.760 1.00 0.00 H ATOM 1836 H ILE B 15 13.424 20.555 -16.429 1.00 0.00 H ATOM 1837 N GLY B 16 14.855 17.238 -17.593 1.00 19.99 N ATOM 1838 CA GLY B 16 14.124 16.346 -18.521 1.00 21.81 C ATOM 1839 C GLY B 16 13.335 17.187 -19.533 1.00 23.39 C ATOM 1840 O GLY B 16 12.199 16.823 -19.907 1.00 24.49 O ATOM 1841 HA3 GLY B 16 13.435 15.720 -17.955 1.00 0.00 H ATOM 1842 HA2 GLY B 16 14.835 15.713 -19.052 1.00 0.00 H ATOM 1843 H GLY B 16 15.887 17.165 -17.487 1.00 0.00 H ATOM 1844 N GLY B 17 13.877 18.289 -20.017 1.00 23.70 N ATOM 1845 CA GLY B 17 13.180 19.115 -21.016 1.00 24.56 C ATOM 1846 C GLY B 17 11.935 19.777 -20.470 1.00 25.31 C ATOM 1847 O GLY B 17 11.143 20.414 -21.218 1.00 25.86 O ATOM 1848 HA3 GLY B 17 12.897 18.480 -21.855 1.00 0.00 H ATOM 1849 HA2 GLY B 17 13.863 19.891 -21.363 1.00 0.00 H ATOM 1850 H GLY B 17 14.818 18.580 -19.685 1.00 0.00 H ATOM 1851 N GLN B 18 11.728 19.702 -19.161 1.00 25.09 N ATOM 1852 CA GLN B 18 10.544 20.385 -18.610 1.00 25.01 C ATOM 1853 C GLN B 18 10.978 21.551 -17.716 1.00 23.16 C ATOM 1854 O GLN B 18 12.056 21.518 -17.114 1.00 22.98 O ATOM 1855 CB GLN B 18 9.698 19.444 -17.828 1.00 27.76 C ATOM 1856 CG GLN B 18 8.499 18.809 -18.498 1.00 31.04 C ATOM 1857 CD GLN B 18 8.120 17.718 -17.465 1.00 33.18 C ATOM 1858 OE1 GLN B 18 9.045 16.933 -17.208 1.00 34.35 O ATOM 1859 NE2 GLN B 18 6.915 17.828 -16.920 1.00 34.26 N ATOM 1860 HA GLN B 18 9.956 20.765 -19.445 1.00 0.00 H ATOM 1861 HB2 GLN B 18 10.345 18.633 -17.495 1.00 0.00 H ATOM 1862 HB3 GLN B 18 9.328 19.991 -16.961 1.00 0.00 H ATOM 1863 HG2 GLN B 18 7.691 19.527 -18.636 1.00 0.00 H ATOM 1864 HG3 GLN B 18 8.764 18.373 -19.461 1.00 0.00 H ATOM 1865 HE22 GLN B 18 6.254 18.554 -17.262 1.00 0.00 H ATOM 1866 HE21 GLN B 18 6.632 17.188 -16.150 1.00 0.00 H ATOM 1867 H GLN B 18 12.381 19.178 -18.544 1.00 0.00 H ATOM 1868 N LEU B 19 10.093 22.523 -17.679 1.00 21.25 N ATOM 1869 CA LEU B 19 10.283 23.720 -16.859 1.00 19.84 C ATOM 1870 C LEU B 19 9.403 23.403 -15.614 1.00 19.30 C ATOM 1871 O LEU B 19 8.350 22.812 -15.750 1.00 18.87 O ATOM 1872 CB LEU B 19 9.871 24.984 -17.538 1.00 19.04 C ATOM 1873 CG LEU B 19 10.423 25.445 -18.858 1.00 18.86 C ATOM 1874 CD1 LEU B 19 9.873 26.811 -19.235 1.00 18.29 C ATOM 1875 CD2 LEU B 19 11.951 25.508 -18.806 1.00 18.68 C ATOM 1876 HA LEU B 19 11.331 23.909 -16.626 1.00 0.00 H ATOM 1877 HB2 LEU B 19 8.793 24.907 -17.678 1.00 0.00 H ATOM 1878 HB3 LEU B 19 10.088 25.784 -16.831 1.00 0.00 H ATOM 1879 HG LEU B 19 10.116 24.723 -19.615 1.00 0.00 H ATOM 1880 HD21 LEU B 19 12.258 26.208 -18.029 1.00 0.00 H ATOM 1881 HD22 LEU B 19 12.347 24.517 -18.582 1.00 0.00 H ATOM 1882 HD23 LEU B 19 12.333 25.844 -19.770 1.00 0.00 H ATOM 1883 HD11 LEU B 19 8.787 26.756 -19.311 1.00 0.00 H ATOM 1884 HD12 LEU B 19 10.148 27.536 -18.469 1.00 0.00 H ATOM 1885 HD13 LEU B 19 10.291 27.117 -20.194 1.00 0.00 H ATOM 1886 H LEU B 19 9.229 22.438 -18.252 1.00 0.00 H ATOM 1887 N LYS B 20 9.935 23.771 -14.498 1.00 19.11 N ATOM 1888 CA LYS B 20 9.414 23.676 -13.136 1.00 18.45 C ATOM 1889 C LYS B 20 9.930 24.879 -12.302 1.00 17.51 C ATOM 1890 O LYS B 20 10.948 25.564 -12.588 1.00 17.04 O ATOM 1891 CB LYS B 20 9.887 22.391 -12.483 1.00 18.97 C ATOM 1892 CG LYS B 20 9.478 21.092 -13.191 1.00 20.56 C ATOM 1893 CD LYS B 20 10.463 20.007 -12.681 1.00 22.18 C ATOM 1894 CE LYS B 20 9.951 18.610 -12.970 1.00 22.75 C ATOM 1895 NZ LYS B 20 8.469 18.617 -12.925 1.00 24.12 N ATOM 1896 HA LYS B 20 8.325 23.684 -13.175 1.00 0.00 H ATOM 1897 HB2 LYS B 20 10.976 22.419 -12.438 1.00 0.00 H ATOM 1898 HB3 LYS B 20 9.484 22.362 -11.471 1.00 0.00 H ATOM 1899 HG2 LYS B 20 8.453 20.826 -12.934 1.00 0.00 H ATOM 1900 HG3 LYS B 20 9.563 21.205 -14.272 1.00 0.00 H ATOM 1901 HD2 LYS B 20 11.425 20.141 -13.176 1.00 0.00 H ATOM 1902 HD3 LYS B 20 10.590 20.122 -11.605 1.00 0.00 H ATOM 1903 HE2 LYS B 20 10.336 17.918 -12.221 1.00 0.00 H ATOM 1904 HE3 LYS B 20 10.285 18.296 -13.959 1.00 0.00 H ATOM 1905 HZ1 LYS B 20 8.153 18.917 -11.981 1.00 0.00 H ATOM 1906 HZ2 LYS B 20 8.105 19.278 -13.640 1.00 0.00 H ATOM 1907 HZ3 LYS B 20 8.113 17.660 -13.123 1.00 0.00 H ATOM 1908 H LYS B 20 10.878 24.201 -14.580 1.00 0.00 H ATOM 1909 N GLU B 21 9.214 25.104 -11.220 1.00 16.94 N ATOM 1910 CA GLU B 21 9.597 26.185 -10.278 1.00 17.22 C ATOM 1911 C GLU B 21 10.204 25.484 -9.060 1.00 14.19 C ATOM 1912 O GLU B 21 9.693 24.427 -8.699 1.00 12.75 O ATOM 1913 CB GLU B 21 8.497 27.091 -9.813 1.00 20.86 C ATOM 1914 CG GLU B 21 8.378 28.432 -10.585 1.00 25.78 C ATOM 1915 CD GLU B 21 7.456 29.390 -9.828 1.00 28.90 C ATOM 1916 OE1 GLU B 21 6.393 29.035 -9.279 1.00 30.28 O ATOM 1917 OE2 GLU B 21 7.945 30.573 -9.832 1.00 30.57 O ATOM 1918 HA GLU B 21 10.275 26.848 -10.815 1.00 0.00 H ATOM 1919 HB2 GLU B 21 7.553 26.557 -9.916 1.00 0.00 H ATOM 1920 HB3 GLU B 21 8.670 27.321 -8.762 1.00 0.00 H ATOM 1921 HG2 GLU B 21 9.366 28.882 -10.682 1.00 0.00 H ATOM 1922 HG3 GLU B 21 7.967 28.243 -11.577 1.00 0.00 H ATOM 1923 H GLU B 21 8.375 24.521 -11.024 1.00 0.00 H ATOM 1924 N ALA B 22 11.255 26.098 -8.576 1.00 11.58 N ATOM 1925 CA ALA B 22 11.940 25.501 -7.413 1.00 10.95 C ATOM 1926 C ALA B 22 12.475 26.655 -6.566 1.00 10.36 C ATOM 1927 O ALA B 22 12.729 27.776 -7.058 1.00 10.27 O ATOM 1928 CB ALA B 22 12.978 24.506 -7.850 1.00 9.85 C ATOM 1929 HA ALA B 22 11.260 24.915 -6.795 1.00 0.00 H ATOM 1930 HB1 ALA B 22 12.499 23.710 -8.420 1.00 0.00 H ATOM 1931 HB2 ALA B 22 13.719 25.006 -8.474 1.00 0.00 H ATOM 1932 HB3 ALA B 22 13.466 24.083 -6.972 1.00 0.00 H ATOM 1933 H ALA B 22 11.598 26.983 -9.000 1.00 0.00 H ATOM 1934 N LEU B 23 12.693 26.359 -5.339 1.00 9.47 N ATOM 1935 CA LEU B 23 13.178 27.248 -4.295 1.00 9.59 C ATOM 1936 C LEU B 23 14.674 27.141 -4.079 1.00 9.37 C ATOM 1937 O LEU B 23 15.125 26.001 -3.809 1.00 9.12 O ATOM 1938 CB LEU B 23 12.406 26.747 -3.046 1.00 11.12 C ATOM 1939 CG LEU B 23 12.279 27.589 -1.819 1.00 11.89 C ATOM 1940 CD1 LEU B 23 11.367 28.792 -2.119 1.00 13.14 C ATOM 1941 CD2 LEU B 23 11.572 26.731 -0.756 1.00 12.91 C ATOM 1942 HA LEU B 23 13.015 28.299 -4.535 1.00 0.00 H ATOM 1943 HB2 LEU B 23 11.390 26.531 -3.378 1.00 0.00 H ATOM 1944 HB3 LEU B 23 12.890 25.821 -2.735 1.00 0.00 H ATOM 1945 HG LEU B 23 13.259 27.934 -1.489 1.00 0.00 H ATOM 1946 HD21 LEU B 23 10.590 26.435 -1.124 1.00 0.00 H ATOM 1947 HD22 LEU B 23 12.168 25.841 -0.553 1.00 0.00 H ATOM 1948 HD23 LEU B 23 11.459 27.310 0.160 1.00 0.00 H ATOM 1949 HD11 LEU B 23 11.802 29.384 -2.925 1.00 0.00 H ATOM 1950 HD12 LEU B 23 10.382 28.434 -2.420 1.00 0.00 H ATOM 1951 HD13 LEU B 23 11.273 29.407 -1.224 1.00 0.00 H ATOM 1952 H LEU B 23 12.502 25.376 -5.059 1.00 0.00 H ATOM 1953 N LEU B 24 15.341 28.274 -4.075 1.00 8.14 N ATOM 1954 CA LEU B 24 16.785 28.279 -3.758 1.00 9.29 C ATOM 1955 C LEU B 24 16.777 28.205 -2.189 1.00 9.95 C ATOM 1956 O LEU B 24 16.377 29.181 -1.541 1.00 10.56 O ATOM 1957 CB LEU B 24 17.411 29.501 -4.350 1.00 8.98 C ATOM 1958 CG LEU B 24 17.286 29.734 -5.854 1.00 9.03 C ATOM 1959 CD1 LEU B 24 18.058 30.982 -6.257 1.00 8.87 C ATOM 1960 CD2 LEU B 24 17.854 28.501 -6.559 1.00 8.33 C ATOM 1961 HA LEU B 24 17.382 27.466 -4.170 1.00 0.00 H ATOM 1962 HB2 LEU B 24 16.965 30.363 -3.853 1.00 0.00 H ATOM 1963 HB3 LEU B 24 18.475 29.461 -4.119 1.00 0.00 H ATOM 1964 HG LEU B 24 16.244 29.884 -6.135 1.00 0.00 H ATOM 1965 HD21 LEU B 24 18.899 28.373 -6.278 1.00 0.00 H ATOM 1966 HD22 LEU B 24 17.286 27.620 -6.261 1.00 0.00 H ATOM 1967 HD23 LEU B 24 17.780 28.635 -7.638 1.00 0.00 H ATOM 1968 HD11 LEU B 24 17.654 31.844 -5.726 1.00 0.00 H ATOM 1969 HD12 LEU B 24 19.110 30.856 -6.001 1.00 0.00 H ATOM 1970 HD13 LEU B 24 17.961 31.137 -7.332 1.00 0.00 H ATOM 1971 H LEU B 24 14.853 29.166 -4.295 1.00 0.00 H ATOM 1972 N ASP B 25 17.252 27.091 -1.679 1.00 8.74 N ATOM 1973 CA ASP B 25 17.176 26.815 -0.244 1.00 8.62 C ATOM 1974 C ASP B 25 18.505 26.529 0.408 1.00 7.84 C ATOM 1975 O ASP B 25 18.971 25.396 0.375 1.00 6.77 O ATOM 1976 CB ASP B 25 16.149 25.663 -0.166 1.00 9.26 C ATOM 1977 CG ASP B 25 15.564 25.386 1.190 1.00 10.68 C ATOM 1978 OD1 ASP B 25 16.193 25.781 2.191 1.00 11.70 O ATOM 1979 OD2 ASP B 25 14.507 24.776 1.304 1.00 11.59 O ATOM 1980 HA ASP B 25 16.863 27.684 0.335 1.00 0.00 H ATOM 1981 HB2 ASP B 25 15.327 25.904 -0.840 1.00 0.00 H ATOM 1982 HB3 ASP B 25 16.643 24.753 -0.508 1.00 0.00 H ATOM 1983 H ASP B 25 17.692 26.390 -2.309 1.00 0.00 H ATOM 1984 N THR B 26 19.070 27.578 1.037 1.00 7.05 N ATOM 1985 CA THR B 26 20.376 27.403 1.677 1.00 6.59 C ATOM 1986 C THR B 26 20.225 26.544 2.921 1.00 7.58 C ATOM 1987 O THR B 26 21.243 26.037 3.465 1.00 7.70 O ATOM 1988 CB THR B 26 21.004 28.802 1.950 1.00 6.26 C ATOM 1989 OG1 THR B 26 20.052 29.369 2.914 1.00 7.25 O ATOM 1990 CG2 THR B 26 21.118 29.772 0.768 1.00 6.76 C ATOM 1991 HA THR B 26 21.067 26.872 1.022 1.00 0.00 H ATOM 1992 HB THR B 26 22.042 28.674 2.258 1.00 0.00 H ATOM 1993 HG1 THR B 26 20.016 28.793 3.718 1.00 0.00 H ATOM 1994 HG23 THR B 26 21.821 29.372 0.038 1.00 0.00 H ATOM 1995 HG21 THR B 26 20.139 29.894 0.304 1.00 0.00 H ATOM 1996 HG22 THR B 26 21.474 30.738 1.125 1.00 0.00 H ATOM 1997 H THR B 26 18.586 28.498 1.068 1.00 0.00 H ATOM 1998 N GLY B 27 19.015 26.315 3.404 1.00 7.57 N ATOM 1999 CA GLY B 27 18.803 25.502 4.601 1.00 7.98 C ATOM 2000 C GLY B 27 18.707 24.031 4.249 1.00 9.13 C ATOM 2001 O GLY B 27 18.605 23.209 5.170 1.00 9.50 O ATOM 2002 HA3 GLY B 27 17.877 25.814 5.085 1.00 0.00 H ATOM 2003 HA2 GLY B 27 19.638 25.651 5.286 1.00 0.00 H ATOM 2004 H GLY B 27 18.191 26.725 2.919 1.00 0.00 H ATOM 2005 N ALA B 28 18.741 23.720 2.969 1.00 9.66 N ATOM 2006 CA ALA B 28 18.615 22.322 2.498 1.00 9.81 C ATOM 2007 C ALA B 28 19.968 21.782 2.072 1.00 9.67 C ATOM 2008 O ALA B 28 20.668 22.396 1.257 1.00 9.26 O ATOM 2009 CB ALA B 28 17.613 22.237 1.357 1.00 9.04 C ATOM 2010 HA ALA B 28 18.248 21.708 3.320 1.00 0.00 H ATOM 2011 HB1 ALA B 28 16.640 22.585 1.703 1.00 0.00 H ATOM 2012 HB2 ALA B 28 17.951 22.862 0.531 1.00 0.00 H ATOM 2013 HB3 ALA B 28 17.532 21.203 1.022 1.00 0.00 H ATOM 2014 H ALA B 28 18.860 24.479 2.268 1.00 0.00 H ATOM 2015 N ASP B 29 20.290 20.611 2.670 1.00 10.02 N ATOM 2016 CA ASP B 29 21.590 20.034 2.303 1.00 10.11 C ATOM 2017 C ASP B 29 21.552 19.522 0.844 1.00 9.41 C ATOM 2018 O ASP B 29 22.580 19.588 0.152 1.00 8.58 O ATOM 2019 CB ASP B 29 21.998 18.921 3.270 1.00 11.29 C ATOM 2020 CG ASP B 29 22.116 19.354 4.712 1.00 12.35 C ATOM 2021 OD1 ASP B 29 22.604 20.460 4.937 1.00 12.64 O ATOM 2022 OD2 ASP B 29 21.703 18.620 5.614 1.00 13.60 O ATOM 2023 HA ASP B 29 22.346 20.816 2.375 1.00 0.00 H ATOM 2024 HB2 ASP B 29 21.251 18.129 3.212 1.00 0.00 H ATOM 2025 HB3 ASP B 29 22.965 18.531 2.952 1.00 0.00 H ATOM 2026 H ASP B 29 19.654 20.147 3.350 1.00 0.00 H ATOM 2027 N ASP B 30 20.447 18.933 0.496 1.00 8.67 N ATOM 2028 CA ASP B 30 20.284 18.290 -0.811 1.00 9.53 C ATOM 2029 C ASP B 30 19.141 18.946 -1.579 1.00 8.70 C ATOM 2030 O ASP B 30 18.365 19.731 -1.025 1.00 9.14 O ATOM 2031 CB ASP B 30 19.963 16.795 -0.588 1.00 10.45 C ATOM 2032 CG ASP B 30 20.896 16.095 0.378 1.00 11.98 C ATOM 2033 OD1 ASP B 30 22.108 16.112 0.117 1.00 12.04 O ATOM 2034 OD2 ASP B 30 20.447 15.480 1.363 1.00 12.51 O ATOM 2035 HA ASP B 30 21.202 18.397 -1.389 1.00 0.00 H ATOM 2036 HB2 ASP B 30 18.948 16.718 -0.199 1.00 0.00 H ATOM 2037 HB3 ASP B 30 20.022 16.286 -1.550 1.00 0.00 H ATOM 2038 H ASP B 30 19.652 18.917 1.167 1.00 0.00 H ATOM 2039 N THR B 31 19.024 18.521 -2.807 1.00 7.91 N ATOM 2040 CA THR B 31 17.973 18.938 -3.754 1.00 7.17 C ATOM 2041 C THR B 31 16.863 17.908 -3.824 1.00 7.41 C ATOM 2042 O THR B 31 17.252 16.732 -4.052 1.00 7.73 O ATOM 2043 CB THR B 31 18.682 19.128 -5.178 1.00 6.33 C ATOM 2044 OG1 THR B 31 19.573 20.245 -4.941 1.00 5.08 O ATOM 2045 CG2 THR B 31 17.706 19.292 -6.355 1.00 5.81 C ATOM 2046 HA THR B 31 17.506 19.869 -3.431 1.00 0.00 H ATOM 2047 HB THR B 31 19.221 18.242 -5.513 1.00 0.00 H ATOM 2048 HG1 THR B 31 20.212 20.009 -4.222 1.00 0.00 H ATOM 2049 HG23 THR B 31 17.088 18.398 -6.440 1.00 0.00 H ATOM 2050 HG21 THR B 31 17.070 20.159 -6.180 1.00 0.00 H ATOM 2051 HG22 THR B 31 18.271 19.434 -7.276 1.00 0.00 H ATOM 2052 H THR B 31 19.728 17.834 -3.145 1.00 0.00 H ATOM 2053 N VAL B 32 15.609 18.204 -3.634 1.00 7.31 N ATOM 2054 CA VAL B 32 14.571 17.193 -3.695 1.00 8.48 C ATOM 2055 C VAL B 32 13.487 17.806 -4.601 1.00 8.37 C ATOM 2056 O VAL B 32 13.137 18.961 -4.337 1.00 8.24 O ATOM 2057 CB VAL B 32 13.791 16.953 -2.357 1.00 9.51 C ATOM 2058 CG1 VAL B 32 13.282 15.533 -2.242 1.00 9.03 C ATOM 2059 CG2 VAL B 32 14.384 17.626 -1.200 1.00 10.00 C ATOM 2060 HA VAL B 32 15.051 16.263 -3.999 1.00 0.00 H ATOM 2061 HB VAL B 32 12.846 17.496 -2.378 1.00 0.00 H ATOM 2062 HG11 VAL B 32 12.607 15.322 -3.072 1.00 0.00 H ATOM 2063 HG12 VAL B 32 14.125 14.843 -2.273 1.00 0.00 H ATOM 2064 HG13 VAL B 32 12.748 15.415 -1.299 1.00 0.00 H ATOM 2065 HG21 VAL B 32 15.401 17.263 -1.052 1.00 0.00 H ATOM 2066 HG22 VAL B 32 14.402 18.701 -1.377 1.00 0.00 H ATOM 2067 HG23 VAL B 32 13.788 17.412 -0.312 1.00 0.00 H ATOM 2068 H VAL B 32 15.345 19.190 -3.434 1.00 0.00 H ATOM 2069 N LEU B 33 12.994 16.987 -5.455 1.00 9.77 N ATOM 2070 CA LEU B 33 11.914 17.446 -6.397 1.00 11.25 C ATOM 2071 C LEU B 33 10.697 16.556 -6.119 1.00 11.79 C ATOM 2072 O LEU B 33 10.922 15.441 -5.611 1.00 10.61 O ATOM 2073 CB LEU B 33 12.435 17.232 -7.839 1.00 11.45 C ATOM 2074 CG LEU B 33 13.685 18.014 -8.235 1.00 11.50 C ATOM 2075 CD1 LEU B 33 13.903 17.822 -9.740 1.00 12.10 C ATOM 2076 CD2 LEU B 33 13.521 19.463 -7.906 1.00 11.07 C ATOM 2077 HA LEU B 33 11.647 18.495 -6.270 1.00 0.00 H ATOM 2078 HB2 LEU B 33 12.656 16.171 -7.957 1.00 0.00 H ATOM 2079 HB3 LEU B 33 11.636 17.514 -8.525 1.00 0.00 H ATOM 2080 HG LEU B 33 14.550 17.649 -7.682 1.00 0.00 H ATOM 2081 HD21 LEU B 33 12.665 19.863 -8.449 1.00 0.00 H ATOM 2082 HD22 LEU B 33 13.357 19.575 -6.834 1.00 0.00 H ATOM 2083 HD23 LEU B 33 14.422 20.004 -8.195 1.00 0.00 H ATOM 2084 HD11 LEU B 33 14.037 16.762 -9.954 1.00 0.00 H ATOM 2085 HD12 LEU B 33 13.035 18.197 -10.282 1.00 0.00 H ATOM 2086 HD13 LEU B 33 14.792 18.372 -10.050 1.00 0.00 H ATOM 2087 H LEU B 33 13.340 16.007 -5.497 1.00 0.00 H ATOM 2088 N GLU B 34 9.547 17.088 -6.467 1.00 12.62 N ATOM 2089 CA GLU B 34 8.287 16.388 -6.363 1.00 13.88 C ATOM 2090 C GLU B 34 8.352 15.198 -7.342 1.00 15.12 C ATOM 2091 O GLU B 34 9.111 15.128 -8.302 1.00 12.45 O ATOM 2092 CB GLU B 34 7.126 17.256 -6.759 1.00 14.97 C ATOM 2093 CG GLU B 34 6.895 18.422 -5.769 1.00 17.14 C ATOM 2094 CD GLU B 34 6.201 19.616 -6.306 1.00 18.10 C ATOM 2095 OE1 GLU B 34 5.505 19.478 -7.318 1.00 18.54 O ATOM 2096 OE2 GLU B 34 6.303 20.710 -5.797 1.00 19.67 O ATOM 2097 HA GLU B 34 8.136 16.078 -5.329 1.00 0.00 H ATOM 2098 HB2 GLU B 34 7.320 17.670 -7.748 1.00 0.00 H ATOM 2099 HB3 GLU B 34 6.226 16.642 -6.793 1.00 0.00 H ATOM 2100 HG2 GLU B 34 6.302 18.039 -4.938 1.00 0.00 H ATOM 2101 HG3 GLU B 34 7.870 18.742 -5.401 1.00 0.00 H ATOM 2102 H GLU B 34 9.543 18.061 -6.835 1.00 0.00 H ATOM 2103 N GLU B 35 7.558 14.233 -6.958 1.00 17.83 N ATOM 2104 CA GLU B 35 7.439 12.972 -7.658 1.00 21.88 C ATOM 2105 C GLU B 35 7.527 13.233 -9.162 1.00 23.55 C ATOM 2106 O GLU B 35 6.794 14.101 -9.682 1.00 24.38 O ATOM 2107 CB GLU B 35 6.101 12.276 -7.408 1.00 23.72 C ATOM 2108 CG GLU B 35 6.075 10.826 -7.925 1.00 25.41 C ATOM 2109 CD GLU B 35 7.318 10.064 -7.550 1.00 26.51 C ATOM 2110 OE1 GLU B 35 7.719 10.293 -6.389 1.00 27.18 O ATOM 2111 OE2 GLU B 35 7.838 9.328 -8.373 1.00 27.82 O ATOM 2112 HA GLU B 35 8.241 12.332 -7.291 1.00 0.00 H ATOM 2113 HB2 GLU B 35 5.908 12.267 -6.335 1.00 0.00 H ATOM 2114 HB3 GLU B 35 5.316 12.840 -7.912 1.00 0.00 H ATOM 2115 HG2 GLU B 35 5.210 10.317 -7.500 1.00 0.00 H ATOM 2116 HG3 GLU B 35 5.988 10.842 -9.011 1.00 0.00 H ATOM 2117 H GLU B 35 6.982 14.379 -6.105 1.00 0.00 H ATOM 2118 N MET B 36 8.433 12.499 -9.765 1.00 24.82 N ATOM 2119 CA MET B 36 8.619 12.602 -11.221 1.00 26.79 C ATOM 2120 C MET B 36 9.447 11.386 -11.656 1.00 27.54 C ATOM 2121 O MET B 36 9.990 10.665 -10.817 1.00 27.28 O ATOM 2122 CB MET B 36 9.244 13.941 -11.616 1.00 26.84 C ATOM 2123 CG MET B 36 10.705 13.946 -11.291 1.00 27.18 C ATOM 2124 SD MET B 36 11.456 15.501 -11.816 1.00 27.95 S ATOM 2125 CE MET B 36 11.636 15.238 -13.581 1.00 28.05 C ATOM 2126 HA MET B 36 7.662 12.587 -11.742 1.00 0.00 H ATOM 2127 HB2 MET B 36 9.113 14.098 -12.687 1.00 0.00 H ATOM 2128 HB3 MET B 36 8.750 14.744 -11.069 1.00 0.00 H ATOM 2129 HG2 MET B 36 11.192 13.119 -11.807 1.00 0.00 H ATOM 2130 HG3 MET B 36 10.835 13.828 -10.215 1.00 0.00 H ATOM 2131 HE1 MET B 36 12.274 14.372 -13.755 1.00 0.00 H ATOM 2132 HE2 MET B 36 10.655 15.063 -14.023 1.00 0.00 H ATOM 2133 HE3 MET B 36 12.088 16.120 -14.034 1.00 0.00 H ATOM 2134 H MET B 36 9.021 11.843 -9.212 1.00 0.00 H ATOM 2135 N ASN B 37 9.534 11.255 -12.957 1.00 29.30 N ATOM 2136 CA ASN B 37 10.276 10.165 -13.580 1.00 31.20 C ATOM 2137 C ASN B 37 11.679 10.637 -13.968 1.00 31.39 C ATOM 2138 O ASN B 37 11.872 11.603 -14.749 1.00 32.47 O ATOM 2139 CB ASN B 37 9.517 9.581 -14.780 1.00 32.94 C ATOM 2140 CG ASN B 37 8.144 9.092 -14.336 1.00 34.30 C ATOM 2141 OD1 ASN B 37 7.133 9.433 -14.967 1.00 35.50 O ATOM 2142 ND2 ASN B 37 8.119 8.330 -13.235 1.00 34.85 N ATOM 2143 HA ASN B 37 10.379 9.358 -12.854 1.00 0.00 H ATOM 2144 HB2 ASN B 37 9.398 10.351 -15.542 1.00 0.00 H ATOM 2145 HB3 ASN B 37 10.082 8.746 -15.194 1.00 0.00 H ATOM 2146 HD22 ASN B 37 9.007 8.081 -12.754 1.00 0.00 H ATOM 2147 HD21 ASN B 37 7.211 7.987 -12.861 1.00 0.00 H ATOM 2148 H ASN B 37 9.058 11.951 -13.565 1.00 0.00 H ATOM 2149 N LEU B 38 12.604 9.900 -13.371 1.00 30.08 N ATOM 2150 CA LEU B 38 14.014 10.175 -13.652 1.00 29.14 C ATOM 2151 C LEU B 38 14.599 8.848 -14.165 1.00 28.84 C ATOM 2152 O LEU B 38 14.190 7.786 -13.699 1.00 29.17 O ATOM 2153 CB LEU B 38 14.635 10.751 -12.405 1.00 28.29 C ATOM 2154 CG LEU B 38 14.401 12.230 -12.169 1.00 27.65 C ATOM 2155 CD1 LEU B 38 15.155 12.649 -10.915 1.00 27.72 C ATOM 2156 CD2 LEU B 38 14.953 13.007 -13.359 1.00 27.28 C ATOM 2157 HA LEU B 38 14.206 10.924 -14.420 1.00 0.00 H ATOM 2158 HB2 LEU B 38 14.232 10.209 -11.550 1.00 0.00 H ATOM 2159 HB3 LEU B 38 15.711 10.588 -12.462 1.00 0.00 H ATOM 2160 HG LEU B 38 13.336 12.431 -12.051 1.00 0.00 H ATOM 2161 HD21 LEU B 38 16.021 12.811 -13.456 1.00 0.00 H ATOM 2162 HD22 LEU B 38 14.440 12.690 -14.267 1.00 0.00 H ATOM 2163 HD23 LEU B 38 14.791 14.073 -13.202 1.00 0.00 H ATOM 2164 HD11 LEU B 38 14.789 12.075 -10.064 1.00 0.00 H ATOM 2165 HD12 LEU B 38 16.220 12.459 -11.052 1.00 0.00 H ATOM 2166 HD13 LEU B 38 14.995 13.712 -10.734 1.00 0.00 H ATOM 2167 H LEU B 38 12.333 9.140 -12.715 1.00 0.00 H ATOM 2168 N PRO B 39 15.516 9.002 -15.091 1.00 28.47 N ATOM 2169 CA PRO B 39 16.230 7.887 -15.685 1.00 27.84 C ATOM 2170 C PRO B 39 17.272 7.252 -14.762 1.00 27.06 C ATOM 2171 O PRO B 39 17.978 7.893 -13.929 1.00 27.06 O ATOM 2172 CB PRO B 39 16.945 8.559 -16.887 1.00 28.19 C ATOM 2173 CG PRO B 39 17.265 9.963 -16.367 1.00 28.56 C ATOM 2174 CD PRO B 39 15.976 10.319 -15.625 1.00 28.44 C ATOM 2175 HA PRO B 39 15.554 7.069 -15.933 1.00 0.00 H ATOM 2176 HD3 PRO B 39 16.172 11.023 -14.816 1.00 0.00 H ATOM 2177 HD2 PRO B 39 15.238 10.745 -16.305 1.00 0.00 H ATOM 2178 HG3 PRO B 39 17.457 10.656 -17.186 1.00 0.00 H ATOM 2179 HG2 PRO B 39 18.122 9.952 -15.693 1.00 0.00 H ATOM 2180 HB2 PRO B 39 17.857 8.022 -17.149 1.00 0.00 H ATOM 2181 HB3 PRO B 39 16.289 8.604 -17.756 1.00 0.00 H ATOM 2182 N GLY B 40 17.406 5.929 -14.970 1.00 25.22 N ATOM 2183 CA GLY B 40 18.424 5.157 -14.237 1.00 22.58 C ATOM 2184 C GLY B 40 17.832 4.494 -13.001 1.00 20.81 C ATOM 2185 O GLY B 40 16.620 4.456 -12.794 1.00 20.91 O ATOM 2186 HA3 GLY B 40 19.226 5.828 -13.930 1.00 0.00 H ATOM 2187 HA2 GLY B 40 18.828 4.387 -14.894 1.00 0.00 H ATOM 2188 H GLY B 40 16.786 5.448 -15.653 1.00 0.00 H ATOM 2189 N ARG B 41 18.777 3.930 -12.275 1.00 19.08 N ATOM 2190 CA ARG B 41 18.542 3.235 -11.019 1.00 17.85 C ATOM 2191 C ARG B 41 18.598 4.297 -9.898 1.00 17.54 C ATOM 2192 O ARG B 41 19.280 5.330 -10.054 1.00 17.68 O ATOM 2193 CB ARG B 41 19.683 2.245 -10.727 1.00 17.64 C ATOM 2194 CG ARG B 41 19.612 1.018 -11.648 1.00 17.94 C ATOM 2195 CD ARG B 41 20.577 -0.015 -11.183 1.00 18.11 C ATOM 2196 NE ARG B 41 20.212 -0.702 -9.947 1.00 17.31 N ATOM 2197 CZ ARG B 41 19.272 -1.614 -9.714 1.00 16.41 C ATOM 2198 NH1 ARG B 41 18.379 -2.129 -10.531 1.00 15.13 N ATOM 2199 NH2 ARG B 41 19.335 -2.084 -8.448 1.00 16.56 N ATOM 2200 HA ARG B 41 17.590 2.706 -11.071 1.00 0.00 H ATOM 2201 HB2 ARG B 41 20.637 2.749 -10.880 1.00 0.00 H ATOM 2202 HB3 ARG B 41 19.610 1.915 -9.691 1.00 0.00 H ATOM 2203 HG2 ARG B 41 18.603 0.607 -11.627 1.00 0.00 H ATOM 2204 HG3 ARG B 41 19.861 1.314 -12.667 1.00 0.00 H ATOM 2205 HD2 ARG B 41 21.540 0.470 -11.026 1.00 0.00 H ATOM 2206 HD3 ARG B 41 20.673 -0.764 -11.969 1.00 0.00 H ATOM 2207 HE ARG B 41 20.778 -0.436 -9.116 1.00 0.00 H ATOM 2208 HH12 ARG B 41 17.707 -2.842 -10.184 1.00 0.00 H ATOM 2209 HH11 ARG B 41 18.345 -1.823 -11.524 1.00 0.00 H ATOM 2210 HH22 ARG B 41 18.658 -2.805 -8.127 1.00 0.00 H ATOM 2211 HH21 ARG B 41 20.061 -1.725 -7.795 1.00 0.00 H ATOM 2212 H ARG B 41 19.755 3.986 -12.623 1.00 0.00 H ATOM 2213 N TRP B 42 17.932 3.951 -8.839 1.00 16.01 N ATOM 2214 CA TRP B 42 17.890 4.830 -7.652 1.00 14.74 C ATOM 2215 C TRP B 42 18.342 3.995 -6.448 1.00 15.14 C ATOM 2216 O TRP B 42 18.283 2.752 -6.530 1.00 13.80 O ATOM 2217 CB TRP B 42 16.521 5.422 -7.586 1.00 13.11 C ATOM 2218 CG TRP B 42 15.364 4.508 -7.406 1.00 12.25 C ATOM 2219 CD1 TRP B 42 14.540 3.962 -8.337 1.00 11.57 C ATOM 2220 CD2 TRP B 42 14.830 4.114 -6.124 1.00 11.61 C ATOM 2221 NE1 TRP B 42 13.554 3.218 -7.730 1.00 11.32 N ATOM 2222 CE2 TRP B 42 13.711 3.295 -6.375 1.00 11.10 C ATOM 2223 CE3 TRP B 42 15.260 4.364 -4.814 1.00 11.36 C ATOM 2224 CZ2 TRP B 42 12.967 2.733 -5.362 1.00 10.43 C ATOM 2225 CZ3 TRP B 42 14.512 3.803 -3.788 1.00 10.95 C ATOM 2226 CH2 TRP B 42 13.397 3.000 -4.059 1.00 10.87 C ATOM 2227 HA TRP B 42 18.570 5.681 -7.682 1.00 0.00 H ATOM 2228 HB2 TRP B 42 16.512 6.122 -6.750 1.00 0.00 H ATOM 2229 HB3 TRP B 42 16.360 5.967 -8.516 1.00 0.00 H ATOM 2230 HE1 TRP B 42 12.810 2.684 -8.223 1.00 0.00 H ATOM 2231 HD1 TRP B 42 14.645 4.094 -9.414 1.00 0.00 H ATOM 2232 HZ2 TRP B 42 12.092 2.115 -5.565 1.00 0.00 H ATOM 2233 HH2 TRP B 42 12.845 2.568 -3.224 1.00 0.00 H ATOM 2234 HZ3 TRP B 42 14.798 3.991 -2.753 1.00 0.00 H ATOM 2235 HE3 TRP B 42 16.142 4.971 -4.610 1.00 0.00 H ATOM 2236 H TRP B 42 17.422 3.045 -8.826 1.00 0.00 H ATOM 2237 N LYS B 43 18.829 4.704 -5.467 1.00 15.51 N ATOM 2238 CA LYS B 43 19.281 4.176 -4.193 1.00 17.17 C ATOM 2239 C LYS B 43 18.283 4.824 -3.196 1.00 16.36 C ATOM 2240 O LYS B 43 17.704 5.818 -3.600 1.00 16.03 O ATOM 2241 CB LYS B 43 20.631 4.626 -3.756 1.00 19.71 C ATOM 2242 CG LYS B 43 21.869 4.236 -4.553 1.00 24.02 C ATOM 2243 CD LYS B 43 23.060 4.992 -3.900 1.00 26.97 C ATOM 2244 CE LYS B 43 24.436 4.651 -4.434 1.00 29.36 C ATOM 2245 NZ LYS B 43 24.531 4.896 -5.915 1.00 30.81 N ATOM 2246 HA LYS B 43 19.329 3.089 -4.251 1.00 0.00 H ATOM 2247 HB2 LYS B 43 20.605 5.715 -3.731 1.00 0.00 H ATOM 2248 HB3 LYS B 43 20.776 4.244 -2.745 1.00 0.00 H ATOM 2249 HG2 LYS B 43 22.030 3.159 -4.500 1.00 0.00 H ATOM 2250 HG3 LYS B 43 21.757 4.534 -5.595 1.00 0.00 H ATOM 2251 HD2 LYS B 43 22.899 6.060 -4.049 1.00 0.00 H ATOM 2252 HD3 LYS B 43 23.052 4.770 -2.833 1.00 0.00 H ATOM 2253 HE2 LYS B 43 24.642 3.599 -4.235 1.00 0.00 H ATOM 2254 HE3 LYS B 43 25.176 5.268 -3.925 1.00 0.00 H ATOM 2255 HZ1 LYS B 43 23.831 4.306 -6.408 1.00 0.00 H ATOM 2256 HZ2 LYS B 43 24.341 5.899 -6.112 1.00 0.00 H ATOM 2257 HZ3 LYS B 43 25.487 4.652 -6.245 1.00 0.00 H ATOM 2258 H LYS B 43 18.899 5.732 -5.610 1.00 0.00 H ATOM 2259 N PRO B 44 18.162 4.240 -2.032 1.00 16.07 N ATOM 2260 CA PRO B 44 17.271 4.763 -0.998 1.00 16.01 C ATOM 2261 C PRO B 44 18.006 5.780 -0.124 1.00 17.20 C ATOM 2262 O PRO B 44 19.215 5.678 0.174 1.00 17.85 O ATOM 2263 CB PRO B 44 16.930 3.540 -0.158 1.00 15.11 C ATOM 2264 CG PRO B 44 18.021 2.565 -0.424 1.00 15.18 C ATOM 2265 CD PRO B 44 18.844 2.996 -1.602 1.00 15.00 C ATOM 2266 HA PRO B 44 16.398 5.263 -1.417 1.00 0.00 H ATOM 2267 HD3 PRO B 44 19.876 3.192 -1.311 1.00 0.00 H ATOM 2268 HD2 PRO B 44 18.827 2.244 -2.391 1.00 0.00 H ATOM 2269 HG3 PRO B 44 17.585 1.588 -0.631 1.00 0.00 H ATOM 2270 HG2 PRO B 44 18.662 2.497 0.455 1.00 0.00 H ATOM 2271 HB2 PRO B 44 16.899 3.800 0.900 1.00 0.00 H ATOM 2272 HB3 PRO B 44 15.967 3.127 -0.458 1.00 0.00 H ATOM 2273 N LYS B 45 17.228 6.757 0.334 1.00 18.15 N ATOM 2274 CA LYS B 45 17.699 7.822 1.213 1.00 18.64 C ATOM 2275 C LYS B 45 16.545 8.358 2.062 1.00 18.71 C ATOM 2276 O LYS B 45 15.390 8.404 1.639 1.00 18.17 O ATOM 2277 CB LYS B 45 18.372 9.003 0.458 1.00 18.51 C ATOM 2278 CG LYS B 45 19.073 9.887 1.460 1.00 18.58 C ATOM 2279 CD LYS B 45 19.867 11.044 0.993 1.00 19.40 C ATOM 2280 CE LYS B 45 20.914 11.452 2.027 1.00 19.93 C ATOM 2281 NZ LYS B 45 21.544 12.714 1.602 1.00 21.22 N ATOM 2282 HA LYS B 45 18.464 7.371 1.845 1.00 0.00 H ATOM 2283 HB2 LYS B 45 19.096 8.615 -0.258 1.00 0.00 H ATOM 2284 HB3 LYS B 45 17.613 9.579 -0.071 1.00 0.00 H ATOM 2285 HG2 LYS B 45 18.305 10.280 2.126 1.00 0.00 H ATOM 2286 HG3 LYS B 45 19.750 9.247 2.026 1.00 0.00 H ATOM 2287 HD2 LYS B 45 20.370 10.778 0.064 1.00 0.00 H ATOM 2288 HD3 LYS B 45 19.198 11.885 0.814 1.00 0.00 H ATOM 2289 HE2 LYS B 45 21.673 10.673 2.106 1.00 0.00 H ATOM 2290 HE3 LYS B 45 20.435 11.591 2.996 1.00 0.00 H ATOM 2291 HZ1 LYS B 45 21.999 12.578 0.677 1.00 0.00 H ATOM 2292 HZ2 LYS B 45 20.818 13.455 1.527 1.00 0.00 H ATOM 2293 HZ3 LYS B 45 22.258 12.997 2.303 1.00 0.00 H ATOM 2294 H LYS B 45 16.228 6.762 0.049 1.00 0.00 H ATOM 2295 N MET B 46 16.896 8.744 3.284 1.00 19.28 N ATOM 2296 CA MET B 46 15.945 9.327 4.227 1.00 20.55 C ATOM 2297 C MET B 46 16.403 10.741 4.557 1.00 18.66 C ATOM 2298 O MET B 46 17.626 10.918 4.765 1.00 19.05 O ATOM 2299 CB MET B 46 15.806 8.508 5.502 1.00 23.99 C ATOM 2300 CG MET B 46 14.567 7.684 5.216 1.00 28.21 C ATOM 2301 SD MET B 46 14.126 6.908 6.795 1.00 33.06 S ATOM 2302 CE MET B 46 12.434 7.615 6.892 1.00 32.10 C ATOM 2303 HA MET B 46 14.961 9.337 3.759 1.00 0.00 H ATOM 2304 HB2 MET B 46 16.677 7.872 5.661 1.00 0.00 H ATOM 2305 HB3 MET B 46 15.663 9.150 6.371 1.00 0.00 H ATOM 2306 HG2 MET B 46 14.780 6.924 4.464 1.00 0.00 H ATOM 2307 HG3 MET B 46 13.756 8.323 4.866 1.00 0.00 H ATOM 2308 HE1 MET B 46 12.496 8.703 6.901 1.00 0.00 H ATOM 2309 HE2 MET B 46 11.856 7.290 6.027 1.00 0.00 H ATOM 2310 HE3 MET B 46 11.949 7.270 7.805 1.00 0.00 H ATOM 2311 H MET B 46 17.886 8.627 3.580 1.00 0.00 H ATOM 2312 N ILE B 47 15.471 11.641 4.560 1.00 16.63 N ATOM 2313 CA ILE B 47 15.876 13.032 4.884 1.00 15.65 C ATOM 2314 C ILE B 47 14.951 13.553 5.957 1.00 15.10 C ATOM 2315 O ILE B 47 13.741 13.273 5.911 1.00 15.09 O ATOM 2316 CB ILE B 47 16.001 13.863 3.583 1.00 15.31 C ATOM 2317 CG1 ILE B 47 14.668 13.790 2.792 1.00 14.77 C ATOM 2318 CG2 ILE B 47 17.206 13.490 2.676 1.00 14.50 C ATOM 2319 CD1 ILE B 47 14.557 15.196 2.037 1.00 15.00 C ATOM 2320 HA ILE B 47 16.875 13.101 5.315 1.00 0.00 H ATOM 2321 HB ILE B 47 16.205 14.886 3.898 1.00 0.00 H ATOM 2322 HG12 ILE B 47 14.693 12.970 2.074 1.00 0.00 H ATOM 2323 HG13 ILE B 47 13.826 13.652 3.471 1.00 0.00 H ATOM 2324 HD11 ILE B 47 14.546 16.001 2.771 1.00 0.00 H ATOM 2325 HD12 ILE B 47 15.413 15.319 1.373 1.00 0.00 H ATOM 2326 HD13 ILE B 47 13.637 15.222 1.454 1.00 0.00 H ATOM 2327 HG21 ILE B 47 18.134 13.635 3.229 1.00 0.00 H ATOM 2328 HG22 ILE B 47 17.122 12.446 2.373 1.00 0.00 H ATOM 2329 HG23 ILE B 47 17.205 14.128 1.792 1.00 0.00 H ATOM 2330 H ILE B 47 14.483 11.400 4.345 1.00 0.00 H ATOM 2331 N GLY B 48 15.562 14.305 6.864 1.00 14.35 N ATOM 2332 CA GLY B 48 14.835 14.893 7.990 1.00 13.87 C ATOM 2333 C GLY B 48 14.677 16.397 7.783 1.00 13.71 C ATOM 2334 O GLY B 48 15.611 17.092 7.455 1.00 12.62 O ATOM 2335 HA3 GLY B 48 15.388 14.712 8.911 1.00 0.00 H ATOM 2336 HA2 GLY B 48 13.849 14.433 8.063 1.00 0.00 H ATOM 2337 H GLY B 48 16.583 14.481 6.772 1.00 0.00 H ATOM 2338 N GLY B 49 13.457 16.852 7.937 1.00 14.92 N ATOM 2339 CA GLY B 49 13.097 18.265 7.838 1.00 16.29 C ATOM 2340 C GLY B 49 12.532 18.658 9.206 1.00 17.98 C ATOM 2341 O GLY B 49 12.689 17.978 10.221 1.00 17.81 O ATOM 2342 HA3 GLY B 49 12.345 18.410 7.062 1.00 0.00 H ATOM 2343 HA2 GLY B 49 13.977 18.864 7.606 1.00 0.00 H ATOM 2344 H GLY B 49 12.701 16.167 8.142 1.00 0.00 H ATOM 2345 N ILE B 50 11.792 19.738 9.169 1.00 19.42 N ATOM 2346 CA ILE B 50 11.155 20.315 10.374 1.00 21.12 C ATOM 2347 C ILE B 50 10.136 19.337 10.923 1.00 21.83 C ATOM 2348 O ILE B 50 10.082 19.172 12.163 1.00 22.28 O ATOM 2349 CB ILE B 50 10.659 21.754 10.001 1.00 21.78 C ATOM 2350 CG1 ILE B 50 11.347 22.750 10.969 1.00 22.62 C ATOM 2351 CG2 ILE B 50 9.161 22.050 9.859 1.00 21.80 C ATOM 2352 CD1 ILE B 50 12.879 22.506 11.015 1.00 23.77 C ATOM 2353 HA ILE B 50 11.835 20.457 11.214 1.00 0.00 H ATOM 2354 HB ILE B 50 10.952 21.866 8.957 1.00 0.00 H ATOM 2355 HG12 ILE B 50 11.157 23.768 10.629 1.00 0.00 H ATOM 2356 HG13 ILE B 50 10.934 22.620 11.969 1.00 0.00 H ATOM 2357 HD11 ILE B 50 13.074 21.490 11.359 1.00 0.00 H ATOM 2358 HD12 ILE B 50 13.297 22.640 10.017 1.00 0.00 H ATOM 2359 HD13 ILE B 50 13.338 23.217 11.701 1.00 0.00 H ATOM 2360 HG21 ILE B 50 8.740 21.420 9.075 1.00 0.00 H ATOM 2361 HG22 ILE B 50 8.659 21.840 10.804 1.00 0.00 H ATOM 2362 HG23 ILE B 50 9.022 23.099 9.598 1.00 0.00 H ATOM 2363 H ILE B 50 11.646 20.210 8.254 1.00 0.00 H ATOM 2364 N GLY B 51 9.351 18.712 10.044 1.00 21.46 N ATOM 2365 CA GLY B 51 8.296 17.815 10.478 1.00 21.42 C ATOM 2366 C GLY B 51 8.650 16.388 10.775 1.00 21.47 C ATOM 2367 O GLY B 51 7.813 15.657 11.366 1.00 21.95 O ATOM 2368 HA3 GLY B 51 7.540 17.803 9.693 1.00 0.00 H ATOM 2369 HA2 GLY B 51 7.868 18.237 11.387 1.00 0.00 H ATOM 2370 H GLY B 51 9.498 18.871 9.027 1.00 0.00 H ATOM 2371 N GLY B 52 9.824 15.950 10.387 1.00 20.75 N ATOM 2372 CA GLY B 52 10.213 14.542 10.607 1.00 20.55 C ATOM 2373 C GLY B 52 10.982 14.056 9.370 1.00 20.36 C ATOM 2374 O GLY B 52 11.568 14.898 8.682 1.00 20.23 O ATOM 2375 HA3 GLY B 52 9.322 13.931 10.751 1.00 0.00 H ATOM 2376 HA2 GLY B 52 10.849 14.468 11.489 1.00 0.00 H ATOM 2377 H GLY B 52 10.488 16.600 9.920 1.00 0.00 H ATOM 2378 N PHE B 53 10.972 12.757 9.135 1.00 20.22 N ATOM 2379 CA PHE B 53 11.701 12.161 8.030 1.00 20.27 C ATOM 2380 C PHE B 53 10.754 11.658 6.952 1.00 19.99 C ATOM 2381 O PHE B 53 9.576 11.388 7.220 1.00 20.77 O ATOM 2382 CB PHE B 53 12.618 11.014 8.484 1.00 20.73 C ATOM 2383 CG PHE B 53 13.803 11.447 9.272 1.00 21.42 C ATOM 2384 CD1 PHE B 53 13.648 11.825 10.609 1.00 21.97 C ATOM 2385 CD2 PHE B 53 15.062 11.496 8.677 1.00 22.05 C ATOM 2386 CE1 PHE B 53 14.761 12.246 11.355 1.00 22.51 C ATOM 2387 CE2 PHE B 53 16.183 11.905 9.396 1.00 22.23 C ATOM 2388 CZ PHE B 53 16.030 12.290 10.731 1.00 22.43 C ATOM 2389 HA PHE B 53 12.328 12.952 7.618 1.00 0.00 H ATOM 2390 HB2 PHE B 53 12.031 10.331 9.098 1.00 0.00 H ATOM 2391 HB3 PHE B 53 12.972 10.489 7.597 1.00 0.00 H ATOM 2392 HD2 PHE B 53 15.172 11.209 7.631 1.00 0.00 H ATOM 2393 HE2 PHE B 53 17.165 11.925 8.924 1.00 0.00 H ATOM 2394 HZ PHE B 53 16.898 12.628 11.297 1.00 0.00 H ATOM 2395 HE1 PHE B 53 14.649 12.535 12.400 1.00 0.00 H ATOM 2396 HD1 PHE B 53 12.662 11.793 11.073 1.00 0.00 H ATOM 2397 H PHE B 53 10.422 12.138 9.764 1.00 0.00 H ATOM 2398 N ILE B 54 11.317 11.569 5.773 1.00 19.10 N ATOM 2399 CA ILE B 54 10.644 11.002 4.603 1.00 18.09 C ATOM 2400 C ILE B 54 11.699 10.161 3.857 1.00 17.81 C ATOM 2401 O ILE B 54 12.925 10.331 3.982 1.00 17.07 O ATOM 2402 CB ILE B 54 9.927 12.048 3.719 1.00 18.02 C ATOM 2403 CG1 ILE B 54 11.008 12.913 3.018 1.00 17.66 C ATOM 2404 CG2 ILE B 54 8.952 12.926 4.520 1.00 18.65 C ATOM 2405 CD1 ILE B 54 10.442 13.919 2.019 1.00 17.53 C ATOM 2406 HA ILE B 54 9.814 10.369 4.916 1.00 0.00 H ATOM 2407 HB ILE B 54 9.320 11.527 2.979 1.00 0.00 H ATOM 2408 HG12 ILE B 54 11.559 13.461 3.783 1.00 0.00 H ATOM 2409 HG13 ILE B 54 11.689 12.248 2.487 1.00 0.00 H ATOM 2410 HD11 ILE B 54 9.897 13.387 1.239 1.00 0.00 H ATOM 2411 HD12 ILE B 54 9.767 14.601 2.535 1.00 0.00 H ATOM 2412 HD13 ILE B 54 11.260 14.484 1.572 1.00 0.00 H ATOM 2413 HG21 ILE B 54 8.191 12.295 4.979 1.00 0.00 H ATOM 2414 HG22 ILE B 54 9.500 13.460 5.296 1.00 0.00 H ATOM 2415 HG23 ILE B 54 8.476 13.643 3.850 1.00 0.00 H ATOM 2416 H ILE B 54 12.290 11.918 5.662 1.00 0.00 H ATOM 2417 N LYS B 55 11.183 9.222 3.103 1.00 18.23 N ATOM 2418 CA LYS B 55 11.967 8.320 2.245 1.00 18.59 C ATOM 2419 C LYS B 55 11.986 8.935 0.849 1.00 16.67 C ATOM 2420 O LYS B 55 10.902 9.349 0.399 1.00 16.20 O ATOM 2421 CB LYS B 55 11.255 6.946 2.159 1.00 21.37 C ATOM 2422 CG LYS B 55 11.324 6.245 3.534 1.00 24.90 C ATOM 2423 CD LYS B 55 10.989 4.748 3.490 1.00 27.73 C ATOM 2424 CE LYS B 55 12.285 3.903 3.586 1.00 29.81 C ATOM 2425 NZ LYS B 55 11.876 2.416 3.556 1.00 31.67 N ATOM 2426 HA LYS B 55 12.973 8.187 2.643 1.00 0.00 H ATOM 2427 HB2 LYS B 55 10.212 7.093 1.878 1.00 0.00 H ATOM 2428 HB3 LYS B 55 11.748 6.327 1.410 1.00 0.00 H ATOM 2429 HG2 LYS B 55 12.334 6.359 3.927 1.00 0.00 H ATOM 2430 HG3 LYS B 55 10.618 6.735 4.204 1.00 0.00 H ATOM 2431 HD2 LYS B 55 10.336 4.501 4.327 1.00 0.00 H ATOM 2432 HD3 LYS B 55 10.480 4.521 2.553 1.00 0.00 H ATOM 2433 HE2 LYS B 55 12.807 4.127 4.517 1.00 0.00 H ATOM 2434 HE3 LYS B 55 12.938 4.126 2.742 1.00 0.00 H ATOM 2435 HZ1 LYS B 55 11.250 2.214 4.362 1.00 0.00 H ATOM 2436 HZ2 LYS B 55 11.376 2.213 2.667 1.00 0.00 H ATOM 2437 HZ3 LYS B 55 12.727 1.822 3.619 1.00 0.00 H ATOM 2438 H LYS B 55 10.149 9.106 3.112 1.00 0.00 H ATOM 2439 N VAL B 56 13.121 9.019 0.212 1.00 14.62 N ATOM 2440 CA VAL B 56 13.132 9.616 -1.144 1.00 13.86 C ATOM 2441 C VAL B 56 13.937 8.668 -2.025 1.00 13.49 C ATOM 2442 O VAL B 56 14.647 7.834 -1.433 1.00 13.86 O ATOM 2443 CB VAL B 56 13.743 11.033 -1.094 1.00 13.17 C ATOM 2444 CG1 VAL B 56 12.848 12.021 -0.394 1.00 13.00 C ATOM 2445 CG2 VAL B 56 15.140 10.963 -0.486 1.00 13.13 C ATOM 2446 HA VAL B 56 12.127 9.733 -1.549 1.00 0.00 H ATOM 2447 HB VAL B 56 13.834 11.410 -2.113 1.00 0.00 H ATOM 2448 HG11 VAL B 56 11.896 12.083 -0.921 1.00 0.00 H ATOM 2449 HG12 VAL B 56 12.677 11.692 0.631 1.00 0.00 H ATOM 2450 HG13 VAL B 56 13.326 13.001 -0.387 1.00 0.00 H ATOM 2451 HG21 VAL B 56 15.075 10.559 0.524 1.00 0.00 H ATOM 2452 HG22 VAL B 56 15.769 10.317 -1.098 1.00 0.00 H ATOM 2453 HG23 VAL B 56 15.570 11.964 -0.451 1.00 0.00 H ATOM 2454 H VAL B 56 14.000 8.674 0.647 1.00 0.00 H ATOM 2455 N ARG B 57 13.856 8.844 -3.306 1.00 12.73 N ATOM 2456 CA ARG B 57 14.677 8.005 -4.213 1.00 13.03 C ATOM 2457 C ARG B 57 15.847 8.912 -4.607 1.00 12.73 C ATOM 2458 O ARG B 57 15.619 10.102 -4.931 1.00 12.43 O ATOM 2459 CB ARG B 57 13.836 7.618 -5.424 1.00 13.68 C ATOM 2460 CG ARG B 57 12.494 7.008 -5.170 1.00 14.99 C ATOM 2461 CD ARG B 57 11.993 6.142 -6.284 1.00 16.16 C ATOM 2462 NE ARG B 57 11.745 6.893 -7.497 1.00 18.26 N ATOM 2463 CZ ARG B 57 10.766 7.809 -7.625 1.00 18.90 C ATOM 2464 NH1 ARG B 57 9.882 8.078 -6.670 1.00 19.34 N ATOM 2465 NH2 ARG B 57 10.710 8.539 -8.740 1.00 19.27 N ATOM 2466 HA ARG B 57 15.028 7.077 -3.761 1.00 0.00 H ATOM 2467 HB2 ARG B 57 13.678 8.521 -6.013 1.00 0.00 H ATOM 2468 HB3 ARG B 57 14.415 6.902 -6.008 1.00 0.00 H ATOM 2469 HG2 ARG B 57 12.560 6.401 -4.267 1.00 0.00 H ATOM 2470 HG3 ARG B 57 11.776 7.813 -5.013 1.00 0.00 H ATOM 2471 HD2 ARG B 57 11.063 5.668 -5.969 1.00 0.00 H ATOM 2472 HD3 ARG B 57 12.738 5.374 -6.493 1.00 0.00 H ATOM 2473 HE ARG B 57 12.359 6.715 -8.317 1.00 0.00 H ATOM 2474 HH12 ARG B 57 9.148 8.797 -6.829 1.00 0.00 H ATOM 2475 HH11 ARG B 57 9.924 7.569 -5.764 1.00 0.00 H ATOM 2476 HH22 ARG B 57 9.962 9.252 -8.858 1.00 0.00 H ATOM 2477 HH21 ARG B 57 11.415 8.396 -9.491 1.00 0.00 H ATOM 2478 H ARG B 57 13.220 9.569 -3.696 1.00 0.00 H ATOM 2479 N GLN B 58 17.045 8.426 -4.641 1.00 12.33 N ATOM 2480 CA GLN B 58 18.247 9.171 -5.001 1.00 12.64 C ATOM 2481 C GLN B 58 18.770 8.808 -6.386 1.00 12.63 C ATOM 2482 O GLN B 58 19.116 7.626 -6.620 1.00 12.37 O ATOM 2483 CB GLN B 58 19.386 8.900 -4.002 1.00 13.44 C ATOM 2484 CG GLN B 58 20.634 9.663 -4.325 1.00 15.48 C ATOM 2485 CD GLN B 58 21.735 9.389 -3.344 1.00 17.04 C ATOM 2486 OE1 GLN B 58 21.507 9.244 -2.153 1.00 18.75 O ATOM 2487 NE2 GLN B 58 22.987 9.348 -3.787 1.00 17.51 N ATOM 2488 HA GLN B 58 17.953 10.220 -4.986 1.00 0.00 H ATOM 2489 HB2 GLN B 58 19.051 9.186 -3.005 1.00 0.00 H ATOM 2490 HB3 GLN B 58 19.615 7.834 -4.015 1.00 0.00 H ATOM 2491 HG2 GLN B 58 20.972 9.378 -5.321 1.00 0.00 H ATOM 2492 HG3 GLN B 58 20.408 10.729 -4.311 1.00 0.00 H ATOM 2493 HE22 GLN B 58 23.184 9.471 -4.801 1.00 0.00 H ATOM 2494 HE21 GLN B 58 23.770 9.193 -3.120 1.00 0.00 H ATOM 2495 H GLN B 58 17.161 7.423 -4.392 1.00 0.00 H ATOM 2496 N TYR B 59 18.853 9.762 -7.262 1.00 12.26 N ATOM 2497 CA TYR B 59 19.406 9.565 -8.622 1.00 12.25 C ATOM 2498 C TYR B 59 20.703 10.357 -8.713 1.00 13.00 C ATOM 2499 O TYR B 59 20.722 11.542 -8.327 1.00 12.70 O ATOM 2500 CB TYR B 59 18.445 10.090 -9.693 1.00 11.14 C ATOM 2501 CG TYR B 59 17.131 9.366 -9.734 1.00 11.31 C ATOM 2502 CD1 TYR B 59 16.085 9.705 -8.885 1.00 11.55 C ATOM 2503 CD2 TYR B 59 16.894 8.338 -10.663 1.00 11.16 C ATOM 2504 CE1 TYR B 59 14.851 9.066 -8.940 1.00 11.63 C ATOM 2505 CE2 TYR B 59 15.689 7.670 -10.729 1.00 11.28 C ATOM 2506 CZ TYR B 59 14.665 8.047 -9.880 1.00 12.06 C ATOM 2507 OH TYR B 59 13.485 7.359 -9.916 1.00 12.88 O ATOM 2508 HA TYR B 59 19.565 8.500 -8.792 1.00 0.00 H ATOM 2509 HB3 TYR B 59 18.925 9.987 -10.666 1.00 0.00 H ATOM 2510 HB2 TYR B 59 18.251 11.144 -9.494 1.00 0.00 H ATOM 2511 HD2 TYR B 59 17.689 8.059 -11.354 1.00 0.00 H ATOM 2512 HE2 TYR B 59 15.546 6.857 -11.440 1.00 0.00 H ATOM 2513 HE1 TYR B 59 14.045 9.353 -8.264 1.00 0.00 H ATOM 2514 HD1 TYR B 59 16.236 10.497 -8.152 1.00 0.00 H ATOM 2515 HH TYR B 59 12.858 7.746 -9.255 1.00 0.00 H ATOM 2516 H TYR B 59 18.515 10.709 -6.997 1.00 0.00 H ATOM 2517 N ASP B 60 21.738 9.788 -9.249 1.00 14.04 N ATOM 2518 CA ASP B 60 23.013 10.523 -9.392 1.00 15.73 C ATOM 2519 C ASP B 60 23.231 11.034 -10.803 1.00 15.58 C ATOM 2520 O ASP B 60 22.692 10.465 -11.765 1.00 14.98 O ATOM 2521 CB ASP B 60 24.136 9.557 -9.000 1.00 17.87 C ATOM 2522 CG ASP B 60 24.031 9.182 -7.521 1.00 19.66 C ATOM 2523 OD1 ASP B 60 23.497 10.064 -6.825 1.00 20.46 O ATOM 2524 OD2 ASP B 60 24.490 8.098 -7.111 1.00 21.16 O ATOM 2525 HA ASP B 60 22.997 11.403 -8.749 1.00 0.00 H ATOM 2526 HB2 ASP B 60 24.060 8.654 -9.605 1.00 0.00 H ATOM 2527 HB3 ASP B 60 25.099 10.034 -9.181 1.00 0.00 H ATOM 2528 H ASP B 60 21.670 8.805 -9.582 1.00 0.00 H ATOM 2529 N GLN B 61 24.032 12.070 -10.911 1.00 16.23 N ATOM 2530 CA GLN B 61 24.459 12.639 -12.203 1.00 17.72 C ATOM 2531 C GLN B 61 23.349 13.102 -13.127 1.00 16.39 C ATOM 2532 O GLN B 61 23.359 12.790 -14.349 1.00 17.04 O ATOM 2533 CB GLN B 61 25.397 11.651 -12.965 1.00 19.63 C ATOM 2534 CG GLN B 61 26.561 12.336 -13.675 1.00 22.61 C ATOM 2535 CD GLN B 61 27.698 11.379 -13.973 1.00 24.60 C ATOM 2536 OE1 GLN B 61 27.886 10.375 -13.257 1.00 26.30 O ATOM 2537 NE2 GLN B 61 28.491 11.646 -15.010 1.00 25.30 N ATOM 2538 HA GLN B 61 24.994 13.546 -11.921 1.00 0.00 H ATOM 2539 HB2 GLN B 61 25.803 10.938 -12.247 1.00 0.00 H ATOM 2540 HB3 GLN B 61 24.805 11.118 -13.709 1.00 0.00 H ATOM 2541 HG2 GLN B 61 26.201 12.756 -14.614 1.00 0.00 H ATOM 2542 HG3 GLN B 61 26.936 13.139 -13.040 1.00 0.00 H ATOM 2543 HE22 GLN B 61 28.317 12.488 -15.594 1.00 0.00 H ATOM 2544 HE21 GLN B 61 29.284 11.012 -15.235 1.00 0.00 H ATOM 2545 H GLN B 61 24.384 12.513 -10.038 1.00 0.00 H ATOM 2546 N ILE B 62 22.430 13.867 -12.566 1.00 15.00 N ATOM 2547 CA ILE B 62 21.306 14.417 -13.322 1.00 13.34 C ATOM 2548 C ILE B 62 21.634 15.843 -13.721 1.00 13.70 C ATOM 2549 O ILE B 62 22.091 16.677 -12.903 1.00 13.10 O ATOM 2550 CB ILE B 62 19.997 14.378 -12.442 1.00 12.53 C ATOM 2551 CG1 ILE B 62 19.808 12.958 -11.866 1.00 12.32 C ATOM 2552 CG2 ILE B 62 18.764 14.856 -13.208 1.00 11.56 C ATOM 2553 CD1 ILE B 62 19.255 11.941 -12.901 1.00 12.28 C ATOM 2554 HA ILE B 62 21.134 13.821 -14.219 1.00 0.00 H ATOM 2555 HB ILE B 62 20.117 15.079 -11.616 1.00 0.00 H ATOM 2556 HG12 ILE B 62 20.773 12.598 -11.509 1.00 0.00 H ATOM 2557 HG13 ILE B 62 19.111 13.014 -11.030 1.00 0.00 H ATOM 2558 HD11 ILE B 62 18.284 12.281 -13.260 1.00 0.00 H ATOM 2559 HD12 ILE B 62 19.947 11.865 -13.740 1.00 0.00 H ATOM 2560 HD13 ILE B 62 19.147 10.965 -12.428 1.00 0.00 H ATOM 2561 HG21 ILE B 62 18.918 15.884 -13.537 1.00 0.00 H ATOM 2562 HG22 ILE B 62 18.606 14.215 -14.075 1.00 0.00 H ATOM 2563 HG23 ILE B 62 17.892 14.809 -12.556 1.00 0.00 H ATOM 2564 H ILE B 62 22.509 14.085 -11.552 1.00 0.00 H ATOM 2565 N LEU B 63 21.376 16.119 -14.984 1.00 14.75 N ATOM 2566 CA LEU B 63 21.564 17.448 -15.506 1.00 16.35 C ATOM 2567 C LEU B 63 20.307 18.278 -15.164 1.00 16.42 C ATOM 2568 O LEU B 63 19.193 17.870 -15.439 1.00 16.02 O ATOM 2569 CB LEU B 63 21.818 17.451 -17.011 1.00 18.15 C ATOM 2570 CG LEU B 63 21.809 18.922 -17.527 1.00 19.42 C ATOM 2571 CD1 LEU B 63 23.162 19.574 -17.286 1.00 19.71 C ATOM 2572 CD2 LEU B 63 21.472 18.875 -18.995 1.00 20.04 C ATOM 2573 HA LEU B 63 22.451 17.885 -15.047 1.00 0.00 H ATOM 2574 HB2 LEU B 63 22.787 16.997 -17.219 1.00 0.00 H ATOM 2575 HB3 LEU B 63 21.036 16.882 -17.515 1.00 0.00 H ATOM 2576 HG LEU B 63 21.071 19.522 -16.994 1.00 0.00 H ATOM 2577 HD21 LEU B 63 22.225 18.287 -19.521 1.00 0.00 H ATOM 2578 HD22 LEU B 63 20.493 18.415 -19.127 1.00 0.00 H ATOM 2579 HD23 LEU B 63 21.456 19.889 -19.395 1.00 0.00 H ATOM 2580 HD11 LEU B 63 23.380 19.572 -16.218 1.00 0.00 H ATOM 2581 HD12 LEU B 63 23.933 19.015 -17.816 1.00 0.00 H ATOM 2582 HD13 LEU B 63 23.139 20.601 -17.652 1.00 0.00 H ATOM 2583 H LEU B 63 21.032 15.366 -15.613 1.00 0.00 H ATOM 2584 N ILE B 64 20.567 19.420 -14.586 1.00 17.14 N ATOM 2585 CA ILE B 64 19.440 20.330 -14.272 1.00 18.80 C ATOM 2586 C ILE B 64 19.999 21.722 -14.568 1.00 19.53 C ATOM 2587 O ILE B 64 21.166 21.981 -14.270 1.00 19.17 O ATOM 2588 CB ILE B 64 18.950 20.108 -12.846 1.00 19.47 C ATOM 2589 CG1 ILE B 64 17.922 21.173 -12.351 1.00 20.06 C ATOM 2590 CG2 ILE B 64 20.145 20.106 -11.848 1.00 20.51 C ATOM 2591 CD1 ILE B 64 17.082 20.374 -11.240 1.00 21.55 C ATOM 2592 HA ILE B 64 18.541 20.161 -14.865 1.00 0.00 H ATOM 2593 HB ILE B 64 18.447 19.141 -12.872 1.00 0.00 H ATOM 2594 HG12 ILE B 64 18.429 22.034 -11.915 1.00 0.00 H ATOM 2595 HG13 ILE B 64 17.278 21.505 -13.166 1.00 0.00 H ATOM 2596 HD11 ILE B 64 16.603 19.510 -11.700 1.00 0.00 H ATOM 2597 HD12 ILE B 64 17.754 20.040 -10.449 1.00 0.00 H ATOM 2598 HD13 ILE B 64 16.322 21.032 -10.819 1.00 0.00 H ATOM 2599 HG21 ILE B 64 20.836 19.306 -12.112 1.00 0.00 H ATOM 2600 HG22 ILE B 64 20.661 21.065 -11.899 1.00 0.00 H ATOM 2601 HG23 ILE B 64 19.772 19.946 -10.836 1.00 0.00 H ATOM 2602 H ILE B 64 21.545 19.685 -14.351 1.00 0.00 H ATOM 2603 N GLU B 65 19.169 22.504 -15.196 1.00 20.99 N ATOM 2604 CA GLU B 65 19.503 23.887 -15.542 1.00 23.20 C ATOM 2605 C GLU B 65 18.709 24.781 -14.586 1.00 23.19 C ATOM 2606 O GLU B 65 17.471 24.721 -14.468 1.00 22.95 O ATOM 2607 CB GLU B 65 19.170 24.252 -16.970 1.00 25.06 C ATOM 2608 CG GLU B 65 19.923 25.466 -17.563 1.00 28.45 C ATOM 2609 CD GLU B 65 19.400 25.807 -18.954 1.00 30.55 C ATOM 2610 OE1 GLU B 65 19.632 24.808 -19.708 1.00 31.52 O ATOM 2611 OE2 GLU B 65 18.769 26.831 -19.234 1.00 31.50 O ATOM 2612 HA GLU B 65 20.581 24.020 -15.448 1.00 0.00 H ATOM 2613 HB2 GLU B 65 19.392 23.386 -17.594 1.00 0.00 H ATOM 2614 HB3 GLU B 65 18.103 24.468 -17.017 1.00 0.00 H ATOM 2615 HG2 GLU B 65 19.784 26.327 -16.909 1.00 0.00 H ATOM 2616 HG3 GLU B 65 20.985 25.230 -17.629 1.00 0.00 H ATOM 2617 H GLU B 65 18.235 22.133 -15.462 1.00 0.00 H ATOM 2618 N ILE B 66 19.467 25.585 -13.888 1.00 23.81 N ATOM 2619 CA ILE B 66 18.857 26.505 -12.893 1.00 24.86 C ATOM 2620 C ILE B 66 19.184 27.916 -13.379 1.00 26.13 C ATOM 2621 O ILE B 66 20.386 28.252 -13.452 1.00 26.31 O ATOM 2622 CB ILE B 66 19.453 26.248 -11.481 1.00 24.06 C ATOM 2623 CG1 ILE B 66 19.238 24.751 -11.122 1.00 23.82 C ATOM 2624 CG2 ILE B 66 18.931 27.240 -10.432 1.00 24.17 C ATOM 2625 CD1 ILE B 66 20.338 24.207 -10.179 1.00 23.75 C ATOM 2626 HA ILE B 66 17.780 26.356 -12.809 1.00 0.00 H ATOM 2627 HB ILE B 66 20.527 26.437 -11.488 1.00 0.00 H ATOM 2628 HG12 ILE B 66 18.271 24.644 -10.631 1.00 0.00 H ATOM 2629 HG13 ILE B 66 19.244 24.166 -12.042 1.00 0.00 H ATOM 2630 HD11 ILE B 66 21.310 24.302 -10.664 1.00 0.00 H ATOM 2631 HD12 ILE B 66 20.336 24.780 -9.252 1.00 0.00 H ATOM 2632 HD13 ILE B 66 20.140 23.158 -9.960 1.00 0.00 H ATOM 2633 HG21 ILE B 66 19.197 28.254 -10.729 1.00 0.00 H ATOM 2634 HG22 ILE B 66 17.847 27.153 -10.360 1.00 0.00 H ATOM 2635 HG23 ILE B 66 19.380 27.014 -9.465 1.00 0.00 H ATOM 2636 H ILE B 66 20.497 25.581 -14.029 1.00 0.00 H ATOM 2637 N CYS B 67 18.112 28.598 -13.686 1.00 27.81 N ATOM 2638 CA CYS B 67 18.221 29.993 -14.160 1.00 30.02 C ATOM 2639 C CYS B 67 19.326 30.087 -15.204 1.00 29.49 C ATOM 2640 O CYS B 67 20.171 30.984 -15.112 1.00 29.91 O ATOM 2641 CB CYS B 67 18.528 30.965 -13.015 1.00 31.35 C ATOM 2642 SG CYS B 67 17.076 31.922 -12.544 1.00 35.27 S ATOM 2643 HA CYS B 67 17.260 30.273 -14.591 1.00 0.00 H ATOM 2644 HB2 CYS B 67 19.314 31.649 -13.334 1.00 0.00 H ATOM 2645 HB3 CYS B 67 18.872 30.396 -12.151 1.00 0.00 H ATOM 2646 HG CYS B 67 17.406 32.778 -11.513 1.00 0.00 H ATOM 2647 H CYS B 67 17.175 28.155 -13.596 1.00 0.00 H ATOM 2648 N GLY B 68 19.275 29.116 -16.091 1.00 29.23 N ATOM 2649 CA GLY B 68 20.246 29.046 -17.184 1.00 28.68 C ATOM 2650 C GLY B 68 21.640 28.658 -16.829 1.00 28.06 C ATOM 2651 O GLY B 68 22.573 28.951 -17.611 1.00 28.69 O ATOM 2652 HA3 GLY B 68 20.287 30.030 -17.650 1.00 0.00 H ATOM 2653 HA2 GLY B 68 19.876 28.318 -17.906 1.00 0.00 H ATOM 2654 H GLY B 68 18.535 28.389 -16.014 1.00 0.00 H ATOM 2655 N HIS B 69 21.842 28.042 -15.685 1.00 27.36 N ATOM 2656 CA HIS B 69 23.194 27.576 -15.304 1.00 26.02 C ATOM 2657 C HIS B 69 22.980 26.043 -15.211 1.00 24.86 C ATOM 2658 O HIS B 69 22.059 25.673 -14.472 1.00 23.68 O ATOM 2659 CB HIS B 69 23.743 28.023 -13.957 1.00 27.23 C ATOM 2660 CG HIS B 69 23.879 29.509 -13.878 1.00 28.19 C ATOM 2661 ND1 HIS B 69 22.816 30.362 -14.134 1.00 28.81 N ATOM 2662 CD2 HIS B 69 24.943 30.278 -13.576 1.00 28.53 C ATOM 2663 CE1 HIS B 69 23.249 31.611 -13.962 1.00 29.14 C ATOM 2664 NE2 HIS B 69 24.524 31.584 -13.636 1.00 28.92 N ATOM 2665 HA HIS B 69 23.914 27.972 -16.021 1.00 0.00 H ATOM 2666 HB2 HIS B 69 23.066 27.688 -13.171 1.00 0.00 H ATOM 2667 HB3 HIS B 69 24.723 27.570 -13.807 1.00 0.00 H ATOM 2668 HD2 HIS B 69 25.946 29.929 -13.331 1.00 0.00 H ATOM 2669 HE1 HIS B 69 22.644 32.511 -14.073 1.00 0.00 H ATOM 2670 H HIS B 69 21.042 27.880 -15.040 1.00 0.00 H ATOM 2671 N LYS B 70 23.810 25.375 -15.980 1.00 23.54 N ATOM 2672 CA LYS B 70 23.751 23.921 -16.025 1.00 23.14 C ATOM 2673 C LYS B 70 24.493 23.361 -14.819 1.00 21.44 C ATOM 2674 O LYS B 70 25.585 23.888 -14.542 1.00 21.98 O ATOM 2675 CB LYS B 70 24.377 23.308 -17.282 1.00 24.81 C ATOM 2676 CG LYS B 70 23.395 23.352 -18.468 1.00 26.98 C ATOM 2677 CD LYS B 70 23.989 22.670 -19.706 1.00 28.65 C ATOM 2678 CE LYS B 70 23.092 22.872 -20.939 1.00 29.67 C ATOM 2679 NZ LYS B 70 22.909 21.552 -21.657 1.00 30.45 N ATOM 2680 HA LYS B 70 22.693 23.660 -16.028 1.00 0.00 H ATOM 2681 HB2 LYS B 70 25.275 23.868 -17.542 1.00 0.00 H ATOM 2682 HB3 LYS B 70 24.643 22.271 -17.078 1.00 0.00 H ATOM 2683 HG2 LYS B 70 22.475 22.840 -18.187 1.00 0.00 H ATOM 2684 HG3 LYS B 70 23.172 24.392 -18.707 1.00 0.00 H ATOM 2685 HD2 LYS B 70 24.972 23.095 -19.908 1.00 0.00 H ATOM 2686 HD3 LYS B 70 24.089 21.602 -19.510 1.00 0.00 H ATOM 2687 HE2 LYS B 70 23.558 23.590 -21.613 1.00 0.00 H ATOM 2688 HE3 LYS B 70 22.120 23.251 -20.623 1.00 0.00 H ATOM 2689 HZ1 LYS B 70 23.837 21.192 -21.959 1.00 0.00 H ATOM 2690 HZ2 LYS B 70 22.463 20.868 -21.013 1.00 0.00 H ATOM 2691 HZ3 LYS B 70 22.302 21.693 -22.490 1.00 0.00 H ATOM 2692 H LYS B 70 24.509 25.885 -16.557 1.00 0.00 H ATOM 2693 N ALA B 71 23.910 22.407 -14.148 1.00 18.37 N ATOM 2694 CA ALA B 71 24.495 21.724 -13.006 1.00 16.71 C ATOM 2695 C ALA B 71 24.292 20.214 -13.218 1.00 16.00 C ATOM 2696 O ALA B 71 23.301 19.862 -13.909 1.00 16.32 O ATOM 2697 CB ALA B 71 23.872 22.164 -11.690 1.00 15.86 C ATOM 2698 HA ALA B 71 25.554 21.974 -12.941 1.00 0.00 H ATOM 2699 HB1 ALA B 71 24.024 23.235 -11.558 1.00 0.00 H ATOM 2700 HB2 ALA B 71 22.804 21.946 -11.704 1.00 0.00 H ATOM 2701 HB3 ALA B 71 24.343 21.625 -10.868 1.00 0.00 H ATOM 2702 H ALA B 71 22.959 22.114 -14.451 1.00 0.00 H ATOM 2703 N ILE B 72 25.187 19.417 -12.666 1.00 14.87 N ATOM 2704 CA ILE B 72 25.043 17.955 -12.736 1.00 14.43 C ATOM 2705 C ILE B 72 25.393 17.317 -11.395 1.00 13.52 C ATOM 2706 O ILE B 72 26.583 17.314 -11.030 1.00 13.67 O ATOM 2707 CB ILE B 72 25.865 17.295 -13.893 1.00 14.35 C ATOM 2708 CG1 ILE B 72 25.648 18.115 -15.214 1.00 14.37 C ATOM 2709 CG2 ILE B 72 25.553 15.780 -14.056 1.00 13.22 C ATOM 2710 CD1 ILE B 72 26.822 17.739 -16.212 1.00 14.42 C ATOM 2711 HA ILE B 72 23.995 17.765 -12.966 1.00 0.00 H ATOM 2712 HB ILE B 72 26.924 17.332 -13.639 1.00 0.00 H ATOM 2713 HG12 ILE B 72 24.686 17.858 -15.658 1.00 0.00 H ATOM 2714 HG13 ILE B 72 25.672 19.183 -14.997 1.00 0.00 H ATOM 2715 HD11 ILE B 72 27.779 17.996 -15.758 1.00 0.00 H ATOM 2716 HD12 ILE B 72 26.792 16.669 -16.419 1.00 0.00 H ATOM 2717 HD13 ILE B 72 26.699 18.294 -17.142 1.00 0.00 H ATOM 2718 HG21 ILE B 72 25.797 15.259 -13.130 1.00 0.00 H ATOM 2719 HG22 ILE B 72 24.494 15.650 -14.279 1.00 0.00 H ATOM 2720 HG23 ILE B 72 26.150 15.373 -14.872 1.00 0.00 H ATOM 2721 H ILE B 72 26.006 19.828 -12.174 1.00 0.00 H ATOM 2722 N GLY B 73 24.415 16.739 -10.735 1.00 13.00 N ATOM 2723 CA GLY B 73 24.724 16.107 -9.411 1.00 13.03 C ATOM 2724 C GLY B 73 23.495 15.288 -8.996 1.00 12.94 C ATOM 2725 O GLY B 73 22.643 14.983 -9.873 1.00 12.92 O ATOM 2726 HA3 GLY B 73 24.927 16.878 -8.668 1.00 0.00 H ATOM 2727 HA2 GLY B 73 25.593 15.455 -9.503 1.00 0.00 H ATOM 2728 H GLY B 73 23.450 16.720 -11.122 1.00 0.00 H ATOM 2729 N THR B 74 23.493 14.976 -7.719 1.00 11.30 N ATOM 2730 CA THR B 74 22.456 14.178 -7.104 1.00 11.03 C ATOM 2731 C THR B 74 21.177 14.919 -6.891 1.00 10.68 C ATOM 2732 O THR B 74 21.152 16.068 -6.429 1.00 11.13 O ATOM 2733 CB THR B 74 22.991 13.548 -5.735 1.00 11.74 C ATOM 2734 OG1 THR B 74 24.203 12.898 -6.146 1.00 12.01 O ATOM 2735 CG2 THR B 74 22.015 12.598 -5.039 1.00 12.05 C ATOM 2736 HA THR B 74 22.217 13.378 -7.805 1.00 0.00 H ATOM 2737 HB THR B 74 23.134 14.308 -4.967 1.00 0.00 H ATOM 2738 HG1 THR B 74 23.993 12.213 -6.829 1.00 0.00 H ATOM 2739 HG23 THR B 74 21.118 13.147 -4.752 1.00 0.00 H ATOM 2740 HG21 THR B 74 21.746 11.792 -5.721 1.00 0.00 H ATOM 2741 HG22 THR B 74 22.488 12.181 -4.150 1.00 0.00 H ATOM 2742 H THR B 74 24.274 15.319 -7.123 1.00 0.00 H ATOM 2743 N VAL B 75 20.096 14.267 -7.251 1.00 10.49 N ATOM 2744 CA VAL B 75 18.744 14.792 -7.125 1.00 10.08 C ATOM 2745 C VAL B 75 17.914 13.724 -6.417 1.00 10.09 C ATOM 2746 O VAL B 75 18.047 12.529 -6.775 1.00 9.75 O ATOM 2747 CB VAL B 75 18.218 15.154 -8.520 1.00 10.34 C ATOM 2748 CG1 VAL B 75 16.749 15.583 -8.412 1.00 10.54 C ATOM 2749 CG2 VAL B 75 19.004 16.261 -9.205 1.00 9.79 C ATOM 2750 HA VAL B 75 18.697 15.707 -6.534 1.00 0.00 H ATOM 2751 HB VAL B 75 18.331 14.260 -9.133 1.00 0.00 H ATOM 2752 HG11 VAL B 75 16.161 14.762 -8.001 1.00 0.00 H ATOM 2753 HG12 VAL B 75 16.672 16.450 -7.756 1.00 0.00 H ATOM 2754 HG13 VAL B 75 16.373 15.841 -9.402 1.00 0.00 H ATOM 2755 HG21 VAL B 75 18.960 17.165 -8.598 1.00 0.00 H ATOM 2756 HG22 VAL B 75 20.042 15.949 -9.321 1.00 0.00 H ATOM 2757 HG23 VAL B 75 18.571 16.459 -10.185 1.00 0.00 H ATOM 2758 H VAL B 75 20.213 13.315 -7.652 1.00 0.00 H ATOM 2759 N LEU B 76 17.112 14.144 -5.467 1.00 9.29 N ATOM 2760 CA LEU B 76 16.243 13.216 -4.710 1.00 9.26 C ATOM 2761 C LEU B 76 14.805 13.509 -5.145 1.00 9.69 C ATOM 2762 O LEU B 76 14.481 14.671 -5.496 1.00 8.96 O ATOM 2763 CB LEU B 76 16.460 13.435 -3.198 1.00 8.90 C ATOM 2764 CG LEU B 76 17.884 13.522 -2.688 1.00 9.00 C ATOM 2765 CD1 LEU B 76 17.939 13.987 -1.240 1.00 8.21 C ATOM 2766 CD2 LEU B 76 18.563 12.150 -2.872 1.00 8.54 C ATOM 2767 HA LEU B 76 16.473 12.170 -4.910 1.00 0.00 H ATOM 2768 HB2 LEU B 76 15.962 14.367 -2.931 1.00 0.00 H ATOM 2769 HB3 LEU B 76 15.980 12.606 -2.678 1.00 0.00 H ATOM 2770 HG LEU B 76 18.425 14.271 -3.266 1.00 0.00 H ATOM 2771 HD21 LEU B 76 18.014 11.396 -2.308 1.00 0.00 H ATOM 2772 HD22 LEU B 76 18.564 11.886 -3.929 1.00 0.00 H ATOM 2773 HD23 LEU B 76 19.589 12.202 -2.508 1.00 0.00 H ATOM 2774 HD11 LEU B 76 17.485 14.975 -1.159 1.00 0.00 H ATOM 2775 HD12 LEU B 76 17.393 13.283 -0.613 1.00 0.00 H ATOM 2776 HD13 LEU B 76 18.978 14.035 -0.914 1.00 0.00 H ATOM 2777 H LEU B 76 17.086 15.159 -5.240 1.00 0.00 H ATOM 2778 N VAL B 77 13.999 12.454 -5.140 1.00 9.73 N ATOM 2779 CA VAL B 77 12.566 12.569 -5.532 1.00 9.48 C ATOM 2780 C VAL B 77 11.778 11.892 -4.405 1.00 8.90 C ATOM 2781 O VAL B 77 12.109 10.794 -3.966 1.00 7.81 O ATOM 2782 CB VAL B 77 12.330 11.886 -6.902 1.00 9.58 C ATOM 2783 CG1 VAL B 77 10.879 11.841 -7.365 1.00 9.01 C ATOM 2784 CG2 VAL B 77 13.264 12.496 -7.929 1.00 10.51 C ATOM 2785 HA VAL B 77 12.248 13.604 -5.655 1.00 0.00 H ATOM 2786 HB VAL B 77 12.569 10.830 -6.777 1.00 0.00 H ATOM 2787 HG11 VAL B 77 10.284 11.290 -6.637 1.00 0.00 H ATOM 2788 HG12 VAL B 77 10.496 12.858 -7.455 1.00 0.00 H ATOM 2789 HG13 VAL B 77 10.823 11.343 -8.333 1.00 0.00 H ATOM 2790 HG21 VAL B 77 13.063 13.564 -8.012 1.00 0.00 H ATOM 2791 HG22 VAL B 77 14.297 12.343 -7.616 1.00 0.00 H ATOM 2792 HG23 VAL B 77 13.101 12.018 -8.895 1.00 0.00 H ATOM 2793 H VAL B 77 14.376 11.527 -4.856 1.00 0.00 H ATOM 2794 N GLY B 78 10.720 12.546 -4.010 1.00 9.44 N ATOM 2795 CA GLY B 78 9.851 12.072 -2.947 1.00 9.78 C ATOM 2796 C GLY B 78 8.761 13.088 -2.671 1.00 11.06 C ATOM 2797 O GLY B 78 8.536 14.106 -3.371 1.00 10.84 O ATOM 2798 HA3 GLY B 78 10.439 11.919 -2.042 1.00 0.00 H ATOM 2799 HA2 GLY B 78 9.396 11.128 -3.247 1.00 0.00 H ATOM 2800 H GLY B 78 10.489 13.446 -4.477 1.00 0.00 H ATOM 2801 N PRO B 79 8.070 12.796 -1.583 1.00 11.23 N ATOM 2802 CA PRO B 79 6.940 13.615 -1.172 1.00 11.50 C ATOM 2803 C PRO B 79 7.275 14.933 -0.563 1.00 10.99 C ATOM 2804 O PRO B 79 6.863 15.262 0.539 1.00 11.23 O ATOM 2805 CB PRO B 79 6.128 12.587 -0.345 1.00 12.27 C ATOM 2806 CG PRO B 79 7.220 11.773 0.345 1.00 11.86 C ATOM 2807 CD PRO B 79 8.306 11.622 -0.704 1.00 11.49 C ATOM 2808 HA PRO B 79 6.351 14.037 -1.986 1.00 0.00 H ATOM 2809 HD3 PRO B 79 9.298 11.660 -0.253 1.00 0.00 H ATOM 2810 HD2 PRO B 79 8.195 10.688 -1.255 1.00 0.00 H ATOM 2811 HG3 PRO B 79 6.840 10.798 0.649 1.00 0.00 H ATOM 2812 HG2 PRO B 79 7.600 12.302 1.219 1.00 0.00 H ATOM 2813 HB2 PRO B 79 5.489 13.085 0.384 1.00 0.00 H ATOM 2814 HB3 PRO B 79 5.517 11.957 -0.991 1.00 0.00 H ATOM 2815 N THR B 80 7.994 15.790 -1.254 1.00 10.95 N ATOM 2816 CA THR B 80 8.364 17.125 -0.758 1.00 10.61 C ATOM 2817 C THR B 80 7.243 18.080 -1.084 1.00 10.47 C ATOM 2818 O THR B 80 6.579 17.902 -2.102 1.00 10.86 O ATOM 2819 CB THR B 80 9.724 17.571 -1.445 1.00 10.67 C ATOM 2820 OG1 THR B 80 9.930 18.919 -0.961 1.00 10.85 O ATOM 2821 CG2 THR B 80 9.690 17.641 -2.978 1.00 10.23 C ATOM 2822 HA THR B 80 8.515 17.118 0.321 1.00 0.00 H ATOM 2823 HB THR B 80 10.496 16.841 -1.202 1.00 0.00 H ATOM 2824 HG1 THR B 80 9.167 19.487 -1.236 1.00 0.00 H ATOM 2825 HG23 THR B 80 9.536 16.641 -3.383 1.00 0.00 H ATOM 2826 HG21 THR B 80 8.874 18.291 -3.293 1.00 0.00 H ATOM 2827 HG22 THR B 80 10.636 18.040 -3.343 1.00 0.00 H ATOM 2828 H THR B 80 8.318 15.509 -2.201 1.00 0.00 H ATOM 2829 N PRO B 81 7.003 19.078 -0.254 1.00 10.49 N ATOM 2830 CA PRO B 81 5.933 20.063 -0.486 1.00 10.70 C ATOM 2831 C PRO B 81 6.226 21.006 -1.660 1.00 10.92 C ATOM 2832 O PRO B 81 5.248 21.481 -2.262 1.00 10.51 O ATOM 2833 CB PRO B 81 5.758 20.825 0.813 1.00 10.80 C ATOM 2834 CG PRO B 81 6.738 20.230 1.787 1.00 10.86 C ATOM 2835 CD PRO B 81 7.680 19.335 1.025 1.00 10.65 C ATOM 2836 HA PRO B 81 5.015 19.550 -0.771 1.00 0.00 H ATOM 2837 HD3 PRO B 81 8.635 19.834 0.861 1.00 0.00 H ATOM 2838 HD2 PRO B 81 7.846 18.403 1.566 1.00 0.00 H ATOM 2839 HG3 PRO B 81 6.204 19.649 2.539 1.00 0.00 H ATOM 2840 HG2 PRO B 81 7.300 21.025 2.277 1.00 0.00 H ATOM 2841 HB2 PRO B 81 5.971 21.883 0.662 1.00 0.00 H ATOM 2842 HB3 PRO B 81 4.740 20.710 1.184 1.00 0.00 H ATOM 2843 N VAL B 82 7.498 21.271 -1.933 1.00 9.55 N ATOM 2844 CA VAL B 82 7.931 22.138 -3.006 1.00 9.72 C ATOM 2845 C VAL B 82 9.225 21.575 -3.628 1.00 9.62 C ATOM 2846 O VAL B 82 9.869 20.804 -2.900 1.00 9.78 O ATOM 2847 CB VAL B 82 8.226 23.605 -2.543 1.00 9.62 C ATOM 2848 CG1 VAL B 82 6.932 24.361 -2.384 1.00 10.28 C ATOM 2849 CG2 VAL B 82 9.141 23.696 -1.348 1.00 8.87 C ATOM 2850 HA VAL B 82 7.110 22.170 -3.722 1.00 0.00 H ATOM 2851 HB VAL B 82 8.801 24.094 -3.330 1.00 0.00 H ATOM 2852 HG11 VAL B 82 6.406 24.383 -3.338 1.00 0.00 H ATOM 2853 HG12 VAL B 82 6.312 23.865 -1.637 1.00 0.00 H ATOM 2854 HG13 VAL B 82 7.145 25.380 -2.062 1.00 0.00 H ATOM 2855 HG21 VAL B 82 8.688 23.176 -0.504 1.00 0.00 H ATOM 2856 HG22 VAL B 82 10.099 23.234 -1.589 1.00 0.00 H ATOM 2857 HG23 VAL B 82 9.296 24.744 -1.090 1.00 0.00 H ATOM 2858 H VAL B 82 8.227 20.828 -1.339 1.00 0.00 H ATOM 2859 N ASN B 83 9.533 21.992 -4.840 1.00 9.19 N ATOM 2860 CA ASN B 83 10.817 21.559 -5.467 1.00 8.74 C ATOM 2861 C ASN B 83 11.878 22.400 -4.743 1.00 8.37 C ATOM 2862 O ASN B 83 11.694 23.617 -4.665 1.00 7.74 O ATOM 2863 CB ASN B 83 10.846 21.784 -6.976 1.00 9.30 C ATOM 2864 CG ASN B 83 9.871 20.930 -7.726 1.00 9.67 C ATOM 2865 OD1 ASN B 83 9.830 19.697 -7.568 1.00 10.15 O ATOM 2866 ND2 ASN B 83 9.027 21.559 -8.536 1.00 10.56 N ATOM 2867 HA ASN B 83 10.980 20.487 -5.361 1.00 0.00 H ATOM 2868 HB2 ASN B 83 10.612 22.830 -7.174 1.00 0.00 H ATOM 2869 HB3 ASN B 83 11.850 21.562 -7.339 1.00 0.00 H ATOM 2870 HD22 ASN B 83 9.085 22.591 -8.648 1.00 0.00 H ATOM 2871 HD21 ASN B 83 8.308 21.019 -9.058 1.00 0.00 H ATOM 2872 H ASN B 83 8.885 22.620 -5.357 1.00 0.00 H ATOM 2873 N ILE B 84 12.931 21.768 -4.249 1.00 8.47 N ATOM 2874 CA ILE B 84 13.978 22.433 -3.502 1.00 7.88 C ATOM 2875 C ILE B 84 15.369 22.278 -4.102 1.00 7.91 C ATOM 2876 O ILE B 84 15.767 21.128 -4.331 1.00 6.87 O ATOM 2877 CB ILE B 84 14.011 21.785 -2.043 1.00 8.24 C ATOM 2878 CG1 ILE B 84 12.690 22.122 -1.336 1.00 8.60 C ATOM 2879 CG2 ILE B 84 15.240 22.342 -1.281 1.00 7.92 C ATOM 2880 CD1 ILE B 84 12.478 21.225 -0.068 1.00 9.38 C ATOM 2881 HA ILE B 84 13.746 23.498 -3.506 1.00 0.00 H ATOM 2882 HB ILE B 84 14.108 20.700 -2.085 1.00 0.00 H ATOM 2883 HG12 ILE B 84 12.706 23.169 -1.032 1.00 0.00 H ATOM 2884 HG13 ILE B 84 11.864 21.959 -2.029 1.00 0.00 H ATOM 2885 HD11 ILE B 84 12.455 20.177 -0.366 1.00 0.00 H ATOM 2886 HD12 ILE B 84 13.298 21.388 0.632 1.00 0.00 H ATOM 2887 HD13 ILE B 84 11.534 21.489 0.409 1.00 0.00 H ATOM 2888 HG21 ILE B 84 16.150 22.083 -1.823 1.00 0.00 H ATOM 2889 HG22 ILE B 84 15.157 23.426 -1.204 1.00 0.00 H ATOM 2890 HG23 ILE B 84 15.274 21.907 -0.282 1.00 0.00 H ATOM 2891 H ILE B 84 13.010 20.743 -4.405 1.00 0.00 H ATOM 2892 N ILE B 85 16.038 23.398 -4.320 1.00 7.21 N ATOM 2893 CA ILE B 85 17.418 23.388 -4.833 1.00 6.73 C ATOM 2894 C ILE B 85 18.272 23.614 -3.559 1.00 6.62 C ATOM 2895 O ILE B 85 18.193 24.712 -2.952 1.00 6.47 O ATOM 2896 CB ILE B 85 17.701 24.485 -5.911 1.00 6.59 C ATOM 2897 CG1 ILE B 85 16.760 24.376 -7.116 1.00 7.47 C ATOM 2898 CG2 ILE B 85 19.212 24.436 -6.343 1.00 7.12 C ATOM 2899 CD1 ILE B 85 16.782 22.986 -7.844 1.00 7.97 C ATOM 2900 HA ILE B 85 17.642 22.458 -5.356 1.00 0.00 H ATOM 2901 HB ILE B 85 17.500 25.457 -5.461 1.00 0.00 H ATOM 2902 HG12 ILE B 85 15.743 24.562 -6.771 1.00 0.00 H ATOM 2903 HG13 ILE B 85 17.043 25.142 -7.838 1.00 0.00 H ATOM 2904 HD11 ILE B 85 17.789 22.785 -8.211 1.00 0.00 H ATOM 2905 HD12 ILE B 85 16.487 22.205 -7.143 1.00 0.00 H ATOM 2906 HD13 ILE B 85 16.085 23.005 -8.682 1.00 0.00 H ATOM 2907 HG21 ILE B 85 19.843 24.616 -5.473 1.00 0.00 H ATOM 2908 HG22 ILE B 85 19.438 23.455 -6.761 1.00 0.00 H ATOM 2909 HG23 ILE B 85 19.399 25.204 -7.094 1.00 0.00 H ATOM 2910 H ILE B 85 15.577 24.309 -4.124 1.00 0.00 H ATOM 2911 N GLY B 86 18.966 22.588 -3.122 1.00 6.56 N ATOM 2912 CA GLY B 86 19.758 22.619 -1.899 1.00 5.30 C ATOM 2913 C GLY B 86 21.204 22.944 -2.179 1.00 5.64 C ATOM 2914 O GLY B 86 21.623 23.145 -3.318 1.00 4.35 O ATOM 2915 HA3 GLY B 86 19.702 21.643 -1.417 1.00 0.00 H ATOM 2916 HA2 GLY B 86 19.348 23.377 -1.231 1.00 0.00 H ATOM 2917 H GLY B 86 18.949 21.709 -3.677 1.00 0.00 H ATOM 2918 N ARG B 87 21.980 22.946 -1.086 1.00 5.76 N ATOM 2919 CA ARG B 87 23.402 23.287 -1.177 1.00 6.46 C ATOM 2920 C ARG B 87 24.206 22.460 -2.138 1.00 6.58 C ATOM 2921 O ARG B 87 25.155 23.064 -2.746 1.00 6.80 O ATOM 2922 CB ARG B 87 24.030 23.359 0.238 1.00 6.78 C ATOM 2923 CG ARG B 87 23.339 24.396 1.130 1.00 6.08 C ATOM 2924 CD ARG B 87 24.204 24.558 2.354 1.00 7.55 C ATOM 2925 NE ARG B 87 24.320 23.268 3.048 1.00 7.80 N ATOM 2926 CZ ARG B 87 25.320 22.406 3.060 1.00 8.42 C ATOM 2927 NH1 ARG B 87 26.525 22.578 2.506 1.00 8.23 N ATOM 2928 NH2 ARG B 87 25.108 21.258 3.766 1.00 9.20 N ATOM 2929 HA ARG B 87 23.442 24.279 -1.628 1.00 0.00 H ATOM 2930 HB2 ARG B 87 23.946 22.380 0.709 1.00 0.00 H ATOM 2931 HB3 ARG B 87 25.083 23.625 0.141 1.00 0.00 H ATOM 2932 HG2 ARG B 87 23.251 25.346 0.603 1.00 0.00 H ATOM 2933 HG3 ARG B 87 22.347 24.046 1.414 1.00 0.00 H ATOM 2934 HD2 ARG B 87 23.753 25.291 3.023 1.00 0.00 H ATOM 2935 HD3 ARG B 87 25.195 24.901 2.056 1.00 0.00 H ATOM 2936 HE ARG B 87 23.492 22.993 3.614 1.00 0.00 H ATOM 2937 HH12 ARG B 87 27.242 21.828 2.577 1.00 0.00 H ATOM 2938 HH11 ARG B 87 26.745 23.462 2.004 1.00 0.00 H ATOM 2939 HH22 ARG B 87 25.853 20.534 3.818 1.00 0.00 H ATOM 2940 HH21 ARG B 87 24.201 21.106 4.252 1.00 0.00 H ATOM 2941 H ARG B 87 21.568 22.703 -0.163 1.00 0.00 H ATOM 2942 N ASN B 88 23.895 21.164 -2.334 1.00 6.41 N ATOM 2943 CA ASN B 88 24.722 20.422 -3.315 1.00 7.48 C ATOM 2944 C ASN B 88 24.721 21.106 -4.687 1.00 7.74 C ATOM 2945 O ASN B 88 25.792 21.065 -5.319 1.00 9.05 O ATOM 2946 CB ASN B 88 24.397 18.945 -3.375 1.00 7.45 C ATOM 2947 CG ASN B 88 23.036 18.723 -4.044 1.00 8.38 C ATOM 2948 OD1 ASN B 88 22.085 19.402 -3.649 1.00 8.28 O ATOM 2949 ND2 ASN B 88 23.000 17.838 -5.042 1.00 8.04 N ATOM 2950 HA ASN B 88 25.749 20.461 -2.953 1.00 0.00 H ATOM 2951 HB2 ASN B 88 25.168 18.431 -3.949 1.00 0.00 H ATOM 2952 HB3 ASN B 88 24.370 18.542 -2.363 1.00 0.00 H ATOM 2953 HD22 ASN B 88 23.859 17.312 -5.302 1.00 0.00 H ATOM 2954 HD21 ASN B 88 22.113 17.674 -5.560 1.00 0.00 H ATOM 2955 H ASN B 88 23.113 20.707 -1.822 1.00 0.00 H ATOM 2956 N LEU B 89 23.677 21.702 -5.216 1.00 7.98 N ATOM 2957 CA LEU B 89 23.654 22.357 -6.538 1.00 8.27 C ATOM 2958 C LEU B 89 23.944 23.847 -6.442 1.00 8.75 C ATOM 2959 O LEU B 89 24.561 24.440 -7.347 1.00 9.75 O ATOM 2960 CB LEU B 89 22.311 22.044 -7.237 1.00 7.13 C ATOM 2961 CG LEU B 89 22.043 20.546 -7.474 1.00 7.57 C ATOM 2962 CD1 LEU B 89 20.807 20.403 -8.315 1.00 8.08 C ATOM 2963 CD2 LEU B 89 23.287 19.891 -8.054 1.00 6.75 C ATOM 2964 HA LEU B 89 24.458 21.953 -7.153 1.00 0.00 H ATOM 2965 HB2 LEU B 89 21.506 22.440 -6.618 1.00 0.00 H ATOM 2966 HB3 LEU B 89 22.306 22.547 -8.204 1.00 0.00 H ATOM 2967 HG LEU B 89 21.843 20.017 -6.542 1.00 0.00 H ATOM 2968 HD21 LEU B 89 23.540 20.369 -9.001 1.00 0.00 H ATOM 2969 HD22 LEU B 89 24.116 20.005 -7.355 1.00 0.00 H ATOM 2970 HD23 LEU B 89 23.094 18.831 -8.220 1.00 0.00 H ATOM 2971 HD11 LEU B 89 19.961 20.853 -7.795 1.00 0.00 H ATOM 2972 HD12 LEU B 89 20.958 20.907 -9.269 1.00 0.00 H ATOM 2973 HD13 LEU B 89 20.608 19.346 -8.489 1.00 0.00 H ATOM 2974 H LEU B 89 22.798 21.713 -4.660 1.00 0.00 H ATOM 2975 N LEU B 90 23.520 24.483 -5.368 1.00 9.52 N ATOM 2976 CA LEU B 90 23.764 25.927 -5.164 1.00 9.18 C ATOM 2977 C LEU B 90 25.257 26.222 -5.326 1.00 9.09 C ATOM 2978 O LEU B 90 25.658 27.260 -5.867 1.00 9.03 O ATOM 2979 CB LEU B 90 23.195 26.326 -3.800 1.00 8.98 C ATOM 2980 CG LEU B 90 21.683 26.333 -3.634 1.00 8.88 C ATOM 2981 CD1 LEU B 90 21.312 26.816 -2.243 1.00 8.15 C ATOM 2982 CD2 LEU B 90 21.104 27.250 -4.727 1.00 8.61 C ATOM 2983 HA LEU B 90 23.256 26.533 -5.914 1.00 0.00 H ATOM 2984 HB2 LEU B 90 23.599 25.632 -3.064 1.00 0.00 H ATOM 2985 HB3 LEU B 90 23.550 27.333 -3.582 1.00 0.00 H ATOM 2986 HG LEU B 90 21.271 25.330 -3.741 1.00 0.00 H ATOM 2987 HD21 LEU B 90 21.506 28.256 -4.606 1.00 0.00 H ATOM 2988 HD22 LEU B 90 21.379 26.862 -5.708 1.00 0.00 H ATOM 2989 HD23 LEU B 90 20.018 27.279 -4.638 1.00 0.00 H ATOM 2990 HD11 LEU B 90 21.751 26.150 -1.500 1.00 0.00 H ATOM 2991 HD12 LEU B 90 21.693 27.827 -2.097 1.00 0.00 H ATOM 2992 HD13 LEU B 90 20.227 26.816 -2.137 1.00 0.00 H ATOM 2993 H LEU B 90 22.998 23.953 -4.642 1.00 0.00 H ATOM 2994 N THR B 91 26.079 25.340 -4.789 1.00 9.68 N ATOM 2995 CA THR B 91 27.531 25.506 -4.840 1.00 9.93 C ATOM 2996 C THR B 91 28.034 25.336 -6.273 1.00 11.04 C ATOM 2997 O THR B 91 29.043 25.962 -6.578 1.00 10.81 O ATOM 2998 CB THR B 91 28.371 24.527 -3.917 1.00 10.30 C ATOM 2999 OG1 THR B 91 28.064 23.191 -4.342 1.00 9.98 O ATOM 3000 CG2 THR B 91 28.160 24.790 -2.409 1.00 10.13 C ATOM 3001 HA THR B 91 27.692 26.513 -4.456 1.00 0.00 H ATOM 3002 HB THR B 91 29.440 24.701 -4.036 1.00 0.00 H ATOM 3003 HG1 THR B 91 28.570 22.545 -3.788 1.00 0.00 H ATOM 3004 HG23 THR B 91 28.417 25.825 -2.182 1.00 0.00 H ATOM 3005 HG21 THR B 91 27.116 24.609 -2.153 1.00 0.00 H ATOM 3006 HG22 THR B 91 28.798 24.121 -1.832 1.00 0.00 H ATOM 3007 H THR B 91 25.683 24.503 -4.316 1.00 0.00 H ATOM 3008 N GLN B 92 27.334 24.465 -7.020 1.00 11.21 N ATOM 3009 CA GLN B 92 27.763 24.271 -8.409 1.00 12.06 C ATOM 3010 C GLN B 92 27.452 25.550 -9.199 1.00 12.62 C ATOM 3011 O GLN B 92 28.193 25.802 -10.152 1.00 13.49 O ATOM 3012 CB GLN B 92 27.167 23.041 -9.074 1.00 11.68 C ATOM 3013 CG GLN B 92 27.490 21.723 -8.433 1.00 11.80 C ATOM 3014 CD GLN B 92 27.141 20.599 -9.415 1.00 12.92 C ATOM 3015 OE1 GLN B 92 26.896 20.895 -10.591 1.00 13.00 O ATOM 3016 NE2 GLN B 92 27.160 19.368 -8.936 1.00 12.79 N ATOM 3017 HA GLN B 92 28.836 24.082 -8.403 1.00 0.00 H ATOM 3018 HB2 GLN B 92 26.083 23.155 -9.075 1.00 0.00 H ATOM 3019 HB3 GLN B 92 27.529 23.009 -10.102 1.00 0.00 H ATOM 3020 HG2 GLN B 92 28.552 21.683 -8.192 1.00 0.00 H ATOM 3021 HG3 GLN B 92 26.907 21.606 -7.520 1.00 0.00 H ATOM 3022 HE22 GLN B 92 27.376 19.204 -7.932 1.00 0.00 H ATOM 3023 HE21 GLN B 92 26.959 18.563 -9.563 1.00 0.00 H ATOM 3024 H GLN B 92 26.520 23.949 -6.628 1.00 0.00 H ATOM 3025 N ILE B 93 26.442 26.331 -8.842 1.00 12.72 N ATOM 3026 CA ILE B 93 26.139 27.549 -9.611 1.00 12.88 C ATOM 3027 C ILE B 93 26.776 28.779 -8.995 1.00 13.09 C ATOM 3028 O ILE B 93 26.523 29.934 -9.401 1.00 14.37 O ATOM 3029 CB ILE B 93 24.614 27.725 -9.910 1.00 12.30 C ATOM 3030 CG1 ILE B 93 23.886 27.922 -8.565 1.00 11.95 C ATOM 3031 CG2 ILE B 93 23.977 26.605 -10.776 1.00 12.04 C ATOM 3032 CD1 ILE B 93 22.377 28.302 -8.827 1.00 13.17 C ATOM 3033 HA ILE B 93 26.602 27.421 -10.589 1.00 0.00 H ATOM 3034 HB ILE B 93 24.498 28.606 -10.541 1.00 0.00 H ATOM 3035 HG12 ILE B 93 23.932 26.998 -7.989 1.00 0.00 H ATOM 3036 HG13 ILE B 93 24.369 28.722 -8.005 1.00 0.00 H ATOM 3037 HD11 ILE B 93 22.331 29.227 -9.402 1.00 0.00 H ATOM 3038 HD12 ILE B 93 21.894 27.501 -9.386 1.00 0.00 H ATOM 3039 HD13 ILE B 93 21.868 28.440 -7.873 1.00 0.00 H ATOM 3040 HG21 ILE B 93 24.481 26.563 -11.742 1.00 0.00 H ATOM 3041 HG22 ILE B 93 24.086 25.647 -10.267 1.00 0.00 H ATOM 3042 HG23 ILE B 93 22.919 26.820 -10.925 1.00 0.00 H ATOM 3043 H ILE B 93 25.862 26.082 -8.016 1.00 0.00 H ATOM 3044 N GLY B 94 27.645 28.597 -8.055 1.00 13.17 N ATOM 3045 CA GLY B 94 28.380 29.668 -7.407 1.00 13.00 C ATOM 3046 C GLY B 94 27.505 30.590 -6.593 1.00 13.20 C ATOM 3047 O GLY B 94 27.816 31.804 -6.491 1.00 13.71 O ATOM 3048 HA3 GLY B 94 28.882 30.257 -8.175 1.00 0.00 H ATOM 3049 HA2 GLY B 94 29.125 29.225 -6.746 1.00 0.00 H ATOM 3050 H GLY B 94 27.829 27.622 -7.744 1.00 0.00 H ATOM 3051 N CYS B 95 26.475 30.056 -5.989 1.00 13.11 N ATOM 3052 CA CYS B 95 25.592 30.907 -5.147 1.00 13.35 C ATOM 3053 C CYS B 95 26.159 31.103 -3.762 1.00 13.60 C ATOM 3054 O CYS B 95 26.701 30.166 -3.094 1.00 13.19 O ATOM 3055 CB CYS B 95 24.226 30.264 -5.191 1.00 14.38 C ATOM 3056 SG CYS B 95 22.971 31.153 -4.313 1.00 17.55 S ATOM 3057 HA CYS B 95 25.516 31.926 -5.526 1.00 0.00 H ATOM 3058 HB2 CYS B 95 24.304 29.267 -4.758 1.00 0.00 H ATOM 3059 HB3 CYS B 95 23.920 30.183 -6.234 1.00 0.00 H ATOM 3060 HG CYS B 95 21.772 30.479 -4.420 1.00 0.00 H ATOM 3061 H CYS B 95 26.274 29.041 -6.097 1.00 0.00 H ATOM 3062 N THR B 96 26.084 32.365 -3.300 1.00 13.00 N ATOM 3063 CA THR B 96 26.550 32.694 -1.944 1.00 13.37 C ATOM 3064 C THR B 96 25.461 33.570 -1.312 1.00 13.61 C ATOM 3065 O THR B 96 24.599 34.057 -2.064 1.00 13.58 O ATOM 3066 CB THR B 96 27.950 33.422 -1.875 1.00 13.24 C ATOM 3067 OG1 THR B 96 27.685 34.705 -2.561 1.00 12.96 O ATOM 3068 CG2 THR B 96 29.087 32.656 -2.545 1.00 13.15 C ATOM 3069 HA THR B 96 26.712 31.760 -1.406 1.00 0.00 H ATOM 3070 HB THR B 96 28.298 33.525 -0.847 1.00 0.00 H ATOM 3071 HG1 THR B 96 27.392 34.527 -3.490 1.00 0.00 H ATOM 3072 HG23 THR B 96 29.254 31.719 -2.014 1.00 0.00 H ATOM 3073 HG21 THR B 96 28.821 32.446 -3.581 1.00 0.00 H ATOM 3074 HG22 THR B 96 29.995 33.258 -2.516 1.00 0.00 H ATOM 3075 H THR B 96 25.693 33.114 -3.907 1.00 0.00 H ATOM 3076 N LEU B 97 25.539 33.717 -0.024 1.00 13.74 N ATOM 3077 CA LEU B 97 24.662 34.567 0.784 1.00 14.52 C ATOM 3078 C LEU B 97 25.481 35.835 1.123 1.00 14.90 C ATOM 3079 O LEU B 97 26.650 35.685 1.519 1.00 14.08 O ATOM 3080 CB LEU B 97 24.261 33.790 2.049 1.00 15.30 C ATOM 3081 CG LEU B 97 22.988 32.988 2.087 1.00 15.37 C ATOM 3082 CD1 LEU B 97 22.904 32.310 3.454 1.00 15.29 C ATOM 3083 CD2 LEU B 97 21.783 33.873 1.770 1.00 15.33 C ATOM 3084 HA LEU B 97 23.745 34.848 0.266 1.00 0.00 H ATOM 3085 HB2 LEU B 97 25.074 33.095 2.258 1.00 0.00 H ATOM 3086 HB3 LEU B 97 24.193 34.521 2.855 1.00 0.00 H ATOM 3087 HG LEU B 97 22.985 32.214 1.320 1.00 0.00 H ATOM 3088 HD21 LEU B 97 21.718 34.674 2.507 1.00 0.00 H ATOM 3089 HD22 LEU B 97 21.901 34.302 0.775 1.00 0.00 H ATOM 3090 HD23 LEU B 97 20.874 33.272 1.803 1.00 0.00 H ATOM 3091 HD11 LEU B 97 23.767 31.658 3.588 1.00 0.00 H ATOM 3092 HD12 LEU B 97 22.896 33.070 4.235 1.00 0.00 H ATOM 3093 HD13 LEU B 97 21.989 31.720 3.510 1.00 0.00 H ATOM 3094 H LEU B 97 26.284 33.189 0.473 1.00 0.00 H ATOM 3095 N ASN B 98 24.841 36.992 0.959 1.00 15.90 N ATOM 3096 CA ASN B 98 25.531 38.259 1.252 1.00 17.09 C ATOM 3097 C ASN B 98 24.735 39.190 2.159 1.00 18.16 C ATOM 3098 O ASN B 98 23.528 39.373 1.926 1.00 18.56 O ATOM 3099 CB ASN B 98 25.852 38.984 -0.090 1.00 16.82 C ATOM 3100 CG ASN B 98 26.726 38.077 -0.935 1.00 18.08 C ATOM 3101 OD1 ASN B 98 27.985 38.083 -0.868 1.00 18.66 O ATOM 3102 ND2 ASN B 98 26.050 37.254 -1.724 1.00 17.50 N ATOM 3103 HA ASN B 98 26.444 38.009 1.793 1.00 0.00 H ATOM 3104 HB2 ASN B 98 24.925 39.200 -0.621 1.00 0.00 H ATOM 3105 HB3 ASN B 98 26.379 39.916 0.113 1.00 0.00 H ATOM 3106 HD22 ASN B 98 25.011 37.288 -1.743 1.00 0.00 H ATOM 3107 HD21 ASN B 98 26.559 36.574 -2.324 1.00 0.00 H ATOM 3108 H ASN B 98 23.856 37.000 0.625 1.00 0.00 H ATOM 3109 N PHE B 99 25.406 39.785 3.117 1.00 19.11 N ATOM 3110 CA PHE B 99 24.750 40.791 3.988 1.00 20.63 C ATOM 3111 C PHE B 99 25.900 41.682 4.512 1.00 21.65 C ATOM 3112 O PHE B 99 25.618 42.725 5.110 1.00 22.18 O ATOM 3113 CB PHE B 99 23.856 40.280 5.061 1.00 20.51 C ATOM 3114 CG PHE B 99 24.451 39.367 6.080 1.00 21.27 C ATOM 3115 CD1 PHE B 99 24.502 37.996 5.863 1.00 21.09 C ATOM 3116 CD2 PHE B 99 24.935 39.900 7.282 1.00 21.72 C ATOM 3117 CE1 PHE B 99 25.026 37.155 6.822 1.00 21.14 C ATOM 3118 CE2 PHE B 99 25.475 39.064 8.266 1.00 21.73 C ATOM 3119 CZ PHE B 99 25.529 37.689 8.028 1.00 21.57 C ATOM 3120 HA PHE B 99 24.021 41.346 3.398 1.00 0.00 H ATOM 3121 OXT PHE B 99 27.034 41.237 4.277 1.00 22.96 O ATOM 3122 HB2 PHE B 99 23.456 41.144 5.591 1.00 0.00 H ATOM 3123 HB3 PHE B 99 23.040 39.742 4.578 1.00 0.00 H ATOM 3124 HD2 PHE B 99 24.891 40.976 7.452 1.00 0.00 H ATOM 3125 HE2 PHE B 99 25.847 39.479 9.203 1.00 0.00 H ATOM 3126 HZ PHE B 99 25.961 37.025 8.777 1.00 0.00 H ATOM 3127 HE1 PHE B 99 25.052 36.079 6.649 1.00 0.00 H ATOM 3128 HD1 PHE B 99 24.125 37.582 4.928 1.00 0.00 H ATOM 3129 H PHE B 99 26.408 39.549 3.267 1.00 0.00 H TER 3130 PHE B 99 HETATM 3131 O HOH 1 9.689 28.979 1.629 1.00 18.81 O HETATM 3132 O HOH 2 14.169 45.054 11.918 1.00 13.59 O HETATM 3133 O HOH 3 16.568 40.340 1.338 1.00 8.53 O HETATM 3134 O HOH 4 16.816 42.664 2.237 1.00 9.52 O HETATM 3135 O HOH 5 13.156 22.293 21.530 1.00 36.27 O HETATM 3136 O HOH 6 1.869 36.290 19.253 1.00 27.32 O HETATM 3137 O HOH 7 6.654 40.876 14.994 1.00 22.29 O HETATM 3138 O HOH 8 7.452 12.574 9.000 1.00 41.64 O HETATM 3139 O HOH 9 4.503 24.160 21.087 1.00 36.22 O HETATM 3140 O HOH 10 8.234 39.109 11.297 1.00 5.15 O HETATM 3141 O HOH 11 1.531 16.828 9.651 1.00 31.66 O HETATM 3142 O HOH 12 8.942 33.772 12.399 1.00 15.92 O HETATM 3143 O HOH 13 33.305 37.455 3.388 1.00 44.95 O HETATM 3144 O HOH 14 6.755 25.844 22.115 1.00 47.37 O HETATM 3145 O HOH 15 31.081 27.179 2.898 1.00 24.66 O HETATM 3146 O HOH 16 34.410 26.924 3.483 1.00 21.39 O HETATM 3147 O HOH 17 19.891 40.268 22.044 1.00 56.99 O HETATM 3148 O HOH 18 3.942 26.286 7.335 1.00 21.95 O HETATM 3149 O HOH 19 29.839 20.197 0.307 1.00 35.10 O HETATM 3150 O HOH 20 20.043 46.326 7.113 1.00 44.95 O HETATM 3151 O HOH 21 2.004 25.797 20.960 1.00 34.07 O HETATM 3152 O HOH 22 27.192 31.925 -11.518 1.00 60.51 O HETATM 3153 O HOH 23 16.641 26.982 21.669 1.00 58.41 O HETATM 3154 O HOH 24 8.340 35.899 5.488 1.00 29.04 O HETATM 3155 O HOH 25 8.046 22.709 26.879 1.00 40.46 O HETATM 3156 O HOH 26 12.788 41.153 22.629 1.00 35.79 O HETATM 3157 O HOH 27 20.283 16.963 10.382 1.00 40.44 O HETATM 3158 O HOH 28 6.320 35.100 28.039 1.00 72.04 O HETATM 3159 O HOH 29 28.933 29.327 8.102 1.00 37.16 O HETATM 3160 O HOH 30 11.366 30.707 1.519 1.00 14.68 O HETATM 3161 O HOH 31 7.254 16.233 3.543 1.00 32.61 O HETATM 3162 O HOH 32 27.920 34.761 -5.537 1.00 20.15 O HETATM 3163 O HOH 33 33.786 34.295 -1.426 1.00 52.87 O HETATM 3164 O HOH 34 3.947 37.972 21.413 1.00 37.52 O HETATM 3165 O HOH 35 4.159 34.139 11.811 1.00 43.95 O HETATM 3166 O HOH 36 35.170 28.893 4.833 1.00 31.32 O HETATM 3167 O HOH 37 32.453 34.848 6.181 1.00 54.82 O HETATM 3168 O HOH 38 29.204 36.802 -4.915 1.00 52.35 O HETATM 3169 O HOH 39 28.654 27.979 4.308 1.00 55.53 O HETATM 3170 O HOH 40 5.584 35.853 11.164 1.00 65.35 O HETATM 3171 O HOH 41 36.377 23.197 10.155 1.00 43.59 O HETATM 3172 O HOH 42 10.410 40.186 5.619 1.00 23.22 O HETATM 3173 O HOH 43 9.916 37.892 4.602 1.00 43.26 O HETATM 3174 O HOH 44 11.639 43.355 22.357 1.00 49.10 O HETATM 3175 O HOH 45 7.235 35.402 9.638 1.00 59.07 O HETATM 3176 O HOH 46 4.449 29.374 5.903 1.00 47.22 O HETATM 3177 O HOH 47 27.664 21.428 6.868 1.00 34.93 O HETATM 3178 O HOH 48 11.621 21.204 6.574 1.00 10.91 O HETATM 3179 O HOH 49 20.765 22.297 6.536 1.00 25.53 O HETATM 3180 O HOH 50 17.620 17.078 -17.310 1.00 23.79 O HETATM 3181 O HOH 51 28.589 28.746 -2.649 1.00 25.17 O HETATM 3182 O HOH 52 20.646 15.968 -3.513 1.00 12.82 O HETATM 3183 O HOH 53 16.095 45.228 0.134 1.00 17.91 O HETATM 3184 O HOH 54 25.268 19.345 0.544 1.00 28.92 O HETATM 3185 O HOH 55 20.341 13.618 -16.636 1.00 30.89 O HETATM 3186 O HOH 56 22.157 23.844 4.573 1.00 14.76 O HETATM 3187 O HOH 57 11.852 39.386 -2.869 1.00 24.48 O HETATM 3188 O HOH 58 25.579 12.997 -8.808 1.00 21.24 O HETATM 3189 O HOH 59 6.622 23.082 -10.859 1.00 24.70 O HETATM 3190 O HOH 60 10.747 32.641 -12.305 1.00 49.97 O HETATM 3191 O HOH 61 25.606 12.366 -16.604 1.00 33.89 O HETATM 3192 O HOH 62 19.493 21.784 -19.760 1.00 53.39 O HETATM 3193 O HOH 63 9.310 8.695 -3.846 1.00 54.12 O HETATM 3194 O HOH 64 12.953 36.193 -3.682 1.00 28.11 O HETATM 3195 O HOH 65 16.600 27.286 -16.361 1.00 30.18 O HETATM 3196 O HOH 66 6.745 16.862 -10.881 1.00 59.70 O HETATM 3197 O HOH 67 22.832 15.769 -1.939 1.00 35.16 O HETATM 3198 O HOH 68 27.609 21.517 -0.939 1.00 41.43 O HETATM 3199 O HOH 69 12.119 35.812 -6.183 1.00 60.05 O HETATM 3200 O HOH 70 22.845 12.727 -1.199 1.00 51.76 O HETATM 3201 O HOH 71 28.855 20.756 -3.228 1.00 30.20 O HETATM 3202 O HOH 72 14.775 12.997 -17.777 1.00 51.32 O HETATM 3203 O HOH 73 25.573 16.553 -6.078 1.00 13.59 O HETATM 3204 O HOH 74 5.395 14.998 3.522 1.00 56.92 O HETATM 3205 O HOH 75 7.524 8.335 0.718 1.00 73.70 O HETATM 3206 O HOH 76 9.359 17.380 -10.014 1.00 25.55 O HETATM 3207 O HOH 77 8.646 34.239 -5.022 1.00 51.49 O HETATM 3208 O HOH 78 14.277 15.829 11.514 1.00 27.65 O HETATM 3209 O HOH 79 23.445 14.296 2.416 1.00 62.91 O HETATM 3210 O HOH 80 21.879 6.586 0.030 1.00 54.11 O HETATM 3211 O HOH 81 28.417 15.615 -11.637 1.00 14.75 O HETATM 3212 O HOH 82 21.645 6.686 -7.664 1.00 33.41 O HETATM 3213 O HOH 83 18.494 16.399 8.731 1.00 28.32 O HETATM 3214 O HOH 84 18.430 14.633 6.791 1.00 37.46 O HETATM 3215 O HOH 85 16.878 16.110 11.569 1.00 35.49 O HETATM 3216 O HOH 86 27.768 18.743 -6.204 1.00 28.66 O HETATM 3217 O HOH 87 16.231 19.235 -20.382 1.00 45.36 O HETATM 3218 O HOH 88 9.745 11.060 11.404 1.00 54.93 O HETATM 3219 O HOH 89 4.850 14.699 11.368 1.00 51.91 O HETATM 3220 O HOH 90 3.801 9.236 -0.848 1.00 68.91 O HETATM 3221 O HOH 91 8.406 8.288 4.108 1.00 48.29 O HETATM 3222 O HOH 92 17.719 19.551 -18.406 1.00 52.30 O HETATM 3223 O HOH 93 20.022 8.441 -13.583 1.00 33.58 O HETATM 3224 O HOH 94 20.723 7.243 -10.997 1.00 30.84 O HETATM 3225 O HOH 95 23.294 41.797 0.343 1.00 33.18 O HETATM 3226 O HOH 96 18.750 43.513 -5.098 1.00 46.70 O HETATM 3227 O HOH 97 23.786 45.070 5.964 1.00 46.59 O HETATM 3228 O HOH 98 6.500 34.342 -1.197 1.00 30.46 O HETATM 3229 O HOH 99 10.516 40.850 -4.357 1.00 61.36 O HETATM 3230 O HOH 100 14.911 35.031 -10.395 1.00 70.25 O HETATM 3231 O HOH 101 5.796 28.523 -3.622 1.00 49.08 O HETATM 3232 O HOH 102 26.160 11.642 -3.854 1.00 68.06 O HETATM 3233 O HOH 103 24.874 16.798 -1.009 1.00 65.12 O HETATM 3234 O HOH 104 20.395 14.702 3.767 1.00 54.68 O HETATM 3235 C1 VAC A 105 14.274 23.880 4.704 1.00 0.06 C HETATM 3236 O2 VAC A 105 14.674 25.182 4.407 1.00 -0.39 O HETATM 3237 H38 VAC A 105 14.783 25.272 3.468 1.00 0.21 H HETATM 3238 C4 VAC A 105 14.095 23.733 6.242 1.00 -0.01 C HETATM 3239 C6 VAC A 105 15.277 22.909 6.715 1.00 0.06 C HETATM 3240 C13 VAC A 105 15.245 21.460 6.226 1.00 0.18 C HETATM 3241 N19 VAC A 105 16.380 20.981 5.772 1.00 -0.27 N HETATM 3242 C20 VAC A 105 16.607 19.613 5.396 1.00 0.10 C HETATM 3243 C23 VAC A 105 16.496 19.191 3.979 1.00 -0.01 C HETATM 3244 C25 VAC A 105 17.370 18.174 3.719 1.00 -0.04 C HETATM 3245 C26 VAC A 105 18.192 17.858 4.929 1.00 0.01 C HETATM 3246 C21 VAC A 105 18.026 19.169 5.769 1.00 0.10 C HETATM 3247 O22 VAC A 105 19.083 20.053 5.460 1.00 -0.39 O HETATM 3248 H39 VAC A 105 19.907 19.669 5.737 1.00 0.21 H HETATM 3249 H11 VAC A 105 18.068 18.954 6.847 1.00 0.07 H HETATM 3250 H12 VAC A 105 17.797 16.983 5.466 1.00 0.04 H HETATM 3251 H13 VAC A 105 19.245 17.681 4.665 1.00 0.04 H HETATM 3252 C37 VAC A 105 17.502 17.551 2.461 1.00 -0.07 C HETATM 3253 C38 VAC A 105 16.636 18.018 1.485 1.00 -0.08 C HETATM 3254 C39 VAC A 105 15.756 19.084 1.736 1.00 -0.08 C HETATM 3255 C40 VAC A 105 15.646 19.678 2.986 1.00 -0.06 C HETATM 3256 H19 VAC A 105 14.939 20.476 3.180 1.00 0.05 H HETATM 3257 H18 VAC A 105 15.141 19.456 0.925 1.00 0.05 H HETATM 3258 H17 VAC A 105 16.638 17.551 0.507 1.00 0.05 H HETATM 3259 H16 VAC A 105 18.226 16.767 2.272 1.00 0.05 H HETATM 3260 H10 VAC A 105 15.879 19.021 5.971 1.00 0.07 H HETATM 3261 H41 VAC A 105 17.146 21.618 5.681 1.00 0.19 H HETATM 3262 O15 VAC A 105 14.169 20.874 6.271 1.00 -0.40 O HETATM 3263 C12 VAC A 105 15.259 22.843 8.238 1.00 0.00 C HETATM 3264 C16 VAC A 105 16.355 21.948 8.759 1.00 -0.04 C HETATM 3265 C59 VAC A 105 15.995 20.773 9.424 1.00 -0.06 C HETATM 3266 C58 VAC A 105 16.961 19.895 9.922 1.00 -0.07 C HETATM 3267 C57 VAC A 105 18.321 20.239 9.712 1.00 -0.07 C HETATM 3268 C56 VAC A 105 18.694 21.389 9.015 1.00 -0.07 C HETATM 3269 C55 VAC A 105 17.691 22.253 8.528 1.00 -0.06 C HETATM 3270 H25 VAC A 105 17.960 23.148 7.978 1.00 0.06 H HETATM 3271 H26 VAC A 105 19.741 21.615 8.850 1.00 0.06 H HETATM 3272 H27 VAC A 105 19.094 19.589 10.105 1.00 0.06 H HETATM 3273 H28 VAC A 105 16.683 18.988 10.447 1.00 0.06 H HETATM 3274 H29 VAC A 105 14.945 20.538 9.556 1.00 0.06 H HETATM 3275 H8 VAC A 105 14.287 22.449 8.568 1.00 0.05 H HETATM 3276 H9 VAC A 105 15.401 23.856 8.643 1.00 0.05 H HETATM 3277 H6 VAC A 105 16.203 23.389 6.367 1.00 0.06 H HETATM 3278 H4 VAC A 105 13.151 23.216 6.471 1.00 0.03 H HETATM 3279 H5 VAC A 105 14.099 24.721 6.725 1.00 0.03 H HETATM 3280 C3 VAC A 105 13.063 23.367 3.988 1.00 -0.01 C HETATM 3281 C9 VAC A 105 11.911 24.223 3.680 1.00 0.06 C HETATM 3282 C31 VAC A 105 11.092 23.537 2.555 1.00 0.00 C HETATM 3283 C33 VAC A 105 9.722 24.141 2.352 1.00 -0.04 C HETATM 3284 C49 VAC A 105 9.551 25.339 1.685 1.00 -0.06 C HETATM 3285 C48 VAC A 105 8.337 25.983 1.505 1.00 -0.07 C HETATM 3286 C47 VAC A 105 7.177 25.341 1.976 1.00 -0.07 C HETATM 3287 C46 VAC A 105 7.322 24.107 2.646 1.00 -0.07 C HETATM 3288 C45 VAC A 105 8.579 23.526 2.833 1.00 -0.06 C HETATM 3289 H20 VAC A 105 8.660 22.583 3.361 1.00 0.06 H HETATM 3290 H21 VAC A 105 6.441 23.600 3.023 1.00 0.06 H HETATM 3291 H22 VAC A 105 6.198 25.782 1.828 1.00 0.06 H HETATM 3292 H23 VAC A 105 8.283 26.950 1.017 1.00 0.06 H HETATM 3293 H24 VAC A 105 10.434 25.811 1.271 1.00 0.06 H HETATM 3294 H14 VAC A 105 10.969 22.475 2.812 1.00 0.05 H HETATM 3295 H15 VAC A 105 11.654 23.624 1.613 1.00 0.05 H HETATM 3296 C30 VAC A 105 10.956 24.350 4.880 1.00 0.18 C HETATM 3297 N86 VAC A 105 10.356 25.497 5.042 1.00 -0.27 N HETATM 3298 C71 VAC A 105 9.308 25.701 6.044 1.00 0.10 C HETATM 3299 C73 VAC A 105 9.646 26.425 7.317 1.00 -0.01 C HETATM 3300 C76 VAC A 105 8.584 27.189 7.729 1.00 -0.04 C HETATM 3301 C68 VAC A 105 7.416 27.059 6.790 1.00 0.01 C HETATM 3302 C69 VAC A 105 8.174 26.617 5.502 1.00 0.10 C HETATM 3303 O70 VAC A 105 8.747 27.730 4.794 1.00 -0.39 O HETATM 3304 H40 VAC A 105 8.051 28.287 4.465 1.00 0.21 H HETATM 3305 H32 VAC A 105 7.503 26.063 4.829 1.00 0.07 H HETATM 3306 H30 VAC A 105 6.700 26.295 7.128 1.00 0.04 H HETATM 3307 H31 VAC A 105 6.892 28.016 6.651 1.00 0.04 H HETATM 3308 C80 VAC A 105 8.656 27.953 8.901 1.00 -0.07 C HETATM 3309 C79 VAC A 105 9.867 27.863 9.595 1.00 -0.08 C HETATM 3310 C78 VAC A 105 10.963 27.120 9.151 1.00 -0.08 C HETATM 3311 C77 VAC A 105 10.863 26.355 7.997 1.00 -0.06 C HETATM 3312 H34 VAC A 105 11.682 25.739 7.644 1.00 0.05 H HETATM 3313 H35 VAC A 105 11.893 27.141 9.708 1.00 0.05 H HETATM 3314 H36 VAC A 105 9.960 28.401 10.531 1.00 0.05 H HETATM 3315 H37 VAC A 105 7.833 28.569 9.245 1.00 0.05 H HETATM 3316 H33 VAC A 105 8.912 24.706 6.295 1.00 0.07 H HETATM 3317 H42 VAC A 105 10.622 26.266 4.460 1.00 0.19 H HETATM 3318 O36 VAC A 105 10.772 23.347 5.625 1.00 -0.40 O HETATM 3319 H7 VAC A 105 12.259 25.218 3.364 1.00 0.06 H HETATM 3320 H2 VAC A 105 12.674 22.539 4.598 1.00 0.03 H HETATM 3321 H3 VAC A 105 13.420 22.976 3.024 1.00 0.03 H HETATM 3322 H1 VAC A 105 15.106 23.226 4.403 1.00 0.06 H CONECT 3235 3236 3238 3280 3322 CONECT 3236 3235 3237 CONECT 3237 3236 CONECT 3238 3235 3239 3278 3279 CONECT 3239 3238 3240 3263 3277 CONECT 3240 3239 3241 3262 CONECT 3241 3240 3242 3261 CONECT 3242 3241 3243 3246 3260 CONECT 3243 3242 3244 3255 CONECT 3244 3243 3245 3252 CONECT 3245 3244 3246 3250 3251 CONECT 3246 3242 3245 3247 3249 CONECT 3247 3246 3248 CONECT 3248 3247 CONECT 3249 3246 CONECT 3250 3245 CONECT 3251 3245 CONECT 3252 3244 3253 3259 CONECT 3253 3252 3254 3258 CONECT 3254 3253 3255 3257 CONECT 3255 3243 3254 3256 CONECT 3256 3255 CONECT 3257 3254 CONECT 3258 3253 CONECT 3259 3252 CONECT 3260 3242 CONECT 3261 3241 CONECT 3262 3240 CONECT 3263 3239 3264 3275 3276 CONECT 3264 3263 3265 3269 CONECT 3265 3264 3266 3274 CONECT 3266 3265 3267 3273 CONECT 3267 3266 3268 3272 CONECT 3268 3267 3269 3271 CONECT 3269 3264 3268 3270 CONECT 3270 3269 CONECT 3271 3268 CONECT 3272 3267 CONECT 3273 3266 CONECT 3274 3265 CONECT 3275 3263 CONECT 3276 3263 CONECT 3277 3239 CONECT 3278 3238 CONECT 3279 3238 CONECT 3280 3235 3281 3320 3321 CONECT 3281 3280 3282 3296 3319 CONECT 3282 3281 3283 3294 3295 CONECT 3283 3282 3284 3288 CONECT 3284 3283 3285 3293 CONECT 3285 3284 3286 3292 CONECT 3286 3285 3287 3291 CONECT 3287 3286 3288 3290 CONECT 3288 3283 3287 3289 CONECT 3289 3288 CONECT 3290 3287 CONECT 3291 3286 CONECT 3292 3285 CONECT 3293 3284 CONECT 3294 3282 CONECT 3295 3282 CONECT 3296 3281 3297 3318 CONECT 3297 3296 3298 3317 CONECT 3298 3297 3299 3302 3316 CONECT 3299 3298 3300 3311 CONECT 3300 3299 3301 3308 CONECT 3301 3300 3302 3306 3307 CONECT 3302 3298 3301 3303 3305 CONECT 3303 3302 3304 CONECT 3304 3303 CONECT 3305 3302 CONECT 3306 3301 CONECT 3307 3301 CONECT 3308 3300 3309 3315 CONECT 3309 3308 3310 3314 CONECT 3310 3309 3311 3313 CONECT 3311 3299 3310 3312 CONECT 3312 3311 CONECT 3313 3310 CONECT 3314 3309 CONECT 3315 3308 CONECT 3316 3298 CONECT 3317 3297 CONECT 3318 3296 CONECT 3319 3281 CONECT 3320 3280 CONECT 3321 3280 CONECT 3322 3235 MASTER 0 0 0 0 0 0 0 0 3320 2 88 16 END
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PDBbind
99aa, >1EBY_1|Chains... at 90%
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PDBbind
99aa, >1HXW_1|Chains... at 90%
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99aa, >1IZH_1|Chains... at 90%
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99aa, >1K6C_1|Chains... at 91%
1k6p
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99aa, >1K6P_1|Chains... at 91%
1k6t
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PDBbind
99aa, >1K6T_1|Chains... at 91%
1k6v
RCSB PDB
PDBbind
99aa, >1K6V_1|Chains... at 91%
1pro
RCSB PDB
PDBbind
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RCSB PDB
PDBbind
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RCSB PDB
PDBbind
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RCSB PDB
PDBbind
99aa, >1VIJ_1|Chains... at 90%
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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
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RCSB PDB
PDBbind
99aa, >2AZ9_1|Chain... at 90%
2i4d
RCSB PDB
PDBbind
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RCSB PDB
PDBbind
99aa, >2I4U_1|Chains... at 90%
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RCSB PDB
PDBbind
99aa, >2I4W_1|Chains... at 90%
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RCSB PDB
PDBbind
99aa, >2O4K_1|Chains... at 90%
2o4p
RCSB PDB
PDBbind
99aa, >2O4P_1|Chains... at 90%
2o4s
RCSB PDB
PDBbind
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2p3b
RCSB PDB
PDBbind
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3ekp
RCSB PDB
PDBbind
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3ekq
RCSB PDB
PDBbind
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3ekt
RCSB PDB
PDBbind
99aa, >3EKT_1|Chains... at 90%
3ekw
RCSB PDB
PDBbind
99aa, >3EKW_1|Chains... at 90%
3el0
RCSB PDB
PDBbind
99aa, >3EL0_1|Chains... at 90%
3el4
RCSB PDB
PDBbind
99aa, >3EL4_1|Chains... at 92%
3el5
RCSB PDB
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3kfn
RCSB PDB
PDBbind
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3m9f
RCSB PDB
PDBbind
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3tlh
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PDBbind
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4eqj
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PDBbind
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5hvp
RCSB PDB
PDBbind
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5ivs
RCSB PDB
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6dgx
RCSB PDB
PDBbind
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6dgy
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PDBbind
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6dgz
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PDBbind
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6dh1
RCSB PDB
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99aa, >6DH1_1|Chains... at 90%
6dh2
RCSB PDB
PDBbind
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6dh3
RCSB PDB
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6dh4
RCSB PDB
PDBbind
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RCSB PDB
PDBbind
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PDBbind
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6dh8
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9hvp
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RCSB PDB
PDBbind
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6oy0
RCSB PDB
PDBbind
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6oxz
RCSB PDB
PDBbind
99aa, >6OXZ_1|Chains... at 91%
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RCSB PDB
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6oxx
RCSB PDB
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RCSB PDB
PDBbind
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RCSB PDB
PDBbind
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6oxu
RCSB PDB
PDBbind
99aa, >6OXU_1|Chains... at 91%
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RCSB PDB
PDBbind
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RCSB PDB
PDBbind
99aa, >6OXS_1|Chains... at 91%
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RCSB PDB
PDBbind
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RCSB PDB
PDBbind
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RCSB PDB
PDBbind
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RCSB PDB
PDBbind
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
4phv
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
hiv-1 protease
Ligand Name
VAC
EC.Number
E.C.3.4.23.16
Resolution
2.1(Å)
Affinity (Kd/Ki/IC50)
IC50=0.67nM
Release Year
1993
Protein/NA Sequence
Check fasta file
Primary Reference
J.Am.Chem.Soc.v113;pp.9382
Ligand Properties
Formula
C
3
9
H
4
2
N
2
O
5
Molecular Weight
618.761
Exact Mass
618.309
No. of atoms
88
No. of bonds
93
Polar Surface Area
118.89
LOGP Value
4.69 (
Computed with XLOGP3
)
5.18 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 5
No. of Hydrogen Bond Acceptors: 5
No. of Rotatable Bonds: 17
No. of Nitrogen and Oxygen Atoms: 7
No. of Rings: 6
Canonical SMILES
O[C@@H](C[C@H](C(=O)N[C@@H]1[C@H](O)Cc2c1cccc2)Cc1ccccc1)C[C@H](C(=O)N[C@@H]1[C@H](O)Cc2c1cccc2)Cc1ccccc1
InChI String
InChI=1S/C39H42N2O5/c42-31(21-29(19-25-11-3-1-4-12-25)38(45)40-36-32-17-9-7-15-27(32)23-34(36)43)22-30(20-26-13-5-2-6-14-26)39(46)41-37-33-18-10-8-16-28(33)24-35(37)44/h1-18,29-31,34-37,42-44H,19-24H2,(H,40,45)(H,41,46)/t29-,30-,34-,35-,36+,37+/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P12497
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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