Browse entries in the PDBbind-CN Database
HEADER 3U15_COMPLEX COMPND 3U15_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 82 GLN VAL ARG PRO LYS LEU PRO LEU LEU LYS ILE LEU HIS SEQRES 2 A 82 ALA ALA GLY ALA GLN GLY GLU MET PHE THR VAL LYS GLU SEQRES 3 A 82 VAL MET HIS TYR LEU GLY GLN TYR ILE MET VAL LYS GLN SEQRES 4 A 82 LEU TYR ASP GLN GLN GLU GLN HIS MET VAL TYR CYS GLY SEQRES 5 A 82 GLY ASP LEU LEU GLY GLU LEU LEU GLY ARG GLN SER PHE SEQRES 6 A 82 SER VAL LYS ASP PRO SER PRO LEU TYR ASP MET LEU ARG SEQRES 7 A 82 LYS ASN LEU VAL SEQRES 1 B 82 GLN VAL ARG PRO LYS LEU PRO LEU LEU LYS ILE LEU HIS SEQRES 2 B 82 ALA ALA GLY ALA GLN GLY GLU MET PHE THR VAL LYS GLU SEQRES 3 B 82 VAL MET HIS TYR LEU GLY GLN TYR ILE MET VAL LYS GLN SEQRES 4 B 82 LEU TYR ASP GLN GLN GLU GLN HIS MET VAL TYR CYS GLY SEQRES 5 B 82 GLY ASP LEU LEU GLY GLU LEU LEU GLY ARG GLN SER PHE SEQRES 6 B 82 SER VAL LYS ASP PRO SER PRO LEU TYR ASP MET LEU ARG SEQRES 7 B 82 LYS ASN LEU VAL HET UNN A 242 42 ATOM 1 N GLN A 26 -14.571 -15.957 19.084 1.00 22.23 N ATOM 2 CA GLN A 26 -15.114 -15.958 17.700 1.00 23.01 C ATOM 3 C GLN A 26 -14.065 -15.383 16.749 1.00 21.53 C ATOM 4 O GLN A 26 -13.169 -14.647 17.177 1.00 26.87 O ATOM 5 CB GLN A 26 -16.445 -15.158 17.604 1.00 21.42 C ATOM 6 CG GLN A 26 -17.446 -15.295 18.778 1.00 23.29 C ATOM 7 CD GLN A 26 -18.687 -16.077 18.350 1.00 25.42 C ATOM 8 OE1 GLN A 26 -19.854 -15.622 18.560 1.00 27.27 O ATOM 9 NE2 GLN A 26 -18.467 -17.222 17.694 1.00 26.89 N ATOM 10 HA GLN A 26 -15.340 -16.986 17.415 1.00 0.00 H ATOM 11 HB2 GLN A 26 -16.187 -14.103 17.516 1.00 0.00 H ATOM 12 HB3 GLN A 26 -16.957 -15.482 16.698 1.00 0.00 H ATOM 13 HG2 GLN A 26 -16.961 -15.819 19.602 1.00 0.00 H ATOM 14 HG3 GLN A 26 -17.747 -14.301 19.108 1.00 0.00 H ATOM 15 HE22 GLN A 26 -17.494 -17.557 17.545 1.00 0.00 H ATOM 16 HE21 GLN A 26 -19.269 -17.777 17.333 1.00 0.00 H ATOM 17 HN3 GLN A 26 -14.342 -14.982 19.364 1.00 0.00 H ATOM 18 HN2 GLN A 26 -13.711 -16.540 19.118 1.00 0.00 H ATOM 19 HN1 GLN A 26 -15.282 -16.348 19.734 1.00 0.00 H ATOM 20 N VAL A 27 -14.121 -15.780 15.482 1.00 25.70 N ATOM 21 CA VAL A 27 -13.110 -15.378 14.521 1.00 21.45 C ATOM 22 C VAL A 27 -13.679 -14.822 13.233 1.00 21.63 C ATOM 23 O VAL A 27 -14.383 -15.491 12.522 1.00 24.32 O ATOM 24 CB VAL A 27 -11.902 -16.358 14.327 1.00 22.50 C ATOM 25 CG1 VAL A 27 -11.152 -16.562 15.655 1.00 21.32 C ATOM 26 CG2 VAL A 27 -12.284 -17.649 13.624 1.00 23.10 C ATOM 27 HA VAL A 27 -12.633 -14.532 15.015 1.00 0.00 H ATOM 28 HB VAL A 27 -11.199 -15.888 13.639 1.00 0.00 H ATOM 29 HG11 VAL A 27 -10.776 -15.602 16.009 1.00 0.00 H ATOM 30 HG12 VAL A 27 -11.833 -16.982 16.395 1.00 0.00 H ATOM 31 HG13 VAL A 27 -10.317 -17.245 15.498 1.00 0.00 H ATOM 32 HG21 VAL A 27 -13.040 -18.171 14.211 1.00 0.00 H ATOM 33 HG22 VAL A 27 -12.683 -17.419 12.636 1.00 0.00 H ATOM 34 HG23 VAL A 27 -11.402 -18.281 13.522 1.00 0.00 H ATOM 35 H VAL A 27 -14.904 -16.390 15.173 1.00 0.00 H ATOM 36 N ARG A 28 -13.372 -13.568 12.966 1.00 20.19 N ATOM 37 CA ARG A 28 -13.763 -13.004 11.694 1.00 21.56 C ATOM 38 C ARG A 28 -12.538 -12.969 10.769 1.00 22.66 C ATOM 39 O ARG A 28 -11.673 -12.126 10.932 1.00 32.45 O ATOM 40 CB ARG A 28 -14.370 -11.633 11.920 1.00 18.32 C ATOM 41 CG ARG A 28 -15.006 -10.868 10.764 1.00 17.01 C ATOM 42 CD ARG A 28 -14.997 -9.354 11.148 1.00 20.74 C ATOM 43 NE ARG A 28 -16.238 -8.576 10.857 1.00 19.79 N ATOM 44 CZ ARG A 28 -16.446 -7.246 11.020 1.00 18.33 C ATOM 45 NH1 ARG A 28 -15.526 -6.403 11.460 1.00 21.59 N ATOM 46 NH2 ARG A 28 -17.655 -6.740 10.759 1.00 20.57 N ATOM 47 HA ARG A 28 -14.524 -13.615 11.208 1.00 0.00 H ATOM 48 HB2 ARG A 28 -15.144 -11.755 12.678 1.00 0.00 H ATOM 49 HB3 ARG A 28 -13.575 -11.000 12.314 1.00 0.00 H ATOM 50 HG2 ARG A 28 -14.431 -11.025 9.851 1.00 0.00 H ATOM 51 HG3 ARG A 28 -16.030 -11.208 10.610 1.00 0.00 H ATOM 52 HD2 ARG A 28 -14.177 -8.882 10.607 1.00 0.00 H ATOM 53 HD3 ARG A 28 -14.810 -9.287 12.220 1.00 0.00 H ATOM 54 HE ARG A 28 -17.041 -9.121 10.484 1.00 0.00 H ATOM 55 HH12 ARG A 28 -15.752 -5.393 11.562 1.00 0.00 H ATOM 56 HH11 ARG A 28 -14.577 -6.750 11.704 1.00 0.00 H ATOM 57 HH22 ARG A 28 -17.830 -5.722 10.879 1.00 0.00 H ATOM 58 HH21 ARG A 28 -18.421 -7.364 10.436 1.00 0.00 H ATOM 59 H ARG A 28 -12.855 -12.992 13.661 1.00 0.00 H ATOM 60 N PRO A 29 -12.439 -13.913 9.821 1.00 24.08 N ATOM 61 CA PRO A 29 -11.368 -13.870 8.822 1.00 23.20 C ATOM 62 C PRO A 29 -11.354 -12.602 7.902 1.00 24.03 C ATOM 63 O PRO A 29 -12.394 -11.918 7.757 1.00 28.86 O ATOM 64 CB PRO A 29 -11.623 -15.135 7.978 1.00 22.55 C ATOM 65 CG PRO A 29 -12.757 -15.875 8.620 1.00 21.65 C ATOM 66 CD PRO A 29 -13.018 -15.258 9.946 1.00 20.58 C ATOM 67 HA PRO A 29 -10.398 -13.826 9.317 1.00 0.00 H ATOM 68 HD3 PRO A 29 -14.088 -15.204 10.147 1.00 0.00 H ATOM 69 HD2 PRO A 29 -12.528 -15.821 10.741 1.00 0.00 H ATOM 70 HG3 PRO A 29 -12.490 -16.924 8.746 1.00 0.00 H ATOM 71 HG2 PRO A 29 -13.648 -15.801 7.996 1.00 0.00 H ATOM 72 HB2 PRO A 29 -11.888 -14.857 6.958 1.00 0.00 H ATOM 73 HB3 PRO A 29 -10.730 -15.760 7.962 1.00 0.00 H ATOM 74 N LYS A 30 -10.202 -12.310 7.276 1.00 24.79 N ATOM 75 CA LYS A 30 -10.124 -11.253 6.255 1.00 25.19 C ATOM 76 C LYS A 30 -10.671 -11.873 5.017 1.00 30.11 C ATOM 77 O LYS A 30 -10.759 -13.100 4.888 1.00 29.37 O ATOM 78 CB LYS A 30 -8.713 -10.766 5.915 1.00 23.55 C ATOM 79 CG LYS A 30 -7.961 -10.115 7.056 1.00 19.67 C ATOM 80 CD LYS A 30 -6.717 -10.852 7.525 1.00 17.75 C ATOM 81 CE LYS A 30 -5.563 -9.864 7.898 1.00 14.25 C ATOM 82 NZ LYS A 30 -5.810 -8.758 8.905 1.00 11.42 N ATOM 83 HA LYS A 30 -10.658 -10.383 6.638 1.00 0.00 H ATOM 84 HB2 LYS A 30 -8.133 -11.624 5.575 1.00 0.00 H ATOM 85 HB3 LYS A 30 -8.793 -10.040 5.106 1.00 0.00 H ATOM 86 HG2 LYS A 30 -7.660 -9.118 6.734 1.00 0.00 H ATOM 87 HG3 LYS A 30 -8.642 -10.032 7.903 1.00 0.00 H ATOM 88 HD2 LYS A 30 -6.969 -11.448 8.402 1.00 0.00 H ATOM 89 HD3 LYS A 30 -6.374 -11.510 6.727 1.00 0.00 H ATOM 90 HE2 LYS A 30 -5.248 -9.383 6.972 1.00 0.00 H ATOM 91 HE3 LYS A 30 -4.744 -10.469 8.288 1.00 0.00 H ATOM 92 HZ1 LYS A 30 -6.571 -8.139 8.559 1.00 0.00 H ATOM 93 HZ2 LYS A 30 -6.089 -9.176 9.816 1.00 0.00 H ATOM 94 HZ3 LYS A 30 -4.939 -8.203 9.029 1.00 0.00 H ATOM 95 H LYS A 30 -9.344 -12.844 7.519 1.00 0.00 H ATOM 96 N LEU A 31 -10.992 -10.978 4.095 1.00 32.21 N ATOM 97 CA LEU A 31 -11.584 -11.322 2.831 1.00 28.82 C ATOM 98 C LEU A 31 -10.972 -12.560 2.200 1.00 28.95 C ATOM 99 O LEU A 31 -11.625 -13.606 2.169 1.00 28.78 O ATOM 100 CB LEU A 31 -11.485 -10.122 1.910 1.00 28.33 C ATOM 101 CG LEU A 31 -12.493 -10.281 0.804 1.00 28.13 C ATOM 102 CD1 LEU A 31 -13.791 -10.900 1.353 1.00 28.52 C ATOM 103 CD2 LEU A 31 -12.648 -8.877 0.291 1.00 27.66 C ATOM 104 HA LEU A 31 -12.630 -11.578 3.002 1.00 0.00 H ATOM 105 HB2 LEU A 31 -11.695 -9.211 2.470 1.00 0.00 H ATOM 106 HB3 LEU A 31 -10.482 -10.065 1.488 1.00 0.00 H ATOM 107 HG LEU A 31 -12.198 -10.961 0.004 1.00 0.00 H ATOM 108 HD21 LEU A 31 -13.004 -8.235 1.096 1.00 0.00 H ATOM 109 HD22 LEU A 31 -11.684 -8.514 -0.066 1.00 0.00 H ATOM 110 HD23 LEU A 31 -13.367 -8.868 -0.528 1.00 0.00 H ATOM 111 HD11 LEU A 31 -13.573 -11.878 1.781 1.00 0.00 H ATOM 112 HD12 LEU A 31 -14.205 -10.249 2.123 1.00 0.00 H ATOM 113 HD13 LEU A 31 -14.511 -11.009 0.542 1.00 0.00 H ATOM 114 H LEU A 31 -10.806 -9.975 4.296 1.00 0.00 H ATOM 115 N PRO A 32 -9.685 -12.488 1.807 1.00 28.42 N ATOM 116 CA PRO A 32 -9.087 -13.581 1.024 1.00 29.65 C ATOM 117 C PRO A 32 -9.446 -15.003 1.479 1.00 31.52 C ATOM 118 O PRO A 32 -9.675 -15.840 0.641 1.00 31.41 O ATOM 119 CB PRO A 32 -7.578 -13.331 1.191 1.00 31.61 C ATOM 120 CG PRO A 32 -7.497 -11.852 1.260 1.00 29.59 C ATOM 121 CD PRO A 32 -8.694 -11.440 2.104 1.00 29.38 C ATOM 122 HA PRO A 32 -9.459 -13.558 -0.000 1.00 0.00 H ATOM 123 HD3 PRO A 32 -8.441 -11.429 3.164 1.00 0.00 H ATOM 124 HD2 PRO A 32 -9.062 -10.457 1.809 1.00 0.00 H ATOM 125 HG3 PRO A 32 -7.561 -11.416 0.263 1.00 0.00 H ATOM 126 HG2 PRO A 32 -6.566 -11.539 1.733 1.00 0.00 H ATOM 127 HB2 PRO A 32 -7.203 -13.788 2.106 1.00 0.00 H ATOM 128 HB3 PRO A 32 -7.019 -13.716 0.338 1.00 0.00 H ATOM 129 N LEU A 33 -9.443 -15.276 2.790 1.00 30.24 N ATOM 130 CA LEU A 33 -9.665 -16.622 3.266 1.00 28.48 C ATOM 131 C LEU A 33 -11.163 -16.999 3.316 1.00 29.58 C ATOM 132 O LEU A 33 -11.520 -18.149 3.068 1.00 35.10 O ATOM 133 CB LEU A 33 -8.953 -16.834 4.611 1.00 27.18 C ATOM 134 CG LEU A 33 -9.599 -17.809 5.589 1.00 26.48 C ATOM 135 CD1 LEU A 33 -9.271 -19.296 5.328 1.00 25.45 C ATOM 136 CD2 LEU A 33 -9.086 -17.355 6.936 1.00 25.26 C ATOM 137 HA LEU A 33 -9.225 -17.309 2.543 1.00 0.00 H ATOM 138 HB2 LEU A 33 -7.948 -17.199 4.398 1.00 0.00 H ATOM 139 HB3 LEU A 33 -8.889 -15.865 5.106 1.00 0.00 H ATOM 140 HG LEU A 33 -10.685 -17.784 5.499 1.00 0.00 H ATOM 141 HD21 LEU A 33 -7.998 -17.416 6.948 1.00 0.00 H ATOM 142 HD22 LEU A 33 -9.395 -16.325 7.113 1.00 0.00 H ATOM 143 HD23 LEU A 33 -9.496 -17.998 7.715 1.00 0.00 H ATOM 144 HD11 LEU A 33 -9.615 -19.573 4.332 1.00 0.00 H ATOM 145 HD12 LEU A 33 -8.194 -19.447 5.397 1.00 0.00 H ATOM 146 HD13 LEU A 33 -9.774 -19.914 6.072 1.00 0.00 H ATOM 147 H LEU A 33 -9.279 -14.510 3.474 1.00 0.00 H ATOM 148 N LEU A 34 -12.001 -16.029 3.662 1.00 29.24 N ATOM 149 CA LEU A 34 -13.453 -16.085 3.464 1.00 30.84 C ATOM 150 C LEU A 34 -13.725 -16.515 2.039 1.00 31.36 C ATOM 151 O LEU A 34 -14.808 -17.022 1.735 1.00 30.76 O ATOM 152 CB LEU A 34 -14.064 -14.702 3.592 1.00 29.88 C ATOM 153 CG LEU A 34 -14.889 -13.988 4.676 1.00 27.19 C ATOM 154 CD1 LEU A 34 -16.168 -13.480 4.011 1.00 26.33 C ATOM 155 CD2 LEU A 34 -15.203 -14.829 5.887 1.00 30.35 C ATOM 156 HA LEU A 34 -13.871 -16.767 4.204 1.00 0.00 H ATOM 157 HB2 LEU A 34 -13.206 -14.043 3.464 1.00 0.00 H ATOM 158 HB3 LEU A 34 -14.705 -14.636 2.713 1.00 0.00 H ATOM 159 HG LEU A 34 -14.287 -13.171 5.074 1.00 0.00 H ATOM 160 HD21 LEU A 34 -15.775 -15.705 5.581 1.00 0.00 H ATOM 161 HD22 LEU A 34 -14.273 -15.148 6.358 1.00 0.00 H ATOM 162 HD23 LEU A 34 -15.787 -14.241 6.595 1.00 0.00 H ATOM 163 HD11 LEU A 34 -15.909 -12.789 3.209 1.00 0.00 H ATOM 164 HD12 LEU A 34 -16.722 -14.324 3.601 1.00 0.00 H ATOM 165 HD13 LEU A 34 -16.781 -12.966 4.751 1.00 0.00 H ATOM 166 H LEU A 34 -11.602 -15.175 4.102 1.00 0.00 H ATOM 167 N LYS A 35 -12.742 -16.282 1.177 1.00 30.49 N ATOM 168 CA LYS A 35 -12.897 -16.419 -0.253 1.00 32.91 C ATOM 169 C LYS A 35 -12.728 -17.888 -0.617 1.00 34.17 C ATOM 170 O LYS A 35 -13.606 -18.479 -1.270 1.00 34.42 O ATOM 171 CB LYS A 35 -11.876 -15.539 -0.975 1.00 32.43 C ATOM 172 CG LYS A 35 -12.439 -14.196 -1.438 1.00 26.56 C ATOM 173 CD LYS A 35 -11.483 -13.461 -2.372 1.00 26.77 C ATOM 174 CE LYS A 35 -12.229 -12.727 -3.473 1.00 20.46 C ATOM 175 NZ LYS A 35 -12.742 -13.698 -4.476 1.00 17.57 N ATOM 176 HA LYS A 35 -13.888 -16.090 -0.565 1.00 0.00 H ATOM 177 HB2 LYS A 35 -11.045 -15.348 -0.296 1.00 0.00 H ATOM 178 HB3 LYS A 35 -11.513 -16.080 -1.849 1.00 0.00 H ATOM 179 HG2 LYS A 35 -13.378 -14.371 -1.963 1.00 0.00 H ATOM 180 HG3 LYS A 35 -12.624 -13.572 -0.563 1.00 0.00 H ATOM 181 HD2 LYS A 35 -10.907 -12.739 -1.793 1.00 0.00 H ATOM 182 HD3 LYS A 35 -10.805 -14.184 -2.825 1.00 0.00 H ATOM 183 HE2 LYS A 35 -11.553 -12.026 -3.962 1.00 0.00 H ATOM 184 HE3 LYS A 35 -13.066 -12.180 -3.039 1.00 0.00 H ATOM 185 HZ1 LYS A 35 -11.944 -14.219 -4.892 1.00 0.00 H ATOM 186 HZ2 LYS A 35 -13.389 -14.366 -4.011 1.00 0.00 H ATOM 187 HZ3 LYS A 35 -13.251 -13.185 -5.224 1.00 0.00 H ATOM 188 H LYS A 35 -11.817 -15.987 1.549 1.00 0.00 H ATOM 189 N ILE A 36 -11.612 -18.496 -0.194 1.00 33.92 N ATOM 190 CA ILE A 36 -11.550 -19.945 -0.190 1.00 29.98 C ATOM 191 C ILE A 36 -12.863 -20.421 0.501 1.00 31.63 C ATOM 192 O ILE A 36 -13.569 -21.379 0.051 1.00 31.59 O ATOM 193 CB ILE A 36 -10.251 -20.438 0.523 1.00 29.02 C ATOM 194 CG1 ILE A 36 -8.974 -19.871 -0.120 1.00 26.47 C ATOM 195 CG2 ILE A 36 -10.125 -21.935 0.486 1.00 27.70 C ATOM 196 CD1 ILE A 36 -7.743 -20.086 0.749 1.00 19.33 C ATOM 197 HA ILE A 36 -11.490 -20.367 -1.193 1.00 0.00 H ATOM 198 HB ILE A 36 -10.345 -20.082 1.549 1.00 0.00 H ATOM 199 HG12 ILE A 36 -8.816 -20.364 -1.079 1.00 0.00 H ATOM 200 HG13 ILE A 36 -9.107 -18.801 -0.280 1.00 0.00 H ATOM 201 HD11 ILE A 36 -7.886 -19.590 1.709 1.00 0.00 H ATOM 202 HD12 ILE A 36 -7.595 -21.154 0.909 1.00 0.00 H ATOM 203 HD13 ILE A 36 -6.869 -19.667 0.249 1.00 0.00 H ATOM 204 HG21 ILE A 36 -10.982 -22.383 0.989 1.00 0.00 H ATOM 205 HG22 ILE A 36 -10.094 -22.270 -0.551 1.00 0.00 H ATOM 206 HG23 ILE A 36 -9.208 -22.234 0.993 1.00 0.00 H ATOM 207 H ILE A 36 -10.798 -17.935 0.128 1.00 0.00 H ATOM 208 N LEU A 37 -13.230 -19.713 1.571 1.00 30.28 N ATOM 209 CA LEU A 37 -14.186 -20.233 2.580 1.00 31.66 C ATOM 210 C LEU A 37 -15.598 -20.377 2.118 1.00 32.23 C ATOM 211 O LEU A 37 -16.166 -21.450 2.117 1.00 34.20 O ATOM 212 CB LEU A 37 -14.150 -19.388 3.840 1.00 34.15 C ATOM 213 CG LEU A 37 -13.144 -19.871 4.870 1.00 28.05 C ATOM 214 CD1 LEU A 37 -13.670 -19.631 6.269 1.00 23.07 C ATOM 215 CD2 LEU A 37 -12.874 -21.341 4.620 1.00 29.01 C ATOM 216 HA LEU A 37 -13.838 -21.247 2.779 1.00 0.00 H ATOM 217 HB2 LEU A 37 -13.894 -18.366 3.562 1.00 0.00 H ATOM 218 HB3 LEU A 37 -15.141 -19.403 4.293 1.00 0.00 H ATOM 219 HG LEU A 37 -12.210 -19.317 4.779 1.00 0.00 H ATOM 220 HD21 LEU A 37 -13.804 -21.901 4.714 1.00 0.00 H ATOM 221 HD22 LEU A 37 -12.472 -21.469 3.615 1.00 0.00 H ATOM 222 HD23 LEU A 37 -12.153 -21.706 5.351 1.00 0.00 H ATOM 223 HD11 LEU A 37 -13.844 -18.565 6.413 1.00 0.00 H ATOM 224 HD12 LEU A 37 -14.606 -20.174 6.402 1.00 0.00 H ATOM 225 HD13 LEU A 37 -12.938 -19.982 6.996 1.00 0.00 H ATOM 226 H LEU A 37 -12.831 -18.762 1.703 1.00 0.00 H ATOM 227 N HIS A 38 -16.152 -19.234 1.750 1.00 33.81 N ATOM 228 CA HIS A 38 -17.378 -19.125 1.037 1.00 30.98 C ATOM 229 C HIS A 38 -17.392 -20.064 -0.131 1.00 27.93 C ATOM 230 O HIS A 38 -18.383 -20.736 -0.334 1.00 24.76 O ATOM 231 CB HIS A 38 -17.521 -17.671 0.576 1.00 34.42 C ATOM 232 CG HIS A 38 -18.162 -16.758 1.604 1.00 36.03 C ATOM 233 ND1 HIS A 38 -17.812 -15.468 1.746 1.00 32.57 N ATOM 234 CD2 HIS A 38 -19.211 -16.980 2.495 1.00 33.44 C ATOM 235 CE1 HIS A 38 -18.575 -14.902 2.698 1.00 34.14 C ATOM 236 NE2 HIS A 38 -19.443 -15.815 3.136 1.00 35.27 N ATOM 237 HA HIS A 38 -18.217 -19.397 1.677 1.00 0.00 H ATOM 238 HB2 HIS A 38 -16.528 -17.285 0.346 1.00 0.00 H ATOM 239 HB3 HIS A 38 -18.133 -17.656 -0.326 1.00 0.00 H ATOM 240 HD2 HIS A 38 -19.744 -17.919 2.646 1.00 0.00 H ATOM 241 HE1 HIS A 38 -18.497 -13.874 3.051 1.00 0.00 H ATOM 242 H HIS A 38 -15.657 -18.354 1.999 1.00 0.00 H ATOM 243 N ALA A 39 -16.284 -20.164 -0.875 1.00 26.09 N ATOM 244 CA ALA A 39 -16.266 -21.000 -2.090 1.00 28.18 C ATOM 245 C ALA A 39 -16.424 -22.499 -1.819 1.00 26.05 C ATOM 246 O ALA A 39 -16.556 -23.286 -2.769 1.00 33.18 O ATOM 247 CB ALA A 39 -15.069 -20.649 -2.994 1.00 20.95 C ATOM 248 HA ALA A 39 -17.165 -20.750 -2.653 1.00 0.00 H ATOM 249 HB1 ALA A 39 -15.136 -19.603 -3.293 1.00 0.00 H ATOM 250 HB2 ALA A 39 -14.141 -20.813 -2.446 1.00 0.00 H ATOM 251 HB3 ALA A 39 -15.086 -21.284 -3.880 1.00 0.00 H ATOM 252 H ALA A 39 -15.427 -19.647 -0.593 1.00 0.00 H ATOM 253 N ALA A 40 -16.518 -22.895 -0.525 1.00 24.76 N ATOM 254 CA ALA A 40 -16.754 -24.334 -0.141 1.00 21.06 C ATOM 255 C ALA A 40 -18.048 -24.445 0.602 1.00 24.67 C ATOM 256 O ALA A 40 -18.266 -25.415 1.381 1.00 21.00 O ATOM 257 CB ALA A 40 -15.597 -24.859 0.721 1.00 22.79 C ATOM 258 HA ALA A 40 -16.805 -24.940 -1.046 1.00 0.00 H ATOM 259 HB1 ALA A 40 -14.666 -24.791 0.158 1.00 0.00 H ATOM 260 HB2 ALA A 40 -15.520 -24.259 1.628 1.00 0.00 H ATOM 261 HB3 ALA A 40 -15.787 -25.899 0.987 1.00 0.00 H ATOM 262 H ALA A 40 -16.424 -22.183 0.227 1.00 0.00 H ATOM 263 N GLY A 41 -18.871 -23.406 0.340 1.00 26.30 N ATOM 264 CA GLY A 41 -20.213 -23.162 0.861 1.00 23.86 C ATOM 265 C GLY A 41 -20.381 -22.764 2.291 1.00 25.05 C ATOM 266 O GLY A 41 -21.424 -23.025 2.858 1.00 24.78 O ATOM 267 HA3 GLY A 41 -20.782 -24.081 0.717 1.00 0.00 H ATOM 268 HA2 GLY A 41 -20.650 -22.367 0.256 1.00 0.00 H ATOM 269 H GLY A 41 -18.502 -22.689 -0.316 1.00 0.00 H ATOM 270 N ALA A 42 -19.401 -22.072 2.865 1.00 24.83 N ATOM 271 CA ALA A 42 -19.631 -21.366 4.090 1.00 28.20 C ATOM 272 C ALA A 42 -20.613 -20.211 3.817 1.00 28.69 C ATOM 273 O ALA A 42 -20.861 -19.900 2.663 1.00 33.30 O ATOM 274 CB ALA A 42 -18.326 -20.832 4.564 1.00 22.53 C ATOM 275 HA ALA A 42 -20.057 -22.021 4.850 1.00 0.00 H ATOM 276 HB1 ALA A 42 -17.635 -21.659 4.729 1.00 0.00 H ATOM 277 HB2 ALA A 42 -17.916 -20.158 3.812 1.00 0.00 H ATOM 278 HB3 ALA A 42 -18.474 -20.289 5.497 1.00 0.00 H ATOM 279 H ALA A 42 -18.461 -22.043 2.421 1.00 0.00 H ATOM 280 N GLN A 43 -21.139 -19.594 4.878 1.00 30.95 N ATOM 281 CA GLN A 43 -21.871 -18.330 4.795 1.00 32.06 C ATOM 282 C GLN A 43 -21.365 -17.324 5.847 1.00 33.03 C ATOM 283 O GLN A 43 -21.076 -17.704 6.976 1.00 34.75 O ATOM 284 CB GLN A 43 -23.390 -18.581 4.879 1.00 32.13 C ATOM 285 CG GLN A 43 -23.917 -19.357 3.667 1.00 30.32 C ATOM 286 CD GLN A 43 -25.335 -19.904 3.840 1.00 38.93 C ATOM 287 OE1 GLN A 43 -25.968 -19.761 4.909 1.00 42.02 O ATOM 288 NE2 GLN A 43 -25.855 -20.519 2.775 1.00 37.58 N ATOM 289 HA GLN A 43 -21.680 -17.873 3.824 1.00 0.00 H ATOM 290 HB2 GLN A 43 -23.602 -19.154 5.782 1.00 0.00 H ATOM 291 HB3 GLN A 43 -23.902 -17.620 4.931 1.00 0.00 H ATOM 292 HG2 GLN A 43 -23.910 -18.690 2.805 1.00 0.00 H ATOM 293 HG3 GLN A 43 -23.247 -20.196 3.481 1.00 0.00 H ATOM 294 HE22 GLN A 43 -25.293 -20.616 1.905 1.00 0.00 H ATOM 295 HE21 GLN A 43 -26.822 -20.901 2.815 1.00 0.00 H ATOM 296 H GLN A 43 -21.022 -20.035 5.813 1.00 0.00 H ATOM 297 N GLY A 44 -21.224 -16.058 5.474 1.00 29.39 N ATOM 298 CA GLY A 44 -20.972 -15.007 6.488 1.00 36.57 C ATOM 299 C GLY A 44 -19.526 -14.681 6.865 1.00 38.84 C ATOM 300 O GLY A 44 -18.600 -15.021 6.118 1.00 36.55 O ATOM 301 HA3 GLY A 44 -21.481 -15.314 7.402 1.00 0.00 H ATOM 302 HA2 GLY A 44 -21.422 -14.087 6.115 1.00 0.00 H ATOM 303 H GLY A 44 -21.291 -15.803 4.468 1.00 0.00 H ATOM 304 N GLU A 45 -19.357 -14.033 8.032 1.00 38.69 N ATOM 305 CA GLU A 45 -18.151 -13.252 8.412 1.00 37.23 C ATOM 306 C GLU A 45 -17.480 -13.725 9.738 1.00 35.28 C ATOM 307 O GLU A 45 -16.267 -13.866 9.804 1.00 41.49 O ATOM 308 CB GLU A 45 -18.496 -11.733 8.512 1.00 33.98 C ATOM 309 CG GLU A 45 -18.367 -10.868 7.227 1.00 34.33 C ATOM 310 CD GLU A 45 -18.229 -9.332 7.469 1.00 33.12 C ATOM 311 OE1 GLU A 45 -18.787 -8.496 6.684 1.00 29.25 O ATOM 312 OE2 GLU A 45 -17.511 -8.923 8.428 1.00 30.44 O ATOM 313 HA GLU A 45 -17.425 -13.426 7.618 1.00 0.00 H ATOM 314 HB2 GLU A 45 -19.529 -11.657 8.852 1.00 0.00 H ATOM 315 HB3 GLU A 45 -17.835 -11.299 9.262 1.00 0.00 H ATOM 316 HG2 GLU A 45 -17.485 -11.204 6.681 1.00 0.00 H ATOM 317 HG3 GLU A 45 -19.255 -11.035 6.618 1.00 0.00 H ATOM 318 H GLU A 45 -20.132 -14.083 8.723 1.00 0.00 H ATOM 319 N MET A 46 -18.272 -13.904 10.789 1.00 33.02 N ATOM 320 CA MET A 46 -17.860 -14.500 12.048 1.00 32.32 C ATOM 321 C MET A 46 -17.914 -16.045 12.065 1.00 31.25 C ATOM 322 O MET A 46 -18.795 -16.657 11.462 1.00 27.70 O ATOM 323 CB MET A 46 -18.703 -13.964 13.185 1.00 35.44 C ATOM 324 CG MET A 46 -18.177 -12.647 13.687 1.00 37.29 C ATOM 325 SD MET A 46 -16.873 -12.984 14.872 1.00 40.01 S ATOM 326 CE MET A 46 -17.784 -12.653 16.380 1.00 33.72 C ATOM 327 HA MET A 46 -16.814 -14.219 12.173 1.00 0.00 H ATOM 328 HB2 MET A 46 -19.726 -13.827 12.834 1.00 0.00 H ATOM 329 HB3 MET A 46 -18.694 -14.684 14.003 1.00 0.00 H ATOM 330 HG2 MET A 46 -18.979 -12.088 14.169 1.00 0.00 H ATOM 331 HG3 MET A 46 -17.780 -12.066 12.855 1.00 0.00 H ATOM 332 HE1 MET A 46 -18.134 -11.621 16.372 1.00 0.00 H ATOM 333 HE2 MET A 46 -18.638 -13.327 16.442 1.00 0.00 H ATOM 334 HE3 MET A 46 -17.132 -12.811 17.239 1.00 0.00 H ATOM 335 H MET A 46 -19.261 -13.594 10.704 1.00 0.00 H ATOM 336 N PHE A 47 -16.987 -16.652 12.803 1.00 28.28 N ATOM 337 CA PHE A 47 -16.735 -18.089 12.684 1.00 28.20 C ATOM 338 C PHE A 47 -16.049 -18.653 13.909 1.00 27.79 C ATOM 339 O PHE A 47 -15.482 -17.907 14.716 1.00 27.07 O ATOM 340 CB PHE A 47 -15.765 -18.319 11.523 1.00 25.35 C ATOM 341 CG PHE A 47 -16.421 -18.286 10.149 1.00 24.11 C ATOM 342 CD1 PHE A 47 -16.739 -19.486 9.491 1.00 23.25 C ATOM 343 CD2 PHE A 47 -16.690 -17.091 9.507 1.00 25.34 C ATOM 344 CE1 PHE A 47 -17.307 -19.477 8.238 1.00 18.26 C ATOM 345 CE2 PHE A 47 -17.289 -17.071 8.257 1.00 20.37 C ATOM 346 CZ PHE A 47 -17.567 -18.281 7.626 1.00 22.83 C ATOM 347 HA PHE A 47 -17.701 -18.573 12.544 1.00 0.00 H ATOM 348 HB2 PHE A 47 -15.000 -17.543 11.556 1.00 0.00 H ATOM 349 HB3 PHE A 47 -15.297 -19.294 11.656 1.00 0.00 H ATOM 350 HD2 PHE A 47 -16.427 -16.151 9.991 1.00 0.00 H ATOM 351 HE2 PHE A 47 -17.538 -16.125 7.776 1.00 0.00 H ATOM 352 HZ PHE A 47 -18.000 -18.275 6.626 1.00 0.00 H ATOM 353 HE1 PHE A 47 -17.548 -20.415 7.737 1.00 0.00 H ATOM 354 HD1 PHE A 47 -16.533 -20.438 9.980 1.00 0.00 H ATOM 355 H PHE A 47 -16.429 -16.093 13.479 1.00 0.00 H ATOM 356 N THR A 48 -16.053 -19.988 13.995 1.00 31.44 N ATOM 357 CA THR A 48 -15.058 -20.695 14.841 1.00 28.53 C ATOM 358 C THR A 48 -13.924 -21.436 14.137 1.00 26.91 C ATOM 359 O THR A 48 -13.893 -21.653 12.898 1.00 26.26 O ATOM 360 CB THR A 48 -15.694 -21.678 15.842 1.00 24.80 C ATOM 361 OG1 THR A 48 -16.400 -22.720 15.140 1.00 25.13 O ATOM 362 CG2 THR A 48 -16.612 -20.918 16.826 1.00 23.51 C ATOM 363 HA THR A 48 -14.608 -19.839 15.345 1.00 0.00 H ATOM 364 HB THR A 48 -14.908 -22.155 16.428 1.00 0.00 H ATOM 365 HG1 THR A 48 -17.113 -22.317 14.584 1.00 0.00 H ATOM 366 HG23 THR A 48 -16.037 -20.143 17.332 1.00 0.00 H ATOM 367 HG21 THR A 48 -17.434 -20.461 16.275 1.00 0.00 H ATOM 368 HG22 THR A 48 -17.010 -21.616 17.562 1.00 0.00 H ATOM 369 H THR A 48 -16.760 -20.536 13.464 1.00 0.00 H ATOM 370 N VAL A 49 -12.981 -21.877 14.957 1.00 24.85 N ATOM 371 CA VAL A 49 -11.810 -22.471 14.408 1.00 27.09 C ATOM 372 C VAL A 49 -12.155 -23.860 13.876 1.00 29.00 C ATOM 373 O VAL A 49 -11.618 -24.259 12.843 1.00 33.74 O ATOM 374 CB VAL A 49 -10.663 -22.536 15.417 1.00 26.16 C ATOM 375 CG1 VAL A 49 -9.348 -22.182 14.739 1.00 21.72 C ATOM 376 CG2 VAL A 49 -10.955 -21.599 16.574 1.00 26.18 C ATOM 377 HA VAL A 49 -11.459 -21.843 13.589 1.00 0.00 H ATOM 378 HB VAL A 49 -10.574 -23.550 15.807 1.00 0.00 H ATOM 379 HG11 VAL A 49 -9.155 -22.889 13.932 1.00 0.00 H ATOM 380 HG12 VAL A 49 -9.410 -21.173 14.333 1.00 0.00 H ATOM 381 HG13 VAL A 49 -8.540 -22.232 15.468 1.00 0.00 H ATOM 382 HG21 VAL A 49 -11.053 -20.580 16.199 1.00 0.00 H ATOM 383 HG22 VAL A 49 -11.884 -21.900 17.058 1.00 0.00 H ATOM 384 HG23 VAL A 49 -10.137 -21.646 17.293 1.00 0.00 H ATOM 385 H VAL A 49 -13.095 -21.790 15.987 1.00 0.00 H ATOM 386 N LYS A 50 -13.048 -24.587 14.559 1.00 28.09 N ATOM 387 CA LYS A 50 -13.495 -25.882 14.009 1.00 29.96 C ATOM 388 C LYS A 50 -14.071 -25.556 12.663 1.00 27.16 C ATOM 389 O LYS A 50 -13.676 -26.138 11.645 1.00 27.09 O ATOM 390 CB LYS A 50 -14.526 -26.608 14.897 1.00 30.33 C ATOM 391 CG LYS A 50 -15.025 -27.974 14.348 1.00 30.30 C ATOM 392 CD LYS A 50 -15.928 -28.796 15.274 1.00 28.91 C ATOM 393 CE LYS A 50 -16.102 -30.227 14.757 1.00 27.08 C ATOM 394 NZ LYS A 50 -17.377 -30.881 15.189 1.00 20.56 N ATOM 395 HA LYS A 50 -12.658 -26.578 13.952 1.00 0.00 H ATOM 396 HB2 LYS A 50 -14.069 -26.782 15.871 1.00 0.00 H ATOM 397 HB3 LYS A 50 -15.391 -25.955 15.014 1.00 0.00 H ATOM 398 HG2 LYS A 50 -15.581 -27.779 13.431 1.00 0.00 H ATOM 399 HG3 LYS A 50 -14.148 -28.579 14.118 1.00 0.00 H ATOM 400 HD2 LYS A 50 -15.481 -28.829 16.268 1.00 0.00 H ATOM 401 HD3 LYS A 50 -16.906 -28.318 15.332 1.00 0.00 H ATOM 402 HE2 LYS A 50 -15.268 -30.827 15.122 1.00 0.00 H ATOM 403 HE3 LYS A 50 -16.081 -30.203 13.667 1.00 0.00 H ATOM 404 HZ1 LYS A 50 -17.409 -30.924 16.228 1.00 0.00 H ATOM 405 HZ2 LYS A 50 -18.185 -30.328 14.839 1.00 0.00 H ATOM 406 HZ3 LYS A 50 -17.420 -31.844 14.800 1.00 0.00 H ATOM 407 H LYS A 50 -13.422 -24.243 15.466 1.00 0.00 H ATOM 408 N GLU A 51 -14.992 -24.604 12.651 1.00 31.36 N ATOM 409 CA GLU A 51 -15.655 -24.246 11.418 1.00 31.65 C ATOM 410 C GLU A 51 -14.699 -23.841 10.295 1.00 26.82 C ATOM 411 O GLU A 51 -14.894 -24.225 9.155 1.00 31.25 O ATOM 412 CB GLU A 51 -16.739 -23.215 11.666 1.00 37.49 C ATOM 413 CG GLU A 51 -17.993 -23.844 12.258 1.00 40.24 C ATOM 414 CD GLU A 51 -18.890 -22.809 12.870 1.00 42.03 C ATOM 415 OE1 GLU A 51 -18.388 -22.075 13.737 1.00 41.42 O ATOM 416 OE2 GLU A 51 -20.082 -22.735 12.479 1.00 44.40 O ATOM 417 HA GLU A 51 -16.135 -25.153 11.050 1.00 0.00 H ATOM 418 HB2 GLU A 51 -16.360 -22.464 12.359 1.00 0.00 H ATOM 419 HB3 GLU A 51 -16.996 -22.738 10.720 1.00 0.00 H ATOM 420 HG2 GLU A 51 -18.537 -24.362 11.468 1.00 0.00 H ATOM 421 HG3 GLU A 51 -17.702 -24.560 13.027 1.00 0.00 H ATOM 422 H GLU A 51 -15.239 -24.112 13.533 1.00 0.00 H ATOM 423 N VAL A 52 -13.637 -23.118 10.630 1.00 24.48 N ATOM 424 CA VAL A 52 -12.740 -22.588 9.635 1.00 23.25 C ATOM 425 C VAL A 52 -11.957 -23.777 9.051 1.00 22.50 C ATOM 426 O VAL A 52 -11.594 -23.792 7.818 1.00 22.29 O ATOM 427 CB VAL A 52 -11.861 -21.457 10.218 1.00 23.06 C ATOM 428 CG1 VAL A 52 -10.772 -21.094 9.251 1.00 21.85 C ATOM 429 CG2 VAL A 52 -12.723 -20.181 10.569 1.00 20.27 C ATOM 430 HA VAL A 52 -13.278 -22.103 8.820 1.00 0.00 H ATOM 431 HB VAL A 52 -11.412 -21.825 11.141 1.00 0.00 H ATOM 432 HG11 VAL A 52 -10.149 -21.968 9.062 1.00 0.00 H ATOM 433 HG12 VAL A 52 -11.217 -20.754 8.316 1.00 0.00 H ATOM 434 HG13 VAL A 52 -10.162 -20.297 9.675 1.00 0.00 H ATOM 435 HG21 VAL A 52 -13.208 -19.812 9.665 1.00 0.00 H ATOM 436 HG22 VAL A 52 -13.480 -20.447 11.307 1.00 0.00 H ATOM 437 HG23 VAL A 52 -12.074 -19.406 10.976 1.00 0.00 H ATOM 438 H VAL A 52 -13.448 -22.930 11.635 1.00 0.00 H ATOM 439 N MET A 53 -11.805 -24.811 9.891 1.00 20.13 N ATOM 440 CA MET A 53 -11.158 -26.092 9.497 1.00 26.34 C ATOM 441 C MET A 53 -12.032 -27.057 8.713 1.00 23.80 C ATOM 442 O MET A 53 -11.557 -27.863 7.938 1.00 24.01 O ATOM 443 CB MET A 53 -10.582 -26.840 10.704 1.00 26.39 C ATOM 444 CG MET A 53 -9.108 -27.118 10.578 1.00 26.61 C ATOM 445 SD MET A 53 -8.159 -25.664 10.045 1.00 33.16 S ATOM 446 CE MET A 53 -6.569 -26.167 10.605 1.00 29.43 C ATOM 447 HA MET A 53 -10.365 -25.764 8.826 1.00 0.00 H ATOM 448 HB2 MET A 53 -10.747 -26.237 11.597 1.00 0.00 H ATOM 449 HB3 MET A 53 -11.107 -27.790 10.807 1.00 0.00 H ATOM 450 HG2 MET A 53 -8.965 -27.914 9.848 1.00 0.00 H ATOM 451 HG3 MET A 53 -8.731 -27.444 11.547 1.00 0.00 H ATOM 452 HE1 MET A 53 -6.597 -26.320 11.684 1.00 0.00 H ATOM 453 HE2 MET A 53 -6.289 -27.098 10.112 1.00 0.00 H ATOM 454 HE3 MET A 53 -5.839 -25.393 10.365 1.00 0.00 H ATOM 455 H MET A 53 -12.156 -24.713 10.865 1.00 0.00 H ATOM 456 N HIS A 54 -13.328 -26.974 8.904 1.00 28.09 N ATOM 457 CA HIS A 54 -14.200 -27.754 8.081 1.00 25.48 C ATOM 458 C HIS A 54 -14.381 -27.322 6.649 1.00 28.30 C ATOM 459 O HIS A 54 -14.750 -28.142 5.771 1.00 24.99 O ATOM 460 CB HIS A 54 -15.564 -27.785 8.699 1.00 29.25 C ATOM 461 CG HIS A 54 -16.582 -28.329 7.763 1.00 31.35 C ATOM 462 ND1 HIS A 54 -16.528 -29.588 7.313 1.00 27.51 N ATOM 463 CD2 HIS A 54 -17.641 -27.715 7.104 1.00 32.38 C ATOM 464 CE1 HIS A 54 -17.528 -29.816 6.466 1.00 28.76 C ATOM 465 NE2 HIS A 54 -18.221 -28.663 6.322 1.00 32.34 N ATOM 466 HA HIS A 54 -13.698 -28.721 8.036 1.00 0.00 H ATOM 467 HB2 HIS A 54 -15.534 -28.411 9.591 1.00 0.00 H ATOM 468 HB3 HIS A 54 -15.848 -26.771 8.979 1.00 0.00 H ATOM 469 HD2 HIS A 54 -17.947 -26.673 7.197 1.00 0.00 H ATOM 470 HE1 HIS A 54 -17.750 -30.764 5.975 1.00 0.00 H ATOM 471 H HIS A 54 -13.715 -26.351 9.642 1.00 0.00 H ATOM 472 N TYR A 55 -14.202 -26.035 6.371 1.00 25.67 N ATOM 473 CA TYR A 55 -14.585 -25.565 5.041 1.00 24.60 C ATOM 474 C TYR A 55 -13.389 -25.624 4.141 1.00 21.80 C ATOM 475 O TYR A 55 -13.482 -25.946 2.935 1.00 21.06 O ATOM 476 CB TYR A 55 -15.135 -24.137 5.116 1.00 22.21 C ATOM 477 CG TYR A 55 -16.540 -24.097 5.666 1.00 24.46 C ATOM 478 CD1 TYR A 55 -17.618 -24.343 4.842 1.00 22.47 C ATOM 479 CD2 TYR A 55 -16.784 -23.785 7.014 1.00 22.54 C ATOM 480 CE1 TYR A 55 -18.924 -24.321 5.331 1.00 27.11 C ATOM 481 CE2 TYR A 55 -18.104 -23.778 7.514 1.00 25.96 C ATOM 482 CZ TYR A 55 -19.156 -24.027 6.660 1.00 22.57 C ATOM 483 OH TYR A 55 -20.462 -24.000 7.099 1.00 29.47 O ATOM 484 HA TYR A 55 -15.371 -26.205 4.640 1.00 0.00 H ATOM 485 HB3 TYR A 55 -15.137 -23.708 4.114 1.00 0.00 H ATOM 486 HB2 TYR A 55 -14.487 -23.544 5.762 1.00 0.00 H ATOM 487 HD2 TYR A 55 -15.951 -23.548 7.676 1.00 0.00 H ATOM 488 HE2 TYR A 55 -18.290 -23.577 8.569 1.00 0.00 H ATOM 489 HE1 TYR A 55 -19.760 -24.535 4.665 1.00 0.00 H ATOM 490 HD1 TYR A 55 -17.446 -24.559 3.788 1.00 0.00 H ATOM 491 HH TYR A 55 -20.584 -24.677 7.811 1.00 0.00 H ATOM 492 H TYR A 55 -13.803 -25.384 7.076 1.00 0.00 H ATOM 493 N LEU A 56 -12.251 -25.292 4.750 1.00 25.12 N ATOM 494 CA LEU A 56 -10.943 -25.544 4.112 1.00 26.78 C ATOM 495 C LEU A 56 -10.739 -27.019 3.786 1.00 25.03 C ATOM 496 O LEU A 56 -10.139 -27.306 2.760 1.00 32.31 O ATOM 497 CB LEU A 56 -9.756 -25.010 4.939 1.00 22.56 C ATOM 498 CG LEU A 56 -9.461 -23.527 5.235 1.00 23.98 C ATOM 499 CD1 LEU A 56 -8.362 -23.576 6.251 1.00 24.10 C ATOM 500 CD2 LEU A 56 -8.985 -22.697 4.035 1.00 24.22 C ATOM 501 HA LEU A 56 -10.965 -24.985 3.176 1.00 0.00 H ATOM 502 HB2 LEU A 56 -9.849 -25.485 5.916 1.00 0.00 H ATOM 503 HB3 LEU A 56 -8.864 -25.386 4.438 1.00 0.00 H ATOM 504 HG LEU A 56 -10.381 -23.037 5.554 1.00 0.00 H ATOM 505 HD21 LEU A 56 -8.061 -23.123 3.644 1.00 0.00 H ATOM 506 HD22 LEU A 56 -9.750 -22.710 3.259 1.00 0.00 H ATOM 507 HD23 LEU A 56 -8.806 -21.670 4.353 1.00 0.00 H ATOM 508 HD11 LEU A 56 -8.709 -24.112 7.134 1.00 0.00 H ATOM 509 HD12 LEU A 56 -7.500 -24.091 5.827 1.00 0.00 H ATOM 510 HD13 LEU A 56 -8.080 -22.560 6.528 1.00 0.00 H ATOM 511 H LEU A 56 -12.285 -24.848 5.690 1.00 0.00 H ATOM 512 N GLY A 57 -11.226 -27.948 4.620 1.00 24.71 N ATOM 513 CA GLY A 57 -11.218 -29.394 4.297 1.00 24.74 C ATOM 514 C GLY A 57 -12.135 -29.587 3.107 1.00 23.40 C ATOM 515 O GLY A 57 -11.767 -30.275 2.130 1.00 24.93 O ATOM 516 HA3 GLY A 57 -11.582 -29.970 5.148 1.00 0.00 H ATOM 517 HA2 GLY A 57 -10.207 -29.717 4.047 1.00 0.00 H ATOM 518 H GLY A 57 -11.625 -27.642 5.530 1.00 0.00 H ATOM 519 N GLN A 58 -13.314 -28.957 3.182 1.00 22.68 N ATOM 520 CA GLN A 58 -14.397 -29.093 2.125 1.00 23.68 C ATOM 521 C GLN A 58 -13.873 -28.713 0.782 1.00 24.28 C ATOM 522 O GLN A 58 -14.019 -29.465 -0.248 1.00 20.92 O ATOM 523 CB GLN A 58 -15.561 -28.123 2.358 1.00 26.88 C ATOM 524 CG GLN A 58 -16.712 -28.516 3.281 1.00 26.82 C ATOM 525 CD GLN A 58 -17.558 -29.688 2.790 1.00 29.83 C ATOM 526 OE1 GLN A 58 -17.074 -30.605 2.102 1.00 28.15 O ATOM 527 NE2 GLN A 58 -18.855 -29.670 3.172 1.00 28.93 N ATOM 528 HA GLN A 58 -14.721 -30.132 2.182 1.00 0.00 H ATOM 529 HB2 GLN A 58 -15.131 -27.207 2.764 1.00 0.00 H ATOM 530 HB3 GLN A 58 -15.998 -27.916 1.381 1.00 0.00 H ATOM 531 HG2 GLN A 58 -16.292 -28.784 4.251 1.00 0.00 H ATOM 532 HG3 GLN A 58 -17.365 -27.651 3.395 1.00 0.00 H ATOM 533 HE22 GLN A 58 -19.217 -28.883 3.747 1.00 0.00 H ATOM 534 HE21 GLN A 58 -19.491 -30.443 2.891 1.00 0.00 H ATOM 535 H GLN A 58 -13.497 -28.345 4.003 1.00 0.00 H ATOM 536 N TYR A 59 -13.315 -27.502 0.797 1.00 24.75 N ATOM 537 CA TYR A 59 -12.610 -26.938 -0.307 1.00 23.44 C ATOM 538 C TYR A 59 -11.592 -27.887 -0.925 1.00 23.39 C ATOM 539 O TYR A 59 -11.593 -28.085 -2.145 1.00 29.82 O ATOM 540 CB TYR A 59 -11.888 -25.700 0.168 1.00 21.96 C ATOM 541 CG TYR A 59 -11.343 -24.867 -0.961 1.00 19.87 C ATOM 542 CD1 TYR A 59 -12.087 -23.829 -1.482 1.00 17.56 C ATOM 543 CD2 TYR A 59 -10.020 -25.044 -1.414 1.00 19.25 C ATOM 544 CE1 TYR A 59 -11.552 -22.992 -2.471 1.00 19.46 C ATOM 545 CE2 TYR A 59 -9.487 -24.246 -2.411 1.00 19.63 C ATOM 546 CZ TYR A 59 -10.255 -23.237 -2.955 1.00 17.84 C ATOM 547 OH TYR A 59 -9.729 -22.423 -3.947 1.00 16.11 O ATOM 548 HA TYR A 59 -13.347 -26.714 -1.078 1.00 0.00 H ATOM 549 HB3 TYR A 59 -11.059 -26.005 0.807 1.00 0.00 H ATOM 550 HB2 TYR A 59 -12.584 -25.091 0.744 1.00 0.00 H ATOM 551 HD2 TYR A 59 -9.404 -25.826 -0.970 1.00 0.00 H ATOM 552 HE2 TYR A 59 -8.469 -24.413 -2.764 1.00 0.00 H ATOM 553 HE1 TYR A 59 -12.136 -22.159 -2.861 1.00 0.00 H ATOM 554 HD1 TYR A 59 -13.101 -23.658 -1.121 1.00 0.00 H ATOM 555 HH TYR A 59 -9.474 -22.977 -4.727 1.00 0.00 H ATOM 556 H TYR A 59 -13.399 -26.935 1.665 1.00 0.00 H ATOM 557 N ILE A 60 -10.721 -28.480 -0.101 1.00 22.35 N ATOM 558 CA ILE A 60 -9.647 -29.339 -0.614 1.00 20.20 C ATOM 559 C ILE A 60 -10.298 -30.587 -1.199 1.00 20.15 C ATOM 560 O ILE A 60 -9.893 -31.105 -2.230 1.00 19.11 O ATOM 561 CB ILE A 60 -8.608 -29.668 0.506 1.00 17.47 C ATOM 562 CG1 ILE A 60 -7.509 -28.545 0.564 1.00 17.02 C ATOM 563 CG2 ILE A 60 -8.243 -31.161 0.407 1.00 17.06 C ATOM 564 CD1 ILE A 60 -6.244 -28.850 1.340 1.00 15.89 C ATOM 565 HA ILE A 60 -9.082 -28.831 -1.395 1.00 0.00 H ATOM 566 HB ILE A 60 -8.981 -29.607 1.529 1.00 0.00 H ATOM 567 HG12 ILE A 60 -7.218 -28.318 -0.462 1.00 0.00 H ATOM 568 HG13 ILE A 60 -7.965 -27.663 1.014 1.00 0.00 H ATOM 569 HD11 ILE A 60 -6.498 -29.062 2.379 1.00 0.00 H ATOM 570 HD12 ILE A 60 -5.751 -29.717 0.902 1.00 0.00 H ATOM 571 HD13 ILE A 60 -5.576 -27.990 1.296 1.00 0.00 H ATOM 572 HG21 ILE A 60 -9.141 -31.763 0.542 1.00 0.00 H ATOM 573 HG22 ILE A 60 -7.812 -31.364 -0.573 1.00 0.00 H ATOM 574 HG23 ILE A 60 -7.518 -31.409 1.182 1.00 0.00 H ATOM 575 H ILE A 60 -10.807 -28.329 0.924 1.00 0.00 H ATOM 576 N MET A 61 -11.396 -31.020 -0.599 1.00 25.24 N ATOM 577 CA MET A 61 -12.011 -32.276 -0.987 1.00 24.15 C ATOM 578 C MET A 61 -12.778 -32.125 -2.281 1.00 23.68 C ATOM 579 O MET A 61 -12.603 -32.915 -3.145 1.00 24.86 O ATOM 580 CB MET A 61 -12.914 -32.899 0.101 1.00 25.92 C ATOM 581 CG MET A 61 -13.180 -34.392 -0.165 1.00 26.16 C ATOM 582 SD MET A 61 -14.675 -35.120 0.566 1.00 30.64 S ATOM 583 CE MET A 61 -16.029 -34.109 -0.079 1.00 23.09 C ATOM 584 HA MET A 61 -11.184 -32.972 -1.130 1.00 0.00 H ATOM 585 HB2 MET A 61 -12.424 -32.794 1.069 1.00 0.00 H ATOM 586 HB3 MET A 61 -13.866 -32.368 0.117 1.00 0.00 H ATOM 587 HG2 MET A 61 -12.325 -34.950 0.217 1.00 0.00 H ATOM 588 HG3 MET A 61 -13.246 -34.525 -1.245 1.00 0.00 H ATOM 589 HE1 MET A 61 -15.887 -33.073 0.230 1.00 0.00 H ATOM 590 HE2 MET A 61 -16.037 -34.167 -1.167 1.00 0.00 H ATOM 591 HE3 MET A 61 -16.976 -34.480 0.313 1.00 0.00 H ATOM 592 H MET A 61 -11.823 -30.452 0.160 1.00 0.00 H ATOM 593 N VAL A 62 -13.631 -31.118 -2.360 1.00 22.41 N ATOM 594 CA VAL A 62 -14.398 -30.771 -3.537 1.00 24.92 C ATOM 595 C VAL A 62 -13.533 -30.189 -4.674 1.00 25.03 C ATOM 596 O VAL A 62 -13.624 -30.729 -5.757 1.00 25.98 O ATOM 597 CB VAL A 62 -15.729 -30.084 -3.150 1.00 25.21 C ATOM 598 CG1 VAL A 62 -16.314 -29.262 -4.269 1.00 23.51 C ATOM 599 CG2 VAL A 62 -16.711 -31.177 -2.690 1.00 25.57 C ATOM 600 HA VAL A 62 -14.754 -31.669 -4.041 1.00 0.00 H ATOM 601 HB VAL A 62 -15.536 -29.377 -2.343 1.00 0.00 H ATOM 602 HG11 VAL A 62 -15.608 -28.482 -4.552 1.00 0.00 H ATOM 603 HG12 VAL A 62 -16.510 -29.905 -5.127 1.00 0.00 H ATOM 604 HG13 VAL A 62 -17.246 -28.806 -3.935 1.00 0.00 H ATOM 605 HG21 VAL A 62 -16.874 -31.883 -3.504 1.00 0.00 H ATOM 606 HG22 VAL A 62 -16.293 -31.701 -1.831 1.00 0.00 H ATOM 607 HG23 VAL A 62 -17.659 -30.718 -2.411 1.00 0.00 H ATOM 608 H VAL A 62 -13.761 -30.531 -1.512 1.00 0.00 H ATOM 609 N LYS A 63 -12.686 -29.164 -4.438 1.00 25.20 N ATOM 610 CA LYS A 63 -11.568 -28.837 -5.386 1.00 22.16 C ATOM 611 C LYS A 63 -10.633 -30.057 -5.672 1.00 22.54 C ATOM 612 O LYS A 63 -9.840 -30.049 -6.637 1.00 23.85 O ATOM 613 CB LYS A 63 -10.750 -27.600 -4.954 1.00 25.19 C ATOM 614 CG LYS A 63 -11.483 -26.242 -4.884 1.00 21.51 C ATOM 615 CD LYS A 63 -11.643 -25.561 -6.234 1.00 24.00 C ATOM 616 CE LYS A 63 -10.336 -25.081 -6.867 1.00 19.28 C ATOM 617 NZ LYS A 63 -9.984 -23.783 -6.150 1.00 20.55 N ATOM 618 HA LYS A 63 -12.062 -28.583 -6.324 1.00 0.00 H ATOM 619 HB2 LYS A 63 -10.349 -27.805 -3.961 1.00 0.00 H ATOM 620 HB3 LYS A 63 -9.928 -27.490 -5.661 1.00 0.00 H ATOM 621 HG2 LYS A 63 -12.475 -26.408 -4.463 1.00 0.00 H ATOM 622 HG3 LYS A 63 -10.917 -25.579 -4.229 1.00 0.00 H ATOM 623 HD2 LYS A 63 -12.112 -26.268 -6.918 1.00 0.00 H ATOM 624 HD3 LYS A 63 -12.295 -24.697 -6.104 1.00 0.00 H ATOM 625 HE2 LYS A 63 -10.473 -24.902 -7.933 1.00 0.00 H ATOM 626 HE3 LYS A 63 -9.549 -25.821 -6.723 1.00 0.00 H ATOM 627 HZ1 LYS A 63 -10.749 -23.093 -6.290 1.00 0.00 H ATOM 628 HZ2 LYS A 63 -9.867 -23.971 -5.134 1.00 0.00 H ATOM 629 HZ3 LYS A 63 -9.097 -23.403 -6.538 1.00 0.00 H ATOM 630 H LYS A 63 -12.811 -28.588 -3.581 1.00 0.00 H ATOM 631 N GLN A 64 -10.747 -31.126 -4.874 1.00 26.03 N ATOM 632 CA GLN A 64 -10.053 -32.431 -5.150 1.00 23.57 C ATOM 633 C GLN A 64 -8.498 -32.235 -5.290 1.00 20.02 C ATOM 634 O GLN A 64 -7.777 -32.868 -6.107 1.00 18.65 O ATOM 635 CB GLN A 64 -10.757 -33.205 -6.313 1.00 22.53 C ATOM 636 CG GLN A 64 -9.946 -33.721 -7.514 1.00 26.38 C ATOM 637 CD GLN A 64 -10.736 -34.750 -8.409 1.00 28.19 C ATOM 638 OE1 GLN A 64 -11.124 -34.455 -9.551 1.00 19.81 O ATOM 639 NE2 GLN A 64 -10.957 -35.956 -7.882 1.00 24.48 N ATOM 640 HA GLN A 64 -10.155 -33.092 -4.289 1.00 0.00 H ATOM 641 HB2 GLN A 64 -11.237 -34.075 -5.864 1.00 0.00 H ATOM 642 HB3 GLN A 64 -11.520 -32.538 -6.715 1.00 0.00 H ATOM 643 HG2 GLN A 64 -9.665 -32.869 -8.133 1.00 0.00 H ATOM 644 HG3 GLN A 64 -9.046 -34.209 -7.139 1.00 0.00 H ATOM 645 HE22 GLN A 64 -10.620 -36.174 -6.923 1.00 0.00 H ATOM 646 HE21 GLN A 64 -11.466 -36.678 -8.431 1.00 0.00 H ATOM 647 H GLN A 64 -11.343 -31.050 -4.025 1.00 0.00 H ATOM 648 N LEU A 65 -8.019 -31.380 -4.412 1.00 20.54 N ATOM 649 CA LEU A 65 -6.684 -30.831 -4.376 1.00 21.69 C ATOM 650 C LEU A 65 -5.621 -31.767 -3.845 1.00 21.53 C ATOM 651 O LEU A 65 -4.423 -31.551 -4.071 1.00 25.27 O ATOM 652 CB LEU A 65 -6.704 -29.587 -3.474 1.00 19.62 C ATOM 653 CG LEU A 65 -7.401 -28.348 -4.035 1.00 18.28 C ATOM 654 CD1 LEU A 65 -7.230 -27.195 -3.075 1.00 19.67 C ATOM 655 CD2 LEU A 65 -6.769 -28.041 -5.370 1.00 17.61 C ATOM 656 HA LEU A 65 -6.418 -30.616 -5.411 1.00 0.00 H ATOM 657 HB2 LEU A 65 -7.207 -29.859 -2.546 1.00 0.00 H ATOM 658 HB3 LEU A 65 -5.670 -29.317 -3.259 1.00 0.00 H ATOM 659 HG LEU A 65 -8.470 -28.517 -4.163 1.00 0.00 H ATOM 660 HD21 LEU A 65 -5.705 -27.851 -5.232 1.00 0.00 H ATOM 661 HD22 LEU A 65 -6.904 -28.891 -6.039 1.00 0.00 H ATOM 662 HD23 LEU A 65 -7.243 -27.159 -5.801 1.00 0.00 H ATOM 663 HD11 LEU A 65 -7.671 -27.456 -2.113 1.00 0.00 H ATOM 664 HD12 LEU A 65 -6.168 -26.987 -2.944 1.00 0.00 H ATOM 665 HD13 LEU A 65 -7.728 -26.312 -3.477 1.00 0.00 H ATOM 666 H LEU A 65 -8.671 -31.066 -3.665 1.00 0.00 H ATOM 667 N TYR A 66 -6.052 -32.783 -3.117 1.00 21.81 N ATOM 668 CA TYR A 66 -5.137 -33.781 -2.572 1.00 24.16 C ATOM 669 C TYR A 66 -4.679 -34.699 -3.671 1.00 23.76 C ATOM 670 O TYR A 66 -5.262 -34.703 -4.733 1.00 29.51 O ATOM 671 CB TYR A 66 -5.855 -34.645 -1.546 1.00 23.06 C ATOM 672 CG TYR A 66 -6.982 -35.405 -2.133 1.00 21.29 C ATOM 673 CD1 TYR A 66 -6.827 -36.735 -2.605 1.00 22.64 C ATOM 674 CD2 TYR A 66 -8.220 -34.802 -2.227 1.00 24.61 C ATOM 675 CE1 TYR A 66 -7.913 -37.421 -3.191 1.00 25.71 C ATOM 676 CE2 TYR A 66 -9.308 -35.459 -2.774 1.00 25.59 C ATOM 677 CZ TYR A 66 -9.166 -36.768 -3.225 1.00 29.14 C ATOM 678 OH TYR A 66 -10.304 -37.387 -3.705 1.00 26.08 O ATOM 679 HA TYR A 66 -4.296 -33.257 -2.117 1.00 0.00 H ATOM 680 HB3 TYR A 66 -6.241 -34.001 -0.756 1.00 0.00 H ATOM 681 HB2 TYR A 66 -5.141 -35.351 -1.122 1.00 0.00 H ATOM 682 HD2 TYR A 66 -8.344 -33.783 -1.861 1.00 0.00 H ATOM 683 HE2 TYR A 66 -10.271 -34.954 -2.851 1.00 0.00 H ATOM 684 HE1 TYR A 66 -7.789 -38.422 -3.604 1.00 0.00 H ATOM 685 HD1 TYR A 66 -5.861 -37.231 -2.514 1.00 0.00 H ATOM 686 HH TYR A 66 -10.081 -38.307 -3.995 1.00 0.00 H ATOM 687 H TYR A 66 -7.071 -32.874 -2.928 1.00 0.00 H ATOM 688 N ASP A 67 -3.642 -35.478 -3.377 1.00 29.82 N ATOM 689 CA ASP A 67 -2.923 -36.331 -4.331 1.00 31.52 C ATOM 690 C ASP A 67 -3.505 -37.767 -4.386 1.00 33.11 C ATOM 691 O ASP A 67 -3.613 -38.460 -3.352 1.00 31.52 O ATOM 692 CB ASP A 67 -1.432 -36.304 -3.963 1.00 32.55 C ATOM 693 CG ASP A 67 -0.547 -36.777 -5.079 1.00 34.68 C ATOM 694 OD1 ASP A 67 -0.234 -35.938 -5.986 1.00 31.40 O ATOM 695 OD2 ASP A 67 -0.194 -37.998 -5.050 1.00 32.45 O ATOM 696 HA ASP A 67 -3.048 -35.943 -5.342 1.00 0.00 H ATOM 697 HB2 ASP A 67 -1.155 -35.281 -3.708 1.00 0.00 H ATOM 698 HB3 ASP A 67 -1.275 -36.948 -3.098 1.00 0.00 H ATOM 699 H ASP A 67 -3.314 -35.483 -2.390 1.00 0.00 H ATOM 700 N GLN A 68 -3.891 -38.232 -5.583 1.00 29.07 N ATOM 701 CA GLN A 68 -4.591 -39.507 -5.670 1.00 28.64 C ATOM 702 C GLN A 68 -3.777 -40.651 -5.028 1.00 32.82 C ATOM 703 O GLN A 68 -4.334 -41.609 -4.431 1.00 29.90 O ATOM 704 CB GLN A 68 -5.050 -39.838 -7.093 1.00 26.17 C ATOM 705 CG GLN A 68 -6.235 -40.828 -7.044 1.00 25.25 C ATOM 706 CD GLN A 68 -7.002 -41.062 -8.360 1.00 24.16 C ATOM 707 OE1 GLN A 68 -7.446 -40.116 -9.034 1.00 27.12 O ATOM 708 NE2 GLN A 68 -7.188 -42.352 -8.720 1.00 23.23 N ATOM 709 HA GLN A 68 -5.504 -39.401 -5.085 1.00 0.00 H ATOM 710 HB2 GLN A 68 -5.364 -38.922 -7.595 1.00 0.00 H ATOM 711 HB3 GLN A 68 -4.224 -40.288 -7.644 1.00 0.00 H ATOM 712 HG2 GLN A 68 -5.847 -41.791 -6.713 1.00 0.00 H ATOM 713 HG3 GLN A 68 -6.948 -40.453 -6.309 1.00 0.00 H ATOM 714 HE22 GLN A 68 -6.802 -43.117 -8.131 1.00 0.00 H ATOM 715 HE21 GLN A 68 -7.717 -42.579 -9.586 1.00 0.00 H ATOM 716 H GLN A 68 -3.692 -37.685 -6.445 1.00 0.00 H ATOM 717 N GLN A 69 -2.454 -40.498 -5.102 1.00 31.32 N ATOM 718 CA GLN A 69 -1.491 -41.427 -4.547 1.00 28.32 C ATOM 719 C GLN A 69 -0.755 -40.949 -3.270 1.00 29.01 C ATOM 720 O GLN A 69 -0.159 -41.763 -2.589 1.00 29.15 O ATOM 721 CB GLN A 69 -0.448 -41.790 -5.635 1.00 31.55 C ATOM 722 CG GLN A 69 -0.684 -43.125 -6.338 1.00 31.16 C ATOM 723 CD GLN A 69 -1.857 -43.119 -7.288 1.00 33.20 C ATOM 724 OE1 GLN A 69 -1.975 -42.222 -8.137 1.00 35.71 O ATOM 725 NE2 GLN A 69 -2.729 -44.146 -7.173 1.00 31.29 N ATOM 726 HA GLN A 69 -2.075 -42.292 -4.232 1.00 0.00 H ATOM 727 HB2 GLN A 69 -0.459 -41.004 -6.390 1.00 0.00 H ATOM 728 HB3 GLN A 69 0.534 -41.825 -5.164 1.00 0.00 H ATOM 729 HG2 GLN A 69 0.213 -43.379 -6.902 1.00 0.00 H ATOM 730 HG3 GLN A 69 -0.862 -43.886 -5.578 1.00 0.00 H ATOM 731 HE22 GLN A 69 -2.584 -44.872 -6.443 1.00 0.00 H ATOM 732 HE21 GLN A 69 -3.545 -44.210 -7.814 1.00 0.00 H ATOM 733 H GLN A 69 -2.090 -39.655 -5.591 1.00 0.00 H ATOM 734 N GLU A 70 -0.763 -39.647 -2.978 1.00 29.15 N ATOM 735 CA GLU A 70 -0.157 -39.127 -1.739 1.00 27.96 C ATOM 736 C GLU A 70 -1.262 -38.472 -0.925 1.00 29.24 C ATOM 737 O GLU A 70 -1.278 -37.255 -0.709 1.00 26.66 O ATOM 738 CB GLU A 70 1.033 -38.188 -2.008 1.00 32.59 C ATOM 739 CG GLU A 70 1.970 -38.029 -0.799 1.00 31.04 C ATOM 740 CD GLU A 70 3.258 -38.830 -0.904 1.00 33.20 C ATOM 741 OE1 GLU A 70 3.715 -39.059 -2.051 1.00 33.28 O ATOM 742 OE2 GLU A 70 3.854 -39.186 0.155 1.00 29.97 O ATOM 743 HA GLU A 70 0.278 -39.947 -1.167 1.00 0.00 H ATOM 744 HB2 GLU A 70 1.609 -38.590 -2.842 1.00 0.00 H ATOM 745 HB3 GLU A 70 0.645 -37.205 -2.276 1.00 0.00 H ATOM 746 HG2 GLU A 70 2.229 -36.975 -0.702 1.00 0.00 H ATOM 747 HG3 GLU A 70 1.436 -38.354 0.094 1.00 0.00 H ATOM 748 H GLU A 70 -1.208 -38.982 -3.642 1.00 0.00 H ATOM 749 N GLN A 71 -2.167 -39.333 -0.461 1.00 26.93 N ATOM 750 CA GLN A 71 -3.518 -38.967 -0.088 1.00 30.62 C ATOM 751 C GLN A 71 -3.553 -37.861 0.945 1.00 28.35 C ATOM 752 O GLN A 71 -4.529 -37.144 0.987 1.00 28.89 O ATOM 753 CB GLN A 71 -4.324 -40.176 0.372 1.00 28.85 C ATOM 754 CG GLN A 71 -4.923 -41.021 -0.786 1.00 32.37 C ATOM 755 CD GLN A 71 -6.174 -40.467 -1.457 1.00 30.49 C ATOM 756 OE1 GLN A 71 -7.296 -40.691 -1.014 1.00 31.44 O ATOM 757 NE2 GLN A 71 -5.987 -39.831 -2.572 1.00 28.95 N ATOM 758 HA GLN A 71 -3.990 -38.576 -0.989 1.00 0.00 H ATOM 759 HB2 GLN A 71 -3.670 -40.819 0.962 1.00 0.00 H ATOM 760 HB3 GLN A 71 -5.144 -39.823 0.997 1.00 0.00 H ATOM 761 HG2 GLN A 71 -4.155 -41.125 -1.552 1.00 0.00 H ATOM 762 HG3 GLN A 71 -5.170 -42.004 -0.385 1.00 0.00 H ATOM 763 HE22 GLN A 71 -5.021 -39.659 -2.917 1.00 0.00 H ATOM 764 HE21 GLN A 71 -6.803 -39.493 -3.121 1.00 0.00 H ATOM 765 H GLN A 71 -1.886 -40.329 -0.360 1.00 0.00 H ATOM 766 N HIS A 72 -2.485 -37.766 1.765 1.00 31.25 N ATOM 767 CA HIS A 72 -2.260 -36.714 2.802 1.00 27.40 C ATOM 768 C HIS A 72 -1.656 -35.447 2.274 1.00 23.72 C ATOM 769 O HIS A 72 -1.751 -34.404 2.932 1.00 21.20 O ATOM 770 CB HIS A 72 -1.354 -37.219 3.942 1.00 24.63 C ATOM 771 CG HIS A 72 0.127 -37.304 3.571 1.00 25.90 C ATOM 772 ND1 HIS A 72 0.971 -36.249 3.691 1.00 27.33 N ATOM 773 CD2 HIS A 72 0.882 -38.355 3.040 1.00 25.91 C ATOM 774 CE1 HIS A 72 2.211 -36.624 3.275 1.00 27.19 C ATOM 775 NE2 HIS A 72 2.143 -37.904 2.856 1.00 25.84 N ATOM 776 HA HIS A 72 -3.262 -36.491 3.168 1.00 0.00 H ATOM 777 HB2 HIS A 72 -1.457 -36.539 4.788 1.00 0.00 H ATOM 778 HB3 HIS A 72 -1.692 -38.214 4.233 1.00 0.00 H ATOM 779 HD2 HIS A 72 0.519 -39.358 2.815 1.00 0.00 H ATOM 780 HE1 HIS A 72 3.104 -35.999 3.280 1.00 0.00 H ATOM 781 H HIS A 72 -1.749 -38.494 1.666 1.00 0.00 H ATOM 782 N MET A 73 -1.025 -35.507 1.092 1.00 28.43 N ATOM 783 CA MET A 73 -0.369 -34.346 0.454 1.00 26.19 C ATOM 784 C MET A 73 -1.350 -33.454 -0.271 1.00 26.92 C ATOM 785 O MET A 73 -2.060 -33.916 -1.171 1.00 29.29 O ATOM 786 CB MET A 73 0.616 -34.814 -0.626 1.00 26.91 C ATOM 787 CG MET A 73 1.911 -35.433 -0.143 1.00 27.77 C ATOM 788 SD MET A 73 2.807 -34.321 0.949 1.00 34.99 S ATOM 789 CE MET A 73 4.400 -35.128 1.022 1.00 26.64 C ATOM 790 HA MET A 73 0.118 -33.806 1.266 1.00 0.00 H ATOM 791 HB2 MET A 73 0.105 -35.555 -1.241 1.00 0.00 H ATOM 792 HB3 MET A 73 0.871 -33.949 -1.238 1.00 0.00 H ATOM 793 HG2 MET A 73 2.537 -35.663 -1.005 1.00 0.00 H ATOM 794 HG3 MET A 73 1.685 -36.353 0.396 1.00 0.00 H ATOM 795 HE1 MET A 73 4.279 -36.133 1.427 1.00 0.00 H ATOM 796 HE2 MET A 73 4.822 -35.188 0.019 1.00 0.00 H ATOM 797 HE3 MET A 73 5.068 -34.554 1.665 1.00 0.00 H ATOM 798 H MET A 73 -0.996 -36.421 0.597 1.00 0.00 H ATOM 799 N VAL A 74 -1.406 -32.182 0.110 1.00 31.94 N ATOM 800 CA VAL A 74 -2.200 -31.241 -0.659 1.00 30.81 C ATOM 801 C VAL A 74 -1.400 -30.551 -1.770 1.00 30.86 C ATOM 802 O VAL A 74 -0.429 -29.815 -1.525 1.00 30.18 O ATOM 803 CB VAL A 74 -2.876 -30.230 0.242 1.00 33.21 C ATOM 804 CG1 VAL A 74 -3.051 -28.901 -0.471 1.00 32.30 C ATOM 805 CG2 VAL A 74 -4.181 -30.821 0.812 1.00 27.53 C ATOM 806 HA VAL A 74 -2.974 -31.825 -1.157 1.00 0.00 H ATOM 807 HB VAL A 74 -2.240 -30.013 1.100 1.00 0.00 H ATOM 808 HG11 VAL A 74 -2.074 -28.515 -0.762 1.00 0.00 H ATOM 809 HG12 VAL A 74 -3.665 -29.045 -1.360 1.00 0.00 H ATOM 810 HG13 VAL A 74 -3.539 -28.193 0.198 1.00 0.00 H ATOM 811 HG21 VAL A 74 -4.852 -31.076 -0.009 1.00 0.00 H ATOM 812 HG22 VAL A 74 -3.951 -31.718 1.387 1.00 0.00 H ATOM 813 HG23 VAL A 74 -4.659 -30.086 1.459 1.00 0.00 H ATOM 814 H VAL A 74 -0.885 -31.863 0.952 1.00 0.00 H ATOM 815 N TYR A 75 -1.841 -30.763 -3.006 1.00 33.96 N ATOM 816 CA TYR A 75 -1.299 -29.954 -4.104 1.00 29.88 C ATOM 817 C TYR A 75 -2.283 -28.889 -4.611 1.00 35.76 C ATOM 818 O TYR A 75 -3.275 -29.172 -5.310 1.00 31.31 O ATOM 819 CB TYR A 75 -0.706 -30.819 -5.210 1.00 28.67 C ATOM 820 CG TYR A 75 0.421 -31.695 -4.724 1.00 27.28 C ATOM 821 CD1 TYR A 75 0.160 -32.870 -4.008 1.00 24.85 C ATOM 822 CD2 TYR A 75 1.792 -31.293 -4.892 1.00 26.03 C ATOM 823 CE1 TYR A 75 1.216 -33.673 -3.541 1.00 22.95 C ATOM 824 CE2 TYR A 75 2.821 -32.067 -4.413 1.00 23.23 C ATOM 825 CZ TYR A 75 2.543 -33.252 -3.746 1.00 23.67 C ATOM 826 OH TYR A 75 3.574 -34.067 -3.271 1.00 30.05 O ATOM 827 HA TYR A 75 -0.467 -29.384 -3.692 1.00 0.00 H ATOM 828 HB3 TYR A 75 -0.327 -30.167 -5.997 1.00 0.00 H ATOM 829 HB2 TYR A 75 -1.493 -31.455 -5.615 1.00 0.00 H ATOM 830 HD2 TYR A 75 2.018 -30.360 -5.407 1.00 0.00 H ATOM 831 HE2 TYR A 75 3.854 -31.751 -4.557 1.00 0.00 H ATOM 832 HE1 TYR A 75 1.009 -34.611 -3.026 1.00 0.00 H ATOM 833 HD1 TYR A 75 -0.871 -33.165 -3.811 1.00 0.00 H ATOM 834 HH TYR A 75 3.186 -34.862 -2.826 1.00 0.00 H ATOM 835 H TYR A 75 -2.560 -31.491 -3.192 1.00 0.00 H ATOM 836 N CYS A 76 -1.980 -27.657 -4.223 1.00 39.96 N ATOM 837 CA CYS A 76 -2.749 -26.490 -4.586 1.00 38.92 C ATOM 838 C CYS A 76 -1.852 -25.498 -5.291 1.00 39.42 C ATOM 839 O CYS A 76 -1.819 -24.316 -4.909 1.00 45.46 O ATOM 840 CB CYS A 76 -3.247 -25.842 -3.310 1.00 41.34 C ATOM 841 SG CYS A 76 -1.905 -25.347 -2.217 1.00 45.05 S ATOM 842 HA CYS A 76 -3.576 -26.776 -5.236 1.00 0.00 H ATOM 843 HB2 CYS A 76 -3.884 -26.552 -2.783 1.00 0.00 H ATOM 844 HB3 CYS A 76 -3.829 -24.958 -3.571 1.00 0.00 H ATOM 845 HG CYS A 76 -1.096 -24.438 -2.867 1.00 0.00 H ATOM 846 H CYS A 76 -1.141 -27.524 -3.623 1.00 0.00 H ATOM 847 N GLY A 77 -1.117 -25.947 -6.304 1.00 38.04 N ATOM 848 CA GLY A 77 -0.359 -25.008 -7.137 1.00 36.84 C ATOM 849 C GLY A 77 -1.375 -24.107 -7.827 1.00 38.94 C ATOM 850 O GLY A 77 -2.484 -24.549 -8.121 1.00 41.80 O ATOM 851 HA3 GLY A 77 0.225 -25.552 -7.879 1.00 0.00 H ATOM 852 HA2 GLY A 77 0.310 -24.412 -6.516 1.00 0.00 H ATOM 853 H GLY A 77 -1.080 -26.967 -6.506 1.00 0.00 H ATOM 854 N GLY A 78 -1.012 -22.847 -8.063 1.00 42.52 N ATOM 855 CA GLY A 78 -1.832 -21.914 -8.879 1.00 41.34 C ATOM 856 C GLY A 78 -3.287 -21.822 -8.450 1.00 37.09 C ATOM 857 O GLY A 78 -4.157 -21.326 -9.178 1.00 28.56 O ATOM 858 HA3 GLY A 78 -1.802 -22.250 -9.916 1.00 0.00 H ATOM 859 HA2 GLY A 78 -1.391 -20.920 -8.808 1.00 0.00 H ATOM 860 H GLY A 78 -0.118 -22.502 -7.659 1.00 0.00 H ATOM 861 N ASP A 79 -3.534 -22.334 -7.256 1.00 39.14 N ATOM 862 CA ASP A 79 -4.842 -22.395 -6.695 1.00 41.11 C ATOM 863 C ASP A 79 -4.841 -21.475 -5.475 1.00 40.17 C ATOM 864 O ASP A 79 -3.830 -21.386 -4.773 1.00 42.35 O ATOM 865 CB ASP A 79 -5.144 -23.839 -6.322 1.00 40.46 C ATOM 866 CG ASP A 79 -6.339 -23.968 -5.426 1.00 39.89 C ATOM 867 OD1 ASP A 79 -7.379 -23.308 -5.684 1.00 40.96 O ATOM 868 OD2 ASP A 79 -6.226 -24.734 -4.449 1.00 41.70 O ATOM 869 HA ASP A 79 -5.614 -22.069 -7.392 1.00 0.00 H ATOM 870 HB2 ASP A 79 -5.330 -24.404 -7.236 1.00 0.00 H ATOM 871 HB3 ASP A 79 -4.277 -24.256 -5.809 1.00 0.00 H ATOM 872 H ASP A 79 -2.738 -22.709 -6.702 1.00 0.00 H ATOM 873 N LEU A 80 -5.971 -20.803 -5.226 1.00 35.61 N ATOM 874 CA LEU A 80 -6.024 -19.688 -4.260 1.00 35.07 C ATOM 875 C LEU A 80 -5.696 -20.018 -2.792 1.00 34.22 C ATOM 876 O LEU A 80 -5.221 -19.143 -2.018 1.00 38.79 O ATOM 877 CB LEU A 80 -7.383 -18.954 -4.382 1.00 33.15 C ATOM 878 CG LEU A 80 -7.371 -17.438 -4.132 1.00 32.60 C ATOM 879 CD1 LEU A 80 -6.412 -16.683 -5.060 1.00 26.12 C ATOM 880 CD2 LEU A 80 -8.774 -16.853 -4.257 1.00 30.32 C ATOM 881 HA LEU A 80 -5.199 -19.037 -4.549 1.00 0.00 H ATOM 882 HB2 LEU A 80 -7.759 -19.120 -5.391 1.00 0.00 H ATOM 883 HB3 LEU A 80 -8.067 -19.403 -3.662 1.00 0.00 H ATOM 884 HG LEU A 80 -7.009 -17.305 -3.113 1.00 0.00 H ATOM 885 HD21 LEU A 80 -9.156 -17.040 -5.261 1.00 0.00 H ATOM 886 HD22 LEU A 80 -9.429 -17.324 -3.524 1.00 0.00 H ATOM 887 HD23 LEU A 80 -8.736 -15.779 -4.075 1.00 0.00 H ATOM 888 HD11 LEU A 80 -5.397 -17.051 -4.909 1.00 0.00 H ATOM 889 HD12 LEU A 80 -6.708 -16.845 -6.096 1.00 0.00 H ATOM 890 HD13 LEU A 80 -6.451 -15.618 -4.832 1.00 0.00 H ATOM 891 H LEU A 80 -6.840 -21.075 -5.729 1.00 0.00 H ATOM 892 N LEU A 81 -5.910 -21.272 -2.409 1.00 38.14 N ATOM 893 CA LEU A 81 -5.336 -21.787 -1.159 1.00 37.66 C ATOM 894 C LEU A 81 -3.821 -21.554 -1.193 1.00 41.90 C ATOM 895 O LEU A 81 -3.265 -20.815 -0.369 1.00 40.30 O ATOM 896 CB LEU A 81 -5.633 -23.282 -1.033 1.00 34.47 C ATOM 897 CG LEU A 81 -5.261 -24.109 0.215 1.00 31.57 C ATOM 898 CD1 LEU A 81 -6.257 -23.956 1.355 1.00 26.68 C ATOM 899 CD2 LEU A 81 -5.084 -25.579 -0.129 1.00 26.71 C ATOM 900 HA LEU A 81 -5.772 -21.273 -0.303 1.00 0.00 H ATOM 901 HB2 LEU A 81 -6.712 -23.385 -1.152 1.00 0.00 H ATOM 902 HB3 LEU A 81 -5.129 -23.761 -1.872 1.00 0.00 H ATOM 903 HG LEU A 81 -4.310 -23.706 0.564 1.00 0.00 H ATOM 904 HD21 LEU A 81 -6.015 -25.969 -0.539 1.00 0.00 H ATOM 905 HD22 LEU A 81 -4.288 -25.685 -0.866 1.00 0.00 H ATOM 906 HD23 LEU A 81 -4.822 -26.133 0.773 1.00 0.00 H ATOM 907 HD11 LEU A 81 -6.305 -22.909 1.656 1.00 0.00 H ATOM 908 HD12 LEU A 81 -7.241 -24.286 1.023 1.00 0.00 H ATOM 909 HD13 LEU A 81 -5.935 -24.564 2.201 1.00 0.00 H ATOM 910 H LEU A 81 -6.492 -21.897 -3.002 1.00 0.00 H ATOM 911 N GLY A 82 -3.168 -22.223 -2.151 1.00 43.16 N ATOM 912 CA GLY A 82 -1.745 -22.037 -2.438 1.00 38.00 C ATOM 913 C GLY A 82 -1.422 -20.576 -2.270 1.00 39.28 C ATOM 914 O GLY A 82 -0.625 -20.233 -1.430 1.00 37.45 O ATOM 915 HA3 GLY A 82 -1.530 -22.348 -3.460 1.00 0.00 H ATOM 916 HA2 GLY A 82 -1.147 -22.630 -1.746 1.00 0.00 H ATOM 917 H GLY A 82 -3.700 -22.911 -2.721 1.00 0.00 H ATOM 918 N GLU A 83 -2.084 -19.710 -3.046 1.00 42.60 N ATOM 919 CA GLU A 83 -1.903 -18.261 -2.929 1.00 41.55 C ATOM 920 C GLU A 83 -1.800 -17.887 -1.446 1.00 44.67 C ATOM 921 O GLU A 83 -0.768 -17.367 -0.962 1.00 44.29 O ATOM 922 CB GLU A 83 -3.057 -17.516 -3.622 1.00 44.09 C ATOM 923 CG GLU A 83 -3.176 -16.004 -3.355 1.00 41.50 C ATOM 924 CD GLU A 83 -2.564 -15.110 -4.456 1.00 41.66 C ATOM 925 OE1 GLU A 83 -2.105 -15.635 -5.504 1.00 32.24 O ATOM 926 OE2 GLU A 83 -2.538 -13.853 -4.272 1.00 39.24 O ATOM 927 HA GLU A 83 -0.981 -17.963 -3.429 1.00 0.00 H ATOM 928 HB2 GLU A 83 -2.937 -17.652 -4.697 1.00 0.00 H ATOM 929 HB3 GLU A 83 -3.989 -17.981 -3.300 1.00 0.00 H ATOM 930 HG2 GLU A 83 -4.233 -15.756 -3.263 1.00 0.00 H ATOM 931 HG3 GLU A 83 -2.669 -15.783 -2.416 1.00 0.00 H ATOM 932 H GLU A 83 -2.749 -20.078 -3.756 1.00 0.00 H ATOM 933 N LEU A 84 -2.862 -18.219 -0.725 1.00 41.69 N ATOM 934 CA LEU A 84 -2.972 -17.899 0.675 1.00 36.69 C ATOM 935 C LEU A 84 -1.918 -18.623 1.543 1.00 37.54 C ATOM 936 O LEU A 84 -1.309 -18.003 2.422 1.00 40.92 O ATOM 937 CB LEU A 84 -4.386 -18.234 1.136 1.00 30.83 C ATOM 938 CG LEU A 84 -5.114 -17.117 1.821 1.00 29.02 C ATOM 939 CD1 LEU A 84 -6.244 -17.698 2.671 1.00 21.58 C ATOM 940 CD2 LEU A 84 -4.119 -16.275 2.629 1.00 25.74 C ATOM 941 HA LEU A 84 -2.774 -16.835 0.801 1.00 0.00 H ATOM 942 HB2 LEU A 84 -4.966 -18.528 0.261 1.00 0.00 H ATOM 943 HB3 LEU A 84 -4.325 -19.073 1.829 1.00 0.00 H ATOM 944 HG LEU A 84 -5.573 -16.448 1.094 1.00 0.00 H ATOM 945 HD21 LEU A 84 -3.635 -16.904 3.375 1.00 0.00 H ATOM 946 HD22 LEU A 84 -3.367 -15.861 1.958 1.00 0.00 H ATOM 947 HD23 LEU A 84 -4.651 -15.464 3.126 1.00 0.00 H ATOM 948 HD11 LEU A 84 -6.935 -18.246 2.030 1.00 0.00 H ATOM 949 HD12 LEU A 84 -5.825 -18.374 3.417 1.00 0.00 H ATOM 950 HD13 LEU A 84 -6.775 -16.888 3.170 1.00 0.00 H ATOM 951 H LEU A 84 -3.643 -18.728 -1.186 1.00 0.00 H ATOM 952 N LEU A 85 -1.681 -19.914 1.305 1.00 37.76 N ATOM 953 CA LEU A 85 -0.593 -20.593 2.015 1.00 33.65 C ATOM 954 C LEU A 85 0.794 -20.155 1.502 1.00 33.63 C ATOM 955 O LEU A 85 1.763 -20.117 2.304 1.00 34.63 O ATOM 956 CB LEU A 85 -0.747 -22.122 2.037 1.00 33.41 C ATOM 957 CG LEU A 85 -2.192 -22.650 1.987 1.00 31.01 C ATOM 958 CD1 LEU A 85 -2.156 -24.140 1.798 1.00 29.07 C ATOM 959 CD2 LEU A 85 -3.074 -22.288 3.201 1.00 30.42 C ATOM 960 HA LEU A 85 -0.667 -20.272 3.054 1.00 0.00 H ATOM 961 HB2 LEU A 85 -0.213 -22.525 1.176 1.00 0.00 H ATOM 962 HB3 LEU A 85 -0.287 -22.492 2.953 1.00 0.00 H ATOM 963 HG LEU A 85 -2.667 -22.147 1.145 1.00 0.00 H ATOM 964 HD21 LEU A 85 -2.628 -22.697 4.108 1.00 0.00 H ATOM 965 HD22 LEU A 85 -3.145 -21.204 3.287 1.00 0.00 H ATOM 966 HD23 LEU A 85 -4.070 -22.709 3.063 1.00 0.00 H ATOM 967 HD11 LEU A 85 -1.644 -24.374 0.865 1.00 0.00 H ATOM 968 HD12 LEU A 85 -1.623 -24.598 2.631 1.00 0.00 H ATOM 969 HD13 LEU A 85 -3.175 -24.525 1.761 1.00 0.00 H ATOM 970 H LEU A 85 -2.264 -20.436 0.620 1.00 0.00 H ATOM 971 N GLY A 86 0.888 -19.816 0.205 1.00 26.08 N ATOM 972 CA GLY A 86 2.156 -19.359 -0.408 1.00 29.38 C ATOM 973 C GLY A 86 3.018 -20.500 -0.936 1.00 29.71 C ATOM 974 O GLY A 86 3.826 -20.311 -1.861 1.00 32.26 O ATOM 975 HA3 GLY A 86 2.727 -18.813 0.344 1.00 0.00 H ATOM 976 HA2 GLY A 86 1.919 -18.692 -1.237 1.00 0.00 H ATOM 977 H GLY A 86 0.038 -19.877 -0.391 1.00 0.00 H ATOM 978 N ARG A 87 2.862 -21.664 -0.303 1.00 28.61 N ATOM 979 CA ARG A 87 3.395 -22.942 -0.792 1.00 28.79 C ATOM 980 C ARG A 87 2.488 -23.481 -1.867 1.00 31.04 C ATOM 981 O ARG A 87 1.379 -22.939 -2.100 1.00 32.37 O ATOM 982 CB ARG A 87 3.606 -23.944 0.348 1.00 23.60 C ATOM 983 CG ARG A 87 3.041 -23.574 1.716 1.00 24.31 C ATOM 984 CD ARG A 87 3.904 -24.217 2.781 1.00 22.90 C ATOM 985 NE ARG A 87 3.962 -25.665 2.612 1.00 24.26 N ATOM 986 CZ ARG A 87 4.743 -26.493 3.308 1.00 23.53 C ATOM 987 NH1 ARG A 87 5.492 -26.029 4.290 1.00 25.70 N ATOM 988 NH2 ARG A 87 4.728 -27.792 3.046 1.00 23.37 N ATOM 989 HA ARG A 87 4.381 -22.773 -1.225 1.00 0.00 H ATOM 990 HB2 ARG A 87 3.146 -24.885 0.047 1.00 0.00 H ATOM 991 HB3 ARG A 87 4.680 -24.087 0.465 1.00 0.00 H ATOM 992 HG2 ARG A 87 3.052 -22.491 1.838 1.00 0.00 H ATOM 993 HG3 ARG A 87 2.017 -23.938 1.802 1.00 0.00 H ATOM 994 HD2 ARG A 87 3.486 -23.990 3.762 1.00 0.00 H ATOM 995 HD3 ARG A 87 4.913 -23.811 2.714 1.00 0.00 H ATOM 996 HE ARG A 87 3.344 -26.086 1.890 1.00 0.00 H ATOM 997 HH12 ARG A 87 6.100 -26.677 4.831 1.00 0.00 H ATOM 998 HH11 ARG A 87 5.475 -25.016 4.523 1.00 0.00 H ATOM 999 HH22 ARG A 87 5.336 -28.439 3.588 1.00 0.00 H ATOM 1000 HH21 ARG A 87 4.108 -28.165 2.299 1.00 0.00 H ATOM 1001 H ARG A 87 2.331 -21.666 0.591 1.00 0.00 H ATOM 1002 N GLN A 88 2.977 -24.514 -2.548 1.00 36.91 N ATOM 1003 CA GLN A 88 2.285 -25.204 -3.637 1.00 34.93 C ATOM 1004 C GLN A 88 1.809 -26.509 -3.082 1.00 34.04 C ATOM 1005 O GLN A 88 0.880 -27.121 -3.610 1.00 34.63 O ATOM 1006 CB GLN A 88 3.278 -25.536 -4.745 1.00 34.22 C ATOM 1007 CG GLN A 88 3.440 -24.434 -5.763 1.00 30.68 C ATOM 1008 CD GLN A 88 3.744 -25.001 -7.117 1.00 28.55 C ATOM 1009 OE1 GLN A 88 2.940 -25.744 -7.680 1.00 33.83 O ATOM 1010 NE2 GLN A 88 4.890 -24.651 -7.659 1.00 21.42 N ATOM 1011 HA GLN A 88 1.477 -24.584 -4.026 1.00 0.00 H ATOM 1012 HB2 GLN A 88 4.249 -25.731 -4.290 1.00 0.00 H ATOM 1013 HB3 GLN A 88 2.933 -26.433 -5.260 1.00 0.00 H ATOM 1014 HG2 GLN A 88 2.517 -23.857 -5.816 1.00 0.00 H ATOM 1015 HG3 GLN A 88 4.258 -23.781 -5.457 1.00 0.00 H ATOM 1016 HE22 GLN A 88 5.537 -24.020 -7.145 1.00 0.00 H ATOM 1017 HE21 GLN A 88 5.149 -25.005 -8.602 1.00 0.00 H ATOM 1018 H GLN A 88 3.923 -24.857 -2.286 1.00 0.00 H ATOM 1019 N SER A 89 2.502 -26.938 -2.030 1.00 34.43 N ATOM 1020 CA SER A 89 2.189 -28.150 -1.319 1.00 30.47 C ATOM 1021 C SER A 89 2.284 -28.029 0.194 1.00 32.10 C ATOM 1022 O SER A 89 3.005 -27.173 0.748 1.00 33.19 O ATOM 1023 CB SER A 89 3.058 -29.304 -1.831 1.00 35.60 C ATOM 1024 OG SER A 89 2.824 -30.479 -1.100 1.00 31.51 O ATOM 1025 HA SER A 89 1.139 -28.359 -1.526 1.00 0.00 H ATOM 1026 HB2 SER A 89 4.108 -29.028 -1.735 1.00 0.00 H ATOM 1027 HB3 SER A 89 2.826 -29.486 -2.880 1.00 0.00 H ATOM 1028 HG SER A 89 1.872 -30.737 -1.188 1.00 0.00 H ATOM 1029 H SER A 89 3.310 -26.369 -1.705 1.00 0.00 H ATOM 1030 N PHE A 90 1.488 -28.860 0.858 1.00 32.44 N ATOM 1031 CA PHE A 90 1.682 -29.157 2.265 1.00 28.44 C ATOM 1032 C PHE A 90 1.225 -30.575 2.544 1.00 26.40 C ATOM 1033 O PHE A 90 0.592 -31.248 1.719 1.00 19.43 O ATOM 1034 CB PHE A 90 1.028 -28.153 3.221 1.00 28.11 C ATOM 1035 CG PHE A 90 -0.470 -28.139 3.189 1.00 27.82 C ATOM 1036 CD1 PHE A 90 -1.222 -29.065 3.914 1.00 26.45 C ATOM 1037 CD2 PHE A 90 -1.139 -27.160 2.465 1.00 31.94 C ATOM 1038 CE1 PHE A 90 -2.604 -29.042 3.905 1.00 28.44 C ATOM 1039 CE2 PHE A 90 -2.524 -27.114 2.450 1.00 31.14 C ATOM 1040 CZ PHE A 90 -3.260 -28.068 3.160 1.00 33.05 C ATOM 1041 HA PHE A 90 2.749 -29.063 2.466 1.00 0.00 H ATOM 1042 HB2 PHE A 90 1.344 -28.396 4.236 1.00 0.00 H ATOM 1043 HB3 PHE A 90 1.382 -27.156 2.960 1.00 0.00 H ATOM 1044 HD2 PHE A 90 -0.569 -26.420 1.903 1.00 0.00 H ATOM 1045 HE2 PHE A 90 -3.039 -26.336 1.886 1.00 0.00 H ATOM 1046 HZ PHE A 90 -4.349 -28.048 3.129 1.00 0.00 H ATOM 1047 HE1 PHE A 90 -3.172 -29.778 4.474 1.00 0.00 H ATOM 1048 HD1 PHE A 90 -0.707 -29.825 4.502 1.00 0.00 H ATOM 1049 H PHE A 90 0.700 -29.313 0.353 1.00 0.00 H ATOM 1050 N SER A 91 1.656 -31.049 3.696 1.00 27.15 N ATOM 1051 CA SER A 91 1.230 -32.313 4.205 1.00 24.65 C ATOM 1052 C SER A 91 0.271 -32.031 5.333 1.00 25.96 C ATOM 1053 O SER A 91 0.380 -31.030 6.079 1.00 22.20 O ATOM 1054 CB SER A 91 2.420 -33.071 4.804 1.00 26.15 C ATOM 1055 OG SER A 91 1.997 -33.950 5.831 1.00 23.10 O ATOM 1056 HA SER A 91 0.782 -32.903 3.406 1.00 0.00 H ATOM 1057 HB2 SER A 91 3.128 -32.353 5.218 1.00 0.00 H ATOM 1058 HB3 SER A 91 2.907 -33.648 4.018 1.00 0.00 H ATOM 1059 HG SER A 91 2.782 -34.426 6.200 1.00 0.00 H ATOM 1060 H SER A 91 2.329 -30.484 4.252 1.00 0.00 H ATOM 1061 N VAL A 92 -0.664 -32.943 5.496 1.00 30.16 N ATOM 1062 CA VAL A 92 -1.630 -32.722 6.561 1.00 28.59 C ATOM 1063 C VAL A 92 -1.146 -33.481 7.768 1.00 29.07 C ATOM 1064 O VAL A 92 -1.376 -33.060 8.884 1.00 22.30 O ATOM 1065 CB VAL A 92 -3.077 -33.061 6.190 1.00 30.85 C ATOM 1066 CG1 VAL A 92 -3.977 -32.503 7.261 1.00 30.83 C ATOM 1067 CG2 VAL A 92 -3.447 -32.430 4.852 1.00 32.16 C ATOM 1068 HA VAL A 92 -1.680 -31.654 6.771 1.00 0.00 H ATOM 1069 HB VAL A 92 -3.189 -34.142 6.108 1.00 0.00 H ATOM 1070 HG11 VAL A 92 -3.719 -32.952 8.220 1.00 0.00 H ATOM 1071 HG12 VAL A 92 -3.846 -31.422 7.317 1.00 0.00 H ATOM 1072 HG13 VAL A 92 -5.014 -32.733 7.018 1.00 0.00 H ATOM 1073 HG21 VAL A 92 -3.343 -31.347 4.921 1.00 0.00 H ATOM 1074 HG22 VAL A 92 -2.783 -32.811 4.076 1.00 0.00 H ATOM 1075 HG23 VAL A 92 -4.478 -32.682 4.606 1.00 0.00 H ATOM 1076 H VAL A 92 -0.710 -33.786 4.889 1.00 0.00 H ATOM 1077 N LYS A 93 -0.446 -34.590 7.525 1.00 30.63 N ATOM 1078 CA LYS A 93 0.347 -35.214 8.588 1.00 34.51 C ATOM 1079 C LYS A 93 1.301 -34.225 9.311 1.00 37.75 C ATOM 1080 O LYS A 93 1.633 -34.429 10.490 1.00 37.50 O ATOM 1081 CB LYS A 93 1.068 -36.452 8.034 1.00 32.28 C ATOM 1082 CG LYS A 93 0.159 -37.682 7.954 1.00 34.96 C ATOM 1083 CD LYS A 93 0.426 -38.597 6.746 1.00 28.80 C ATOM 1084 CE LYS A 93 -0.892 -39.043 6.109 1.00 26.68 C ATOM 1085 NZ LYS A 93 -0.843 -40.087 5.047 1.00 26.30 N ATOM 1086 HA LYS A 93 -0.338 -35.538 9.371 1.00 0.00 H ATOM 1087 HB2 LYS A 93 1.434 -36.223 7.033 1.00 0.00 H ATOM 1088 HB3 LYS A 93 1.912 -36.684 8.684 1.00 0.00 H ATOM 1089 HG2 LYS A 93 0.298 -38.268 8.862 1.00 0.00 H ATOM 1090 HG3 LYS A 93 -0.874 -37.339 7.899 1.00 0.00 H ATOM 1091 HD2 LYS A 93 1.016 -38.054 6.008 1.00 0.00 H ATOM 1092 HD3 LYS A 93 0.980 -39.475 7.077 1.00 0.00 H ATOM 1093 HE2 LYS A 93 -1.356 -38.159 5.672 1.00 0.00 H ATOM 1094 HE3 LYS A 93 -1.525 -39.425 6.910 1.00 0.00 H ATOM 1095 HZ1 LYS A 93 -0.263 -39.746 4.254 1.00 0.00 H ATOM 1096 HZ2 LYS A 93 -0.425 -40.956 5.436 1.00 0.00 H ATOM 1097 HZ3 LYS A 93 -1.808 -40.285 4.712 1.00 0.00 H ATOM 1098 H LYS A 93 -0.463 -35.014 6.576 1.00 0.00 H ATOM 1099 N ASP A 94 1.715 -33.151 8.623 1.00 41.89 N ATOM 1100 CA ASP A 94 2.305 -31.978 9.291 1.00 42.75 C ATOM 1101 C ASP A 94 1.680 -30.636 8.825 1.00 46.81 C ATOM 1102 O ASP A 94 2.146 -30.055 7.847 1.00 51.95 O ATOM 1103 CB ASP A 94 3.843 -31.968 9.156 1.00 43.42 C ATOM 1104 CG ASP A 94 4.487 -30.634 9.622 1.00 42.43 C ATOM 1105 OD1 ASP A 94 4.127 -30.076 10.700 1.00 46.32 O ATOM 1106 OD2 ASP A 94 5.374 -30.134 8.896 1.00 43.38 O ATOM 1107 HA ASP A 94 2.062 -32.072 10.349 1.00 0.00 H ATOM 1108 HB2 ASP A 94 4.250 -32.779 9.760 1.00 0.00 H ATOM 1109 HB3 ASP A 94 4.101 -32.131 8.110 1.00 0.00 H ATOM 1110 H ASP A 94 1.617 -33.146 7.588 1.00 0.00 H ATOM 1111 N PRO A 95 0.672 -30.115 9.571 1.00 46.10 N ATOM 1112 CA PRO A 95 -0.139 -28.929 9.191 1.00 45.54 C ATOM 1113 C PRO A 95 0.348 -27.497 9.538 1.00 48.15 C ATOM 1114 O PRO A 95 -0.305 -26.526 9.132 1.00 57.38 O ATOM 1115 CB PRO A 95 -1.488 -29.208 9.862 1.00 44.07 C ATOM 1116 CG PRO A 95 -1.141 -30.018 11.062 1.00 46.43 C ATOM 1117 CD PRO A 95 0.157 -30.748 10.803 1.00 43.79 C ATOM 1118 HA PRO A 95 -0.114 -28.861 8.103 1.00 0.00 H ATOM 1119 HD3 PRO A 95 0.853 -30.612 11.631 1.00 0.00 H ATOM 1120 HD2 PRO A 95 -0.019 -31.813 10.650 1.00 0.00 H ATOM 1121 HG3 PRO A 95 -1.934 -30.740 11.258 1.00 0.00 H ATOM 1122 HG2 PRO A 95 -1.026 -29.363 11.925 1.00 0.00 H ATOM 1123 HB2 PRO A 95 -1.975 -28.277 10.152 1.00 0.00 H ATOM 1124 HB3 PRO A 95 -2.143 -29.767 9.194 1.00 0.00 H ATOM 1125 N SER A 96 1.471 -27.344 10.235 1.00 46.66 N ATOM 1126 CA SER A 96 2.041 -25.993 10.551 1.00 43.67 C ATOM 1127 C SER A 96 1.802 -24.791 9.584 1.00 40.08 C ATOM 1128 O SER A 96 1.269 -23.745 10.023 1.00 36.94 O ATOM 1129 CB SER A 96 3.536 -26.126 10.866 1.00 44.48 C ATOM 1130 OG SER A 96 4.296 -26.292 9.680 1.00 40.41 O ATOM 1131 HA SER A 96 1.436 -25.695 11.407 1.00 0.00 H ATOM 1132 HB2 SER A 96 3.688 -26.992 11.511 1.00 0.00 H ATOM 1133 HB3 SER A 96 3.873 -25.227 11.382 1.00 0.00 H ATOM 1134 HG SER A 96 5.255 -26.375 9.913 1.00 0.00 H ATOM 1135 H SER A 96 1.971 -28.191 10.573 1.00 0.00 H ATOM 1136 N PRO A 97 2.177 -24.918 8.279 1.00 37.37 N ATOM 1137 CA PRO A 97 2.308 -23.704 7.427 1.00 38.23 C ATOM 1138 C PRO A 97 0.964 -22.967 7.185 1.00 43.30 C ATOM 1139 O PRO A 97 0.931 -21.720 6.904 1.00 35.03 O ATOM 1140 CB PRO A 97 2.871 -24.271 6.110 1.00 35.72 C ATOM 1141 CG PRO A 97 2.360 -25.668 6.048 1.00 36.21 C ATOM 1142 CD PRO A 97 2.359 -26.152 7.479 1.00 31.27 C ATOM 1143 HA PRO A 97 2.937 -22.947 7.896 1.00 0.00 H ATOM 1144 HD3 PRO A 97 1.539 -26.849 7.651 1.00 0.00 H ATOM 1145 HD2 PRO A 97 3.304 -26.637 7.724 1.00 0.00 H ATOM 1146 HG3 PRO A 97 3.014 -26.288 5.435 1.00 0.00 H ATOM 1147 HG2 PRO A 97 1.351 -25.689 5.636 1.00 0.00 H ATOM 1148 HB2 PRO A 97 2.513 -23.693 5.258 1.00 0.00 H ATOM 1149 HB3 PRO A 97 3.961 -24.261 6.122 1.00 0.00 H ATOM 1150 N LEU A 98 -0.098 -23.769 7.340 1.00 37.46 N ATOM 1151 CA LEU A 98 -1.508 -23.416 7.211 1.00 38.32 C ATOM 1152 C LEU A 98 -2.083 -22.813 8.491 1.00 43.39 C ATOM 1153 O LEU A 98 -3.001 -21.987 8.440 1.00 46.04 O ATOM 1154 CB LEU A 98 -2.307 -24.696 6.910 1.00 42.51 C ATOM 1155 CG LEU A 98 -3.823 -24.580 7.126 1.00 39.29 C ATOM 1156 CD1 LEU A 98 -4.459 -24.144 5.823 1.00 37.16 C ATOM 1157 CD2 LEU A 98 -4.429 -25.889 7.627 1.00 40.46 C ATOM 1158 HA LEU A 98 -1.585 -22.676 6.414 1.00 0.00 H ATOM 1159 HB2 LEU A 98 -2.133 -24.967 5.869 1.00 0.00 H ATOM 1160 HB3 LEU A 98 -1.933 -25.489 7.557 1.00 0.00 H ATOM 1161 HG LEU A 98 -4.019 -23.838 7.900 1.00 0.00 H ATOM 1162 HD21 LEU A 98 -4.247 -26.676 6.895 1.00 0.00 H ATOM 1163 HD22 LEU A 98 -3.968 -26.161 8.577 1.00 0.00 H ATOM 1164 HD23 LEU A 98 -5.503 -25.761 7.766 1.00 0.00 H ATOM 1165 HD11 LEU A 98 -4.049 -23.179 5.525 1.00 0.00 H ATOM 1166 HD12 LEU A 98 -4.247 -24.884 5.051 1.00 0.00 H ATOM 1167 HD13 LEU A 98 -5.537 -24.056 5.958 1.00 0.00 H ATOM 1168 H LEU A 98 0.107 -24.760 7.581 1.00 0.00 H ATOM 1169 N TYR A 99 -1.598 -23.307 9.632 1.00 39.58 N ATOM 1170 CA TYR A 99 -1.889 -22.739 10.932 1.00 33.24 C ATOM 1171 C TYR A 99 -1.352 -21.315 10.955 1.00 38.24 C ATOM 1172 O TYR A 99 -2.053 -20.382 11.344 1.00 39.73 O ATOM 1173 CB TYR A 99 -1.218 -23.602 11.987 1.00 32.73 C ATOM 1174 CG TYR A 99 -1.982 -24.870 12.262 1.00 33.02 C ATOM 1175 CD1 TYR A 99 -3.376 -24.870 12.195 1.00 33.30 C ATOM 1176 CD2 TYR A 99 -1.326 -26.082 12.585 1.00 31.40 C ATOM 1177 CE1 TYR A 99 -4.098 -26.024 12.460 1.00 31.88 C ATOM 1178 CE2 TYR A 99 -2.040 -27.250 12.848 1.00 30.59 C ATOM 1179 CZ TYR A 99 -3.439 -27.206 12.783 1.00 30.54 C ATOM 1180 OH TYR A 99 -4.233 -28.309 13.030 1.00 29.57 O ATOM 1181 HA TYR A 99 -2.960 -22.712 11.134 1.00 0.00 H ATOM 1182 HB3 TYR A 99 -1.144 -23.030 12.912 1.00 0.00 H ATOM 1183 HB2 TYR A 99 -0.218 -23.863 11.642 1.00 0.00 H ATOM 1184 HD2 TYR A 99 -0.237 -26.102 12.629 1.00 0.00 H ATOM 1185 HE2 TYR A 99 -1.522 -28.176 13.098 1.00 0.00 H ATOM 1186 HE1 TYR A 99 -5.187 -26.005 12.415 1.00 0.00 H ATOM 1187 HD1 TYR A 99 -3.903 -23.953 11.932 1.00 0.00 H ATOM 1188 HH TYR A 99 -5.185 -28.058 12.930 1.00 0.00 H ATOM 1189 H TYR A 99 -0.980 -24.142 9.585 1.00 0.00 H ATOM 1190 N ASP A 100 -0.114 -21.174 10.496 1.00 32.53 N ATOM 1191 CA ASP A 100 0.533 -19.886 10.259 1.00 36.71 C ATOM 1192 C ASP A 100 -0.130 -19.067 9.167 1.00 39.36 C ATOM 1193 O ASP A 100 0.095 -17.853 9.077 1.00 38.67 O ATOM 1194 CB ASP A 100 2.010 -20.096 9.977 1.00 37.37 C ATOM 1195 CG ASP A 100 2.740 -20.688 11.170 1.00 37.64 C ATOM 1196 OD1 ASP A 100 2.471 -20.220 12.318 1.00 30.59 O ATOM 1197 OD2 ASP A 100 3.562 -21.611 10.951 1.00 32.44 O ATOM 1198 HA ASP A 100 0.419 -19.297 11.169 1.00 0.00 H ATOM 1199 HB2 ASP A 100 2.114 -20.773 9.129 1.00 0.00 H ATOM 1200 HB3 ASP A 100 2.461 -19.135 9.730 1.00 0.00 H ATOM 1201 H ASP A 100 0.430 -22.036 10.292 1.00 0.00 H ATOM 1202 N MET A 101 -0.921 -19.742 8.333 1.00 36.95 N ATOM 1203 CA MET A 101 -1.971 -19.104 7.567 1.00 36.46 C ATOM 1204 C MET A 101 -3.115 -18.739 8.523 1.00 34.35 C ATOM 1205 O MET A 101 -3.660 -17.668 8.437 1.00 32.12 O ATOM 1206 CB MET A 101 -2.489 -20.035 6.465 1.00 36.33 C ATOM 1207 CG MET A 101 -3.234 -19.307 5.352 1.00 37.98 C ATOM 1208 SD MET A 101 -4.937 -19.053 5.843 1.00 37.39 S ATOM 1209 CE MET A 101 -5.496 -20.750 5.725 1.00 28.85 C ATOM 1210 HA MET A 101 -1.575 -18.208 7.088 1.00 0.00 H ATOM 1211 HB2 MET A 101 -1.639 -20.557 6.027 1.00 0.00 H ATOM 1212 HB3 MET A 101 -3.166 -20.760 6.916 1.00 0.00 H ATOM 1213 HG2 MET A 101 -3.203 -19.905 4.441 1.00 0.00 H ATOM 1214 HG3 MET A 101 -2.761 -18.343 5.168 1.00 0.00 H ATOM 1215 HE1 MET A 101 -5.364 -21.105 4.703 1.00 0.00 H ATOM 1216 HE2 MET A 101 -4.913 -21.371 6.405 1.00 0.00 H ATOM 1217 HE3 MET A 101 -6.550 -20.804 5.996 1.00 0.00 H ATOM 1218 H MET A 101 -0.778 -20.767 8.228 1.00 0.00 H ATOM 1219 N LEU A 102 -3.499 -19.631 9.424 1.00 37.74 N ATOM 1220 CA LEU A 102 -4.731 -19.370 10.196 1.00 36.85 C ATOM 1221 C LEU A 102 -4.473 -18.480 11.403 1.00 41.87 C ATOM 1222 O LEU A 102 -5.274 -17.588 11.744 1.00 39.03 O ATOM 1223 CB LEU A 102 -5.443 -20.655 10.551 1.00 30.88 C ATOM 1224 CG LEU A 102 -5.926 -21.415 9.304 1.00 30.90 C ATOM 1225 CD1 LEU A 102 -6.457 -22.785 9.663 1.00 25.58 C ATOM 1226 CD2 LEU A 102 -7.023 -20.641 8.557 1.00 28.31 C ATOM 1227 HA LEU A 102 -5.408 -18.808 9.553 1.00 0.00 H ATOM 1228 HB2 LEU A 102 -4.758 -21.294 11.108 1.00 0.00 H ATOM 1229 HB3 LEU A 102 -6.305 -20.418 11.174 1.00 0.00 H ATOM 1230 HG LEU A 102 -5.057 -21.522 8.654 1.00 0.00 H ATOM 1231 HD21 LEU A 102 -7.875 -20.491 9.220 1.00 0.00 H ATOM 1232 HD22 LEU A 102 -6.632 -19.674 8.240 1.00 0.00 H ATOM 1233 HD23 LEU A 102 -7.337 -21.211 7.683 1.00 0.00 H ATOM 1234 HD11 LEU A 102 -5.667 -23.366 10.138 1.00 0.00 H ATOM 1235 HD12 LEU A 102 -7.296 -22.679 10.351 1.00 0.00 H ATOM 1236 HD13 LEU A 102 -6.789 -23.293 8.758 1.00 0.00 H ATOM 1237 H LEU A 102 -2.945 -20.496 9.584 1.00 0.00 H ATOM 1238 N ARG A 103 -3.338 -18.735 12.044 1.00 37.30 N ATOM 1239 CA ARG A 103 -2.759 -17.806 12.988 1.00 37.38 C ATOM 1240 C ARG A 103 -2.649 -16.398 12.347 1.00 37.94 C ATOM 1241 O ARG A 103 -2.443 -15.405 13.026 1.00 39.73 O ATOM 1242 CB ARG A 103 -1.391 -18.348 13.426 1.00 31.30 C ATOM 1243 CG ARG A 103 -1.272 -18.813 14.869 1.00 35.16 C ATOM 1244 CD ARG A 103 -0.323 -17.894 15.690 1.00 35.16 C ATOM 1245 NE ARG A 103 -0.628 -17.861 17.132 1.00 33.89 N ATOM 1246 CZ ARG A 103 -0.044 -17.083 18.052 1.00 34.54 C ATOM 1247 NH1 ARG A 103 0.916 -16.211 17.738 1.00 38.10 N ATOM 1248 NH2 ARG A 103 -0.436 -17.163 19.313 1.00 35.42 N ATOM 1249 HA ARG A 103 -3.393 -17.707 13.869 1.00 0.00 H ATOM 1250 HB2 ARG A 103 -1.150 -19.196 12.784 1.00 0.00 H ATOM 1251 HB3 ARG A 103 -0.657 -17.557 13.272 1.00 0.00 H ATOM 1252 HG2 ARG A 103 -2.261 -18.801 15.328 1.00 0.00 H ATOM 1253 HG3 ARG A 103 -0.879 -19.830 14.882 1.00 0.00 H ATOM 1254 HD2 ARG A 103 -0.402 -16.880 15.298 1.00 0.00 H ATOM 1255 HD3 ARG A 103 0.698 -18.253 15.562 1.00 0.00 H ATOM 1256 HE ARG A 103 -1.371 -18.506 17.468 1.00 0.00 H ATOM 1257 HH12 ARG A 103 1.347 -15.623 18.480 1.00 0.00 H ATOM 1258 HH11 ARG A 103 1.233 -16.120 16.752 1.00 0.00 H ATOM 1259 HH22 ARG A 103 0.011 -16.563 20.036 1.00 0.00 H ATOM 1260 HH21 ARG A 103 -1.191 -17.826 19.582 1.00 0.00 H ATOM 1261 H ARG A 103 -2.849 -19.634 11.860 1.00 0.00 H ATOM 1262 N LYS A 104 -2.814 -16.298 11.032 1.00 41.83 N ATOM 1263 CA LYS A 104 -2.504 -15.032 10.385 1.00 37.79 C ATOM 1264 C LYS A 104 -3.763 -14.346 9.905 1.00 43.30 C ATOM 1265 O LYS A 104 -3.780 -13.115 9.734 1.00 50.69 O ATOM 1266 CB LYS A 104 -1.576 -15.284 9.195 1.00 35.56 C ATOM 1267 CG LYS A 104 -0.631 -14.149 8.853 1.00 31.54 C ATOM 1268 CD LYS A 104 0.227 -14.670 7.714 1.00 25.11 C ATOM 1269 CE LYS A 104 1.519 -13.891 7.491 1.00 26.14 C ATOM 1270 NZ LYS A 104 2.745 -14.498 8.110 1.00 20.94 N ATOM 1271 HA LYS A 104 -2.014 -14.384 11.111 1.00 0.00 H ATOM 1272 HB2 LYS A 104 -0.975 -16.166 9.418 1.00 0.00 H ATOM 1273 HB3 LYS A 104 -2.196 -15.480 8.320 1.00 0.00 H ATOM 1274 HG2 LYS A 104 -1.190 -13.268 8.538 1.00 0.00 H ATOM 1275 HG3 LYS A 104 -0.011 -13.896 9.713 1.00 0.00 H ATOM 1276 HD2 LYS A 104 0.486 -15.707 7.929 1.00 0.00 H ATOM 1277 HD3 LYS A 104 -0.360 -14.626 6.797 1.00 0.00 H ATOM 1278 HE2 LYS A 104 1.388 -12.893 7.909 1.00 0.00 H ATOM 1279 HE3 LYS A 104 1.686 -13.814 6.417 1.00 0.00 H ATOM 1280 HZ1 LYS A 104 2.614 -14.568 9.139 1.00 0.00 H ATOM 1281 HZ2 LYS A 104 2.898 -15.447 7.714 1.00 0.00 H ATOM 1282 HZ3 LYS A 104 3.569 -13.898 7.904 1.00 0.00 H ATOM 1283 H LYS A 104 -3.158 -17.108 10.477 1.00 0.00 H ATOM 1284 N ASN A 105 -4.822 -15.134 9.723 1.00 43.00 N ATOM 1285 CA ASN A 105 -5.925 -14.680 8.884 1.00 35.92 C ATOM 1286 C ASN A 105 -7.300 -14.516 9.545 1.00 35.89 C ATOM 1287 O ASN A 105 -8.113 -13.746 9.022 1.00 34.64 O ATOM 1288 CB ASN A 105 -5.958 -15.480 7.549 1.00 31.64 C ATOM 1289 CG ASN A 105 -4.890 -15.003 6.562 1.00 33.91 C ATOM 1290 OD1 ASN A 105 -3.868 -15.671 6.364 1.00 28.66 O ATOM 1291 ND2 ASN A 105 -5.101 -13.807 5.963 1.00 34.60 N ATOM 1292 HA ASN A 105 -5.691 -13.637 8.668 1.00 0.00 H ATOM 1293 HB2 ASN A 105 -5.789 -16.534 7.767 1.00 0.00 H ATOM 1294 HB3 ASN A 105 -6.939 -15.358 7.091 1.00 0.00 H ATOM 1295 HD22 ASN A 105 -5.974 -13.276 6.156 1.00 0.00 H ATOM 1296 HD21 ASN A 105 -4.390 -13.420 5.310 1.00 0.00 H ATOM 1297 H ASN A 105 -4.862 -16.069 10.177 1.00 0.00 H ATOM 1298 N LEU A 106 -7.542 -15.197 10.688 1.00 38.44 N ATOM 1299 CA LEU A 106 -8.806 -15.048 11.455 1.00 32.28 C ATOM 1300 C LEU A 106 -8.630 -13.979 12.523 1.00 32.69 C ATOM 1301 O LEU A 106 -7.943 -14.234 13.543 1.00 32.86 O ATOM 1302 CB LEU A 106 -9.237 -16.375 12.091 1.00 31.39 C ATOM 1303 CG LEU A 106 -8.793 -17.561 11.241 1.00 30.06 C ATOM 1304 CD1 LEU A 106 -8.053 -18.556 12.097 1.00 26.94 C ATOM 1305 CD2 LEU A 106 -9.949 -18.157 10.451 1.00 29.85 C ATOM 1306 HA LEU A 106 -9.594 -14.746 10.765 1.00 0.00 H ATOM 1307 HB2 LEU A 106 -8.788 -16.458 13.081 1.00 0.00 H ATOM 1308 HB3 LEU A 106 -10.323 -16.390 12.184 1.00 0.00 H ATOM 1309 HG LEU A 106 -8.091 -17.217 10.481 1.00 0.00 H ATOM 1310 HD21 LEU A 106 -10.720 -18.500 11.141 1.00 0.00 H ATOM 1311 HD22 LEU A 106 -10.364 -17.398 9.788 1.00 0.00 H ATOM 1312 HD23 LEU A 106 -9.588 -18.999 9.860 1.00 0.00 H ATOM 1313 HD11 LEU A 106 -7.176 -18.077 12.533 1.00 0.00 H ATOM 1314 HD12 LEU A 106 -8.710 -18.908 12.892 1.00 0.00 H ATOM 1315 HD13 LEU A 106 -7.739 -19.400 11.482 1.00 0.00 H ATOM 1316 H LEU A 106 -6.815 -15.850 11.044 1.00 0.00 H ATOM 1317 N VAL A 107 -9.190 -12.781 12.264 1.00 31.81 N ATOM 1318 CA VAL A 107 -9.289 -11.675 13.273 1.00 31.70 C ATOM 1319 C VAL A 107 -10.354 -11.966 14.358 1.00 29.63 C ATOM 1320 O VAL A 107 -11.207 -12.830 14.295 1.00 30.49 O ATOM 1321 CB VAL A 107 -9.492 -10.266 12.610 1.00 32.95 C ATOM 1322 CG1 VAL A 107 -9.760 -9.169 13.663 1.00 28.78 C ATOM 1323 CG2 VAL A 107 -8.286 -9.866 11.752 1.00 28.93 C ATOM 1324 HA VAL A 107 -8.324 -11.639 13.779 1.00 0.00 H ATOM 1325 HB VAL A 107 -10.368 -10.353 11.967 1.00 0.00 H ATOM 1326 HG11 VAL A 107 -10.662 -9.417 14.223 1.00 0.00 H ATOM 1327 HG12 VAL A 107 -8.912 -9.107 14.346 1.00 0.00 H ATOM 1328 HG13 VAL A 107 -9.895 -8.211 13.161 1.00 0.00 H ATOM 1329 HG21 VAL A 107 -7.394 -9.827 12.377 1.00 0.00 H ATOM 1330 HG22 VAL A 107 -8.145 -10.602 10.960 1.00 0.00 H ATOM 1331 HG23 VAL A 107 -8.465 -8.886 11.311 1.00 0.00 H ATOM 1332 H VAL A 107 -9.575 -12.614 11.312 1.00 0.00 H TER 1333 VAL A 107 ATOM 1334 N GLN B 26 -28.842 -42.316 -13.954 1.00 28.40 N ATOM 1335 CA GLN B 26 -29.039 -42.028 -12.502 1.00 33.32 C ATOM 1336 C GLN B 26 -29.571 -43.210 -11.676 1.00 33.66 C ATOM 1337 O GLN B 26 -30.106 -44.204 -12.209 1.00 36.63 O ATOM 1338 CB GLN B 26 -29.864 -40.762 -12.287 1.00 31.19 C ATOM 1339 CG GLN B 26 -29.638 -40.129 -10.913 1.00 35.78 C ATOM 1340 CD GLN B 26 -30.526 -38.926 -10.635 1.00 34.18 C ATOM 1341 OE1 GLN B 26 -30.061 -37.788 -10.561 1.00 38.71 O ATOM 1342 NE2 GLN B 26 -31.809 -39.169 -10.480 1.00 35.70 N ATOM 1343 HA GLN B 26 -28.037 -41.852 -12.111 1.00 0.00 H ATOM 1344 HB2 GLN B 26 -29.593 -40.036 -13.053 1.00 0.00 H ATOM 1345 HB3 GLN B 26 -30.920 -41.014 -12.384 1.00 0.00 H ATOM 1346 HG2 GLN B 26 -29.833 -40.883 -10.151 1.00 0.00 H ATOM 1347 HG3 GLN B 26 -28.598 -39.810 -10.849 1.00 0.00 H ATOM 1348 HE22 GLN B 26 -32.166 -40.143 -10.549 1.00 0.00 H ATOM 1349 HE21 GLN B 26 -32.467 -38.387 -10.288 1.00 0.00 H ATOM 1350 HN3 GLN B 26 -29.750 -42.593 -14.378 1.00 0.00 H ATOM 1351 HN2 GLN B 26 -28.157 -43.091 -14.063 1.00 0.00 H ATOM 1352 HN1 GLN B 26 -28.482 -41.464 -14.429 1.00 0.00 H ATOM 1353 N VAL B 27 -29.408 -43.098 -10.361 1.00 37.91 N ATOM 1354 CA VAL B 27 -29.416 -44.253 -9.470 1.00 30.69 C ATOM 1355 C VAL B 27 -30.339 -44.078 -8.249 1.00 29.07 C ATOM 1356 O VAL B 27 -30.311 -43.057 -7.583 1.00 33.38 O ATOM 1357 CB VAL B 27 -27.959 -44.625 -9.071 1.00 29.47 C ATOM 1358 CG1 VAL B 27 -27.035 -44.640 -10.302 1.00 23.09 C ATOM 1359 CG2 VAL B 27 -27.421 -43.685 -7.982 1.00 27.45 C ATOM 1360 HA VAL B 27 -29.847 -45.090 -10.020 1.00 0.00 H ATOM 1361 HB VAL B 27 -27.976 -45.632 -8.655 1.00 0.00 H ATOM 1362 HG11 VAL B 27 -27.400 -45.375 -11.019 1.00 0.00 H ATOM 1363 HG12 VAL B 27 -27.030 -43.652 -10.763 1.00 0.00 H ATOM 1364 HG13 VAL B 27 -26.024 -44.903 -9.992 1.00 0.00 H ATOM 1365 HG21 VAL B 27 -27.429 -42.660 -8.352 1.00 0.00 H ATOM 1366 HG22 VAL B 27 -28.053 -43.757 -7.097 1.00 0.00 H ATOM 1367 HG23 VAL B 27 -26.401 -43.973 -7.727 1.00 0.00 H ATOM 1368 H VAL B 27 -29.270 -42.152 -9.953 1.00 0.00 H ATOM 1369 N ARG B 28 -31.155 -45.086 -7.988 1.00 27.47 N ATOM 1370 CA ARG B 28 -31.944 -45.132 -6.760 1.00 25.48 C ATOM 1371 C ARG B 28 -31.216 -45.735 -5.533 1.00 24.77 C ATOM 1372 O ARG B 28 -31.406 -46.928 -5.258 1.00 33.81 O ATOM 1373 CB ARG B 28 -33.233 -45.909 -6.990 1.00 23.77 C ATOM 1374 CG ARG B 28 -34.222 -45.816 -5.825 1.00 21.40 C ATOM 1375 CD ARG B 28 -35.428 -46.751 -5.995 1.00 23.09 C ATOM 1376 NE ARG B 28 -36.488 -46.176 -6.871 1.00 25.35 N ATOM 1377 CZ ARG B 28 -36.878 -46.706 -8.046 1.00 25.68 C ATOM 1378 NH1 ARG B 28 -36.330 -47.836 -8.523 1.00 22.42 N ATOM 1379 NH2 ARG B 28 -37.824 -46.091 -8.755 1.00 30.96 N ATOM 1380 HA ARG B 28 -32.141 -44.087 -6.520 1.00 0.00 H ATOM 1381 HB2 ARG B 28 -33.717 -45.517 -7.885 1.00 0.00 H ATOM 1382 HB3 ARG B 28 -32.980 -46.958 -7.145 1.00 0.00 H ATOM 1383 HG2 ARG B 28 -33.702 -46.081 -4.904 1.00 0.00 H ATOM 1384 HG3 ARG B 28 -34.583 -44.790 -5.755 1.00 0.00 H ATOM 1385 HD2 ARG B 28 -35.857 -46.948 -5.013 1.00 0.00 H ATOM 1386 HD3 ARG B 28 -35.084 -47.687 -6.434 1.00 0.00 H ATOM 1387 HE ARG B 28 -36.959 -45.305 -6.553 1.00 0.00 H ATOM 1388 HH12 ARG B 28 -36.649 -48.225 -9.433 1.00 0.00 H ATOM 1389 HH11 ARG B 28 -35.587 -48.322 -7.982 1.00 0.00 H ATOM 1390 HH22 ARG B 28 -38.134 -46.490 -9.664 1.00 0.00 H ATOM 1391 HH21 ARG B 28 -38.252 -45.212 -8.399 1.00 0.00 H ATOM 1392 H ARG B 28 -31.237 -45.864 -8.673 1.00 0.00 H ATOM 1393 N PRO B 29 -30.494 -44.926 -4.719 1.00 24.54 N ATOM 1394 CA PRO B 29 -29.769 -45.612 -3.638 1.00 26.24 C ATOM 1395 C PRO B 29 -30.658 -46.230 -2.586 1.00 32.43 C ATOM 1396 O PRO B 29 -31.711 -45.685 -2.241 1.00 37.05 O ATOM 1397 CB PRO B 29 -28.863 -44.535 -3.031 1.00 25.14 C ATOM 1398 CG PRO B 29 -29.325 -43.232 -3.569 1.00 24.24 C ATOM 1399 CD PRO B 29 -30.287 -43.463 -4.693 1.00 24.49 C ATOM 1400 HA PRO B 29 -29.219 -46.463 -4.039 1.00 0.00 H ATOM 1401 HD3 PRO B 29 -31.228 -42.945 -4.506 1.00 0.00 H ATOM 1402 HD2 PRO B 29 -29.865 -43.118 -5.637 1.00 0.00 H ATOM 1403 HG3 PRO B 29 -28.468 -42.667 -3.935 1.00 0.00 H ATOM 1404 HG2 PRO B 29 -29.820 -42.668 -2.778 1.00 0.00 H ATOM 1405 HB2 PRO B 29 -28.946 -44.543 -1.944 1.00 0.00 H ATOM 1406 HB3 PRO B 29 -27.826 -44.712 -3.316 1.00 0.00 H ATOM 1407 N LYS B 30 -30.220 -47.389 -2.107 1.00 33.93 N ATOM 1408 CA LYS B 30 -30.925 -48.150 -1.098 1.00 32.07 C ATOM 1409 C LYS B 30 -30.705 -47.616 0.303 1.00 29.15 C ATOM 1410 O LYS B 30 -29.626 -47.161 0.671 1.00 33.30 O ATOM 1411 CB LYS B 30 -30.460 -49.587 -1.122 1.00 29.95 C ATOM 1412 CG LYS B 30 -29.505 -49.905 -2.254 1.00 29.57 C ATOM 1413 CD LYS B 30 -30.134 -50.590 -3.481 1.00 26.57 C ATOM 1414 CE LYS B 30 -30.055 -52.114 -3.320 1.00 24.74 C ATOM 1415 NZ LYS B 30 -30.387 -52.936 -4.544 1.00 21.17 N ATOM 1416 HA LYS B 30 -31.985 -48.068 -1.336 1.00 0.00 H ATOM 1417 HB2 LYS B 30 -29.958 -49.801 -0.179 1.00 0.00 H ATOM 1418 HB3 LYS B 30 -31.335 -50.229 -1.220 1.00 0.00 H ATOM 1419 HG2 LYS B 30 -29.054 -48.970 -2.586 1.00 0.00 H ATOM 1420 HG3 LYS B 30 -28.728 -50.563 -1.864 1.00 0.00 H ATOM 1421 HD2 LYS B 30 -31.178 -50.288 -3.569 1.00 0.00 H ATOM 1422 HD3 LYS B 30 -29.594 -50.292 -4.379 1.00 0.00 H ATOM 1423 HE2 LYS B 30 -30.748 -52.401 -2.529 1.00 0.00 H ATOM 1424 HE3 LYS B 30 -29.038 -52.364 -3.018 1.00 0.00 H ATOM 1425 HZ1 LYS B 30 -31.361 -52.730 -4.845 1.00 0.00 H ATOM 1426 HZ2 LYS B 30 -29.728 -52.695 -5.311 1.00 0.00 H ATOM 1427 HZ3 LYS B 30 -30.300 -53.947 -4.315 1.00 0.00 H ATOM 1428 H LYS B 30 -29.325 -47.769 -2.476 1.00 0.00 H ATOM 1429 N LEU B 31 -31.735 -47.792 1.109 1.00 31.47 N ATOM 1430 CA LEU B 31 -31.910 -47.120 2.378 1.00 30.14 C ATOM 1431 C LEU B 31 -30.718 -47.176 3.293 1.00 32.47 C ATOM 1432 O LEU B 31 -30.362 -46.153 3.855 1.00 29.06 O ATOM 1433 CB LEU B 31 -33.148 -47.655 3.096 1.00 28.15 C ATOM 1434 CG LEU B 31 -33.919 -46.789 4.083 1.00 29.00 C ATOM 1435 CD1 LEU B 31 -33.953 -45.306 3.710 1.00 24.94 C ATOM 1436 CD2 LEU B 31 -35.305 -47.405 4.087 1.00 24.54 C ATOM 1437 HA LEU B 31 -32.038 -46.066 2.129 1.00 0.00 H ATOM 1438 HB2 LEU B 31 -33.856 -47.945 2.319 1.00 0.00 H ATOM 1439 HB3 LEU B 31 -32.829 -48.541 3.645 1.00 0.00 H ATOM 1440 HG LEU B 31 -33.445 -46.783 5.064 1.00 0.00 H ATOM 1441 HD21 LEU B 31 -35.723 -47.362 3.081 1.00 0.00 H ATOM 1442 HD22 LEU B 31 -35.239 -48.444 4.410 1.00 0.00 H ATOM 1443 HD23 LEU B 31 -35.946 -46.850 4.773 1.00 0.00 H ATOM 1444 HD11 LEU B 31 -32.935 -44.920 3.668 1.00 0.00 H ATOM 1445 HD12 LEU B 31 -34.428 -45.188 2.736 1.00 0.00 H ATOM 1446 HD13 LEU B 31 -34.520 -44.757 4.461 1.00 0.00 H ATOM 1447 H LEU B 31 -32.473 -48.461 0.811 1.00 0.00 H ATOM 1448 N PRO B 32 -30.083 -48.357 3.407 1.00 33.84 N ATOM 1449 CA PRO B 32 -28.931 -48.475 4.250 1.00 32.52 C ATOM 1450 C PRO B 32 -27.736 -47.679 3.680 1.00 30.73 C ATOM 1451 O PRO B 32 -27.016 -47.045 4.438 1.00 29.22 O ATOM 1452 CB PRO B 32 -28.668 -49.984 4.275 1.00 33.27 C ATOM 1453 CG PRO B 32 -29.620 -50.608 3.289 1.00 33.03 C ATOM 1454 CD PRO B 32 -30.168 -49.500 2.486 1.00 35.31 C ATOM 1455 HA PRO B 32 -29.081 -48.064 5.248 1.00 0.00 H ATOM 1456 HD3 PRO B 32 -29.569 -49.329 1.591 1.00 0.00 H ATOM 1457 HD2 PRO B 32 -31.201 -49.697 2.198 1.00 0.00 H ATOM 1458 HG3 PRO B 32 -30.422 -51.127 3.814 1.00 0.00 H ATOM 1459 HG2 PRO B 32 -29.091 -51.314 2.648 1.00 0.00 H ATOM 1460 HB2 PRO B 32 -27.638 -50.191 3.985 1.00 0.00 H ATOM 1461 HB3 PRO B 32 -28.849 -50.380 5.274 1.00 0.00 H ATOM 1462 N LEU B 33 -27.540 -47.666 2.352 1.00 32.01 N ATOM 1463 CA LEU B 33 -26.689 -46.629 1.781 1.00 27.76 C ATOM 1464 C LEU B 33 -27.416 -45.248 1.745 1.00 27.05 C ATOM 1465 O LEU B 33 -26.781 -44.213 1.955 1.00 24.87 O ATOM 1466 CB LEU B 33 -26.116 -47.054 0.414 1.00 24.79 C ATOM 1467 CG LEU B 33 -25.415 -45.964 -0.409 1.00 22.99 C ATOM 1468 CD1 LEU B 33 -24.278 -45.339 0.396 1.00 22.94 C ATOM 1469 CD2 LEU B 33 -24.913 -46.581 -1.726 1.00 21.87 C ATOM 1470 HA LEU B 33 -25.829 -46.499 2.438 1.00 0.00 H ATOM 1471 HB2 LEU B 33 -25.393 -47.850 0.592 1.00 0.00 H ATOM 1472 HB3 LEU B 33 -26.941 -47.441 -0.184 1.00 0.00 H ATOM 1473 HG LEU B 33 -26.116 -45.163 -0.646 1.00 0.00 H ATOM 1474 HD21 LEU B 33 -24.212 -47.385 -1.505 1.00 0.00 H ATOM 1475 HD22 LEU B 33 -25.760 -46.979 -2.285 1.00 0.00 H ATOM 1476 HD23 LEU B 33 -24.413 -45.814 -2.318 1.00 0.00 H ATOM 1477 HD11 LEU B 33 -24.681 -44.894 1.306 1.00 0.00 H ATOM 1478 HD12 LEU B 33 -23.553 -46.110 0.657 1.00 0.00 H ATOM 1479 HD13 LEU B 33 -23.792 -44.568 -0.202 1.00 0.00 H ATOM 1480 H LEU B 33 -27.986 -48.381 1.743 1.00 0.00 H ATOM 1481 N LEU B 34 -28.748 -45.273 1.560 1.00 27.16 N ATOM 1482 CA LEU B 34 -29.603 -44.078 1.694 1.00 26.97 C ATOM 1483 C LEU B 34 -29.498 -43.497 3.098 1.00 31.84 C ATOM 1484 O LEU B 34 -29.533 -42.261 3.285 1.00 29.52 O ATOM 1485 CB LEU B 34 -31.066 -44.383 1.305 1.00 26.04 C ATOM 1486 CG LEU B 34 -32.120 -43.314 0.929 1.00 20.93 C ATOM 1487 CD1 LEU B 34 -31.689 -42.403 -0.200 1.00 24.11 C ATOM 1488 CD2 LEU B 34 -33.435 -43.977 0.515 1.00 19.44 C ATOM 1489 HA LEU B 34 -29.242 -43.323 0.995 1.00 0.00 H ATOM 1490 HB2 LEU B 34 -31.007 -45.050 0.445 1.00 0.00 H ATOM 1491 HB3 LEU B 34 -31.487 -44.923 2.153 1.00 0.00 H ATOM 1492 HG LEU B 34 -32.243 -42.708 1.827 1.00 0.00 H ATOM 1493 HD21 LEU B 34 -33.260 -44.620 -0.347 1.00 0.00 H ATOM 1494 HD22 LEU B 34 -33.816 -44.574 1.344 1.00 0.00 H ATOM 1495 HD23 LEU B 34 -34.162 -43.208 0.255 1.00 0.00 H ATOM 1496 HD11 LEU B 34 -30.780 -41.875 0.088 1.00 0.00 H ATOM 1497 HD12 LEU B 34 -31.498 -42.998 -1.093 1.00 0.00 H ATOM 1498 HD13 LEU B 34 -32.480 -41.682 -0.405 1.00 0.00 H ATOM 1499 H LEU B 34 -29.197 -46.178 1.311 1.00 0.00 H ATOM 1500 N LYS B 35 -29.346 -44.390 4.084 1.00 29.42 N ATOM 1501 CA LYS B 35 -28.994 -43.967 5.453 1.00 28.87 C ATOM 1502 C LYS B 35 -27.716 -43.106 5.523 1.00 27.90 C ATOM 1503 O LYS B 35 -27.627 -42.179 6.338 1.00 23.12 O ATOM 1504 CB LYS B 35 -28.815 -45.174 6.389 1.00 23.81 C ATOM 1505 CG LYS B 35 -29.941 -45.352 7.388 1.00 23.25 C ATOM 1506 CD LYS B 35 -30.864 -46.547 7.048 1.00 22.21 C ATOM 1507 CE LYS B 35 -32.309 -46.099 7.208 1.00 21.24 C ATOM 1508 NZ LYS B 35 -32.785 -45.939 8.586 1.00 23.89 N ATOM 1509 HA LYS B 35 -29.835 -43.355 5.779 1.00 0.00 H ATOM 1510 HB2 LYS B 35 -28.752 -46.075 5.779 1.00 0.00 H ATOM 1511 HB3 LYS B 35 -27.884 -45.045 6.941 1.00 0.00 H ATOM 1512 HG2 LYS B 35 -29.508 -45.516 8.375 1.00 0.00 H ATOM 1513 HG3 LYS B 35 -30.541 -44.442 7.402 1.00 0.00 H ATOM 1514 HD2 LYS B 35 -30.689 -46.867 6.021 1.00 0.00 H ATOM 1515 HD3 LYS B 35 -30.658 -47.376 7.725 1.00 0.00 H ATOM 1516 HE2 LYS B 35 -32.944 -46.839 6.720 1.00 0.00 H ATOM 1517 HE3 LYS B 35 -32.418 -45.139 6.704 1.00 0.00 H ATOM 1518 HZ1 LYS B 35 -32.707 -46.848 9.086 1.00 0.00 H ATOM 1519 HZ2 LYS B 35 -32.206 -45.224 9.071 1.00 0.00 H ATOM 1520 HZ3 LYS B 35 -33.779 -45.632 8.575 1.00 0.00 H ATOM 1521 H LYS B 35 -29.479 -45.401 3.881 1.00 0.00 H ATOM 1522 N ILE B 36 -26.714 -43.436 4.713 1.00 27.65 N ATOM 1523 CA ILE B 36 -25.340 -42.921 4.962 1.00 25.49 C ATOM 1524 C ILE B 36 -25.197 -41.615 4.221 1.00 22.80 C ATOM 1525 O ILE B 36 -24.668 -40.595 4.745 1.00 18.31 O ATOM 1526 CB ILE B 36 -24.249 -43.947 4.498 1.00 25.15 C ATOM 1527 CG1 ILE B 36 -24.315 -45.235 5.370 1.00 20.59 C ATOM 1528 CG2 ILE B 36 -22.863 -43.290 4.469 1.00 22.18 C ATOM 1529 CD1 ILE B 36 -23.257 -46.285 5.022 1.00 23.74 C ATOM 1530 HA ILE B 36 -25.192 -42.770 6.031 1.00 0.00 H ATOM 1531 HB ILE B 36 -24.451 -44.259 3.474 1.00 0.00 H ATOM 1532 HG12 ILE B 36 -24.182 -44.949 6.413 1.00 0.00 H ATOM 1533 HG13 ILE B 36 -25.299 -45.685 5.241 1.00 0.00 H ATOM 1534 HD11 ILE B 36 -23.382 -46.594 3.984 1.00 0.00 H ATOM 1535 HD12 ILE B 36 -22.264 -45.857 5.158 1.00 0.00 H ATOM 1536 HD13 ILE B 36 -23.375 -47.148 5.677 1.00 0.00 H ATOM 1537 HG21 ILE B 36 -22.875 -42.450 3.775 1.00 0.00 H ATOM 1538 HG22 ILE B 36 -22.610 -42.934 5.468 1.00 0.00 H ATOM 1539 HG23 ILE B 36 -22.123 -44.021 4.144 1.00 0.00 H ATOM 1540 H ILE B 36 -26.892 -44.059 3.899 1.00 0.00 H ATOM 1541 N LEU B 37 -25.725 -41.624 2.988 1.00 24.04 N ATOM 1542 CA LEU B 37 -25.808 -40.381 2.224 1.00 22.36 C ATOM 1543 C LEU B 37 -26.431 -39.269 3.102 1.00 25.17 C ATOM 1544 O LEU B 37 -25.831 -38.170 3.297 1.00 25.16 O ATOM 1545 CB LEU B 37 -26.522 -40.597 0.892 1.00 19.25 C ATOM 1546 CG LEU B 37 -26.196 -41.928 0.176 1.00 15.24 C ATOM 1547 CD1 LEU B 37 -27.227 -42.112 -0.928 1.00 15.61 C ATOM 1548 CD2 LEU B 37 -24.770 -42.046 -0.355 1.00 13.51 C ATOM 1549 HA LEU B 37 -24.807 -40.044 1.956 1.00 0.00 H ATOM 1550 HB2 LEU B 37 -27.596 -40.568 1.077 1.00 0.00 H ATOM 1551 HB3 LEU B 37 -26.247 -39.780 0.226 1.00 0.00 H ATOM 1552 HG LEU B 37 -26.252 -42.729 0.913 1.00 0.00 H ATOM 1553 HD21 LEU B 37 -24.585 -41.250 -1.077 1.00 0.00 H ATOM 1554 HD22 LEU B 37 -24.067 -41.957 0.473 1.00 0.00 H ATOM 1555 HD23 LEU B 37 -24.643 -43.014 -0.839 1.00 0.00 H ATOM 1556 HD11 LEU B 37 -28.224 -42.147 -0.490 1.00 0.00 H ATOM 1557 HD12 LEU B 37 -27.164 -41.276 -1.625 1.00 0.00 H ATOM 1558 HD13 LEU B 37 -27.028 -43.044 -1.457 1.00 0.00 H ATOM 1559 H LEU B 37 -26.074 -42.513 2.577 1.00 0.00 H ATOM 1560 N HIS B 38 -27.578 -39.579 3.696 1.00 25.18 N ATOM 1561 CA HIS B 38 -28.376 -38.559 4.338 1.00 24.60 C ATOM 1562 C HIS B 38 -27.711 -38.004 5.540 1.00 24.78 C ATOM 1563 O HIS B 38 -27.880 -36.833 5.848 1.00 26.10 O ATOM 1564 CB HIS B 38 -29.737 -39.084 4.701 1.00 24.13 C ATOM 1565 CG HIS B 38 -30.693 -39.109 3.531 1.00 25.62 C ATOM 1566 ND1 HIS B 38 -31.423 -40.187 3.216 1.00 21.61 N ATOM 1567 CD2 HIS B 38 -31.006 -38.129 2.601 1.00 23.26 C ATOM 1568 CE1 HIS B 38 -32.184 -39.917 2.170 1.00 21.79 C ATOM 1569 NE2 HIS B 38 -31.920 -38.648 1.777 1.00 24.23 N ATOM 1570 HA HIS B 38 -28.489 -37.751 3.615 1.00 0.00 H ATOM 1571 HB2 HIS B 38 -29.627 -40.099 5.082 1.00 0.00 H ATOM 1572 HB3 HIS B 38 -30.158 -38.449 5.480 1.00 0.00 H ATOM 1573 HD2 HIS B 38 -30.585 -37.125 2.552 1.00 0.00 H ATOM 1574 HE1 HIS B 38 -32.899 -40.596 1.705 1.00 0.00 H ATOM 1575 H HIS B 38 -27.905 -40.566 3.699 1.00 0.00 H ATOM 1576 N ALA B 39 -26.948 -38.860 6.212 1.00 27.03 N ATOM 1577 CA ALA B 39 -26.174 -38.496 7.408 1.00 29.64 C ATOM 1578 C ALA B 39 -25.188 -37.328 7.199 1.00 31.18 C ATOM 1579 O ALA B 39 -24.834 -36.631 8.160 1.00 31.40 O ATOM 1580 CB ALA B 39 -25.410 -39.712 7.904 1.00 30.12 C ATOM 1581 HA ALA B 39 -26.901 -38.152 8.143 1.00 0.00 H ATOM 1582 HB1 ALA B 39 -26.115 -40.505 8.153 1.00 0.00 H ATOM 1583 HB2 ALA B 39 -24.733 -40.058 7.123 1.00 0.00 H ATOM 1584 HB3 ALA B 39 -24.836 -39.442 8.791 1.00 0.00 H ATOM 1585 H ALA B 39 -26.895 -39.842 5.873 1.00 0.00 H ATOM 1586 N ALA B 40 -24.701 -37.176 5.961 1.00 31.81 N ATOM 1587 CA ALA B 40 -23.767 -36.108 5.593 1.00 29.66 C ATOM 1588 C ALA B 40 -24.531 -35.156 4.686 1.00 32.07 C ATOM 1589 O ALA B 40 -24.004 -34.630 3.676 1.00 30.76 O ATOM 1590 CB ALA B 40 -22.564 -36.674 4.877 1.00 27.35 C ATOM 1591 HA ALA B 40 -23.396 -35.592 6.479 1.00 0.00 H ATOM 1592 HB1 ALA B 40 -22.053 -37.380 5.531 1.00 0.00 H ATOM 1593 HB2 ALA B 40 -22.889 -37.186 3.971 1.00 0.00 H ATOM 1594 HB3 ALA B 40 -21.885 -35.863 4.614 1.00 0.00 H ATOM 1595 H ALA B 40 -25.000 -37.848 5.225 1.00 0.00 H ATOM 1596 N GLY B 41 -25.803 -35.002 5.042 1.00 33.64 N ATOM 1597 CA GLY B 41 -26.640 -33.898 4.595 1.00 34.01 C ATOM 1598 C GLY B 41 -27.123 -34.031 3.171 1.00 37.49 C ATOM 1599 O GLY B 41 -27.425 -33.040 2.544 1.00 35.59 O ATOM 1600 HA3 GLY B 41 -26.064 -32.976 4.677 1.00 0.00 H ATOM 1601 HA2 GLY B 41 -27.510 -33.841 5.249 1.00 0.00 H ATOM 1602 H GLY B 41 -26.224 -35.711 5.676 1.00 0.00 H ATOM 1603 N ALA B 42 -27.198 -35.252 2.660 1.00 41.69 N ATOM 1604 CA ALA B 42 -27.863 -35.471 1.392 1.00 43.40 C ATOM 1605 C ALA B 42 -29.355 -35.534 1.677 1.00 43.56 C ATOM 1606 O ALA B 42 -29.739 -35.809 2.815 1.00 45.76 O ATOM 1607 CB ALA B 42 -27.402 -36.784 0.795 1.00 45.44 C ATOM 1608 HA ALA B 42 -27.633 -34.672 0.687 1.00 0.00 H ATOM 1609 HB1 ALA B 42 -26.324 -36.752 0.638 1.00 0.00 H ATOM 1610 HB2 ALA B 42 -27.647 -37.598 1.478 1.00 0.00 H ATOM 1611 HB3 ALA B 42 -27.905 -36.944 -0.159 1.00 0.00 H ATOM 1612 H ALA B 42 -26.778 -36.055 3.171 1.00 0.00 H ATOM 1613 N GLN B 43 -30.174 -35.259 0.657 1.00 40.31 N ATOM 1614 CA GLN B 43 -31.610 -35.593 0.633 1.00 38.73 C ATOM 1615 C GLN B 43 -32.147 -36.099 -0.729 1.00 31.95 C ATOM 1616 O GLN B 43 -31.563 -35.858 -1.779 1.00 30.07 O ATOM 1617 CB GLN B 43 -32.481 -34.448 1.198 1.00 41.94 C ATOM 1618 CG GLN B 43 -31.774 -33.101 1.262 1.00 40.84 C ATOM 1619 CD GLN B 43 -32.616 -32.034 1.917 1.00 43.62 C ATOM 1620 OE1 GLN B 43 -33.778 -31.822 1.531 1.00 43.92 O ATOM 1621 NE2 GLN B 43 -32.032 -31.330 2.904 1.00 38.75 N ATOM 1622 HA GLN B 43 -31.695 -36.451 1.299 1.00 0.00 H ATOM 1623 HB2 GLN B 43 -33.361 -34.343 0.564 1.00 0.00 H ATOM 1624 HB3 GLN B 43 -32.792 -34.720 2.207 1.00 0.00 H ATOM 1625 HG2 GLN B 43 -30.852 -33.217 1.832 1.00 0.00 H ATOM 1626 HG3 GLN B 43 -31.535 -32.783 0.247 1.00 0.00 H ATOM 1627 HE22 GLN B 43 -31.056 -31.547 3.190 1.00 0.00 H ATOM 1628 HE21 GLN B 43 -32.557 -30.569 3.381 1.00 0.00 H ATOM 1629 H GLN B 43 -29.772 -34.778 -0.173 1.00 0.00 H ATOM 1630 N GLY B 44 -33.259 -36.814 -0.670 1.00 32.03 N ATOM 1631 CA GLY B 44 -33.907 -37.388 -1.844 1.00 29.32 C ATOM 1632 C GLY B 44 -33.858 -38.890 -2.017 1.00 30.32 C ATOM 1633 O GLY B 44 -33.518 -39.647 -1.102 1.00 26.96 O ATOM 1634 HA3 GLY B 44 -33.439 -36.944 -2.723 1.00 0.00 H ATOM 1635 HA2 GLY B 44 -34.957 -37.099 -1.809 1.00 0.00 H ATOM 1636 H GLY B 44 -33.693 -36.975 0.261 1.00 0.00 H ATOM 1637 N GLU B 45 -34.258 -39.346 -3.202 1.00 29.97 N ATOM 1638 CA GLU B 45 -34.386 -40.755 -3.417 1.00 29.29 C ATOM 1639 C GLU B 45 -33.508 -41.279 -4.541 1.00 33.29 C ATOM 1640 O GLU B 45 -33.123 -42.438 -4.548 1.00 34.08 O ATOM 1641 CB GLU B 45 -35.858 -41.103 -3.659 1.00 24.57 C ATOM 1642 CG GLU B 45 -36.770 -40.901 -2.484 1.00 23.45 C ATOM 1643 CD GLU B 45 -37.878 -41.953 -2.386 1.00 23.44 C ATOM 1644 OE1 GLU B 45 -38.412 -42.182 -1.258 1.00 23.38 O ATOM 1645 OE2 GLU B 45 -38.166 -42.591 -3.428 1.00 24.64 O ATOM 1646 HA GLU B 45 -34.031 -41.253 -2.515 1.00 0.00 H ATOM 1647 HB2 GLU B 45 -36.221 -40.481 -4.477 1.00 0.00 H ATOM 1648 HB3 GLU B 45 -35.912 -42.152 -3.950 1.00 0.00 H ATOM 1649 HG2 GLU B 45 -36.174 -40.941 -1.573 1.00 0.00 H ATOM 1650 HG3 GLU B 45 -37.233 -39.918 -2.571 1.00 0.00 H ATOM 1651 H GLU B 45 -34.477 -38.680 -3.970 1.00 0.00 H ATOM 1652 N MET B 46 -33.196 -40.381 -5.467 1.00 40.30 N ATOM 1653 CA MET B 46 -32.370 -40.662 -6.608 1.00 43.09 C ATOM 1654 C MET B 46 -31.167 -39.733 -6.504 1.00 42.47 C ATOM 1655 O MET B 46 -31.269 -38.634 -5.963 1.00 43.09 O ATOM 1656 CB MET B 46 -33.142 -40.364 -7.888 1.00 40.35 C ATOM 1657 CG MET B 46 -34.508 -41.018 -7.949 1.00 45.31 C ATOM 1658 SD MET B 46 -34.511 -42.536 -8.909 1.00 44.33 S ATOM 1659 CE MET B 46 -33.676 -42.003 -10.409 1.00 51.20 C ATOM 1660 HA MET B 46 -32.065 -41.708 -6.632 1.00 0.00 H ATOM 1661 HB2 MET B 46 -33.274 -39.285 -7.966 1.00 0.00 H ATOM 1662 HB3 MET B 46 -32.554 -40.719 -8.734 1.00 0.00 H ATOM 1663 HG2 MET B 46 -35.210 -40.318 -8.402 1.00 0.00 H ATOM 1664 HG3 MET B 46 -34.830 -41.247 -6.933 1.00 0.00 H ATOM 1665 HE1 MET B 46 -34.244 -41.196 -10.872 1.00 0.00 H ATOM 1666 HE2 MET B 46 -32.676 -41.649 -10.160 1.00 0.00 H ATOM 1667 HE3 MET B 46 -33.604 -42.842 -11.101 1.00 0.00 H ATOM 1668 H MET B 46 -33.572 -39.417 -5.360 1.00 0.00 H ATOM 1669 N PHE B 47 -30.024 -40.197 -7.003 1.00 44.75 N ATOM 1670 CA PHE B 47 -28.788 -39.404 -6.977 1.00 38.09 C ATOM 1671 C PHE B 47 -27.946 -39.895 -8.102 1.00 35.27 C ATOM 1672 O PHE B 47 -28.005 -41.083 -8.434 1.00 26.74 O ATOM 1673 CB PHE B 47 -27.969 -39.694 -5.718 1.00 37.75 C ATOM 1674 CG PHE B 47 -28.591 -39.201 -4.437 1.00 38.33 C ATOM 1675 CD1 PHE B 47 -28.558 -37.856 -4.107 1.00 33.90 C ATOM 1676 CD2 PHE B 47 -29.217 -40.093 -3.570 1.00 35.27 C ATOM 1677 CE1 PHE B 47 -29.131 -37.396 -2.938 1.00 36.93 C ATOM 1678 CE2 PHE B 47 -29.804 -39.640 -2.391 1.00 40.28 C ATOM 1679 CZ PHE B 47 -29.763 -38.287 -2.079 1.00 35.00 C ATOM 1680 HA PHE B 47 -29.047 -38.346 -7.026 1.00 0.00 H ATOM 1681 HB2 PHE B 47 -27.837 -40.773 -5.639 1.00 0.00 H ATOM 1682 HB3 PHE B 47 -26.995 -39.218 -5.829 1.00 0.00 H ATOM 1683 HD2 PHE B 47 -29.248 -41.154 -3.816 1.00 0.00 H ATOM 1684 HE2 PHE B 47 -30.293 -40.343 -1.717 1.00 0.00 H ATOM 1685 HZ PHE B 47 -30.226 -37.925 -1.161 1.00 0.00 H ATOM 1686 HE1 PHE B 47 -29.088 -36.336 -2.689 1.00 0.00 H ATOM 1687 HD1 PHE B 47 -28.072 -37.150 -4.781 1.00 0.00 H ATOM 1688 H PHE B 47 -30.005 -41.148 -7.423 1.00 0.00 H ATOM 1689 N THR B 48 -27.093 -39.019 -8.637 1.00 30.66 N ATOM 1690 CA THR B 48 -26.028 -39.516 -9.513 1.00 26.25 C ATOM 1691 C THR B 48 -24.975 -40.361 -8.809 1.00 28.88 C ATOM 1692 O THR B 48 -24.985 -40.464 -7.618 1.00 29.96 O ATOM 1693 CB THR B 48 -25.320 -38.406 -10.252 1.00 22.01 C ATOM 1694 OG1 THR B 48 -24.774 -37.487 -9.309 1.00 23.02 O ATOM 1695 CG2 THR B 48 -26.337 -37.700 -11.239 1.00 24.43 C ATOM 1696 HA THR B 48 -26.562 -40.155 -10.216 1.00 0.00 H ATOM 1697 HB THR B 48 -24.499 -38.807 -10.847 1.00 0.00 H ATOM 1698 HG1 THR B 48 -25.504 -37.107 -8.759 1.00 0.00 H ATOM 1699 HG23 THR B 48 -26.730 -38.435 -11.941 1.00 0.00 H ATOM 1700 HG21 THR B 48 -27.158 -37.269 -10.666 1.00 0.00 H ATOM 1701 HG22 THR B 48 -25.821 -36.912 -11.787 1.00 0.00 H ATOM 1702 H THR B 48 -27.182 -38.003 -8.436 1.00 0.00 H ATOM 1703 N VAL B 49 -24.072 -40.964 -9.575 1.00 28.76 N ATOM 1704 CA VAL B 49 -22.965 -41.746 -9.031 1.00 29.80 C ATOM 1705 C VAL B 49 -22.066 -40.978 -8.061 1.00 32.01 C ATOM 1706 O VAL B 49 -21.640 -41.501 -6.965 1.00 28.38 O ATOM 1707 CB VAL B 49 -22.056 -42.223 -10.174 1.00 30.59 C ATOM 1708 CG1 VAL B 49 -20.837 -42.939 -9.585 1.00 25.95 C ATOM 1709 CG2 VAL B 49 -22.826 -43.177 -11.086 1.00 28.87 C ATOM 1710 HA VAL B 49 -23.439 -42.564 -8.489 1.00 0.00 H ATOM 1711 HB VAL B 49 -21.727 -41.364 -10.759 1.00 0.00 H ATOM 1712 HG11 VAL B 49 -20.287 -42.250 -8.944 1.00 0.00 H ATOM 1713 HG12 VAL B 49 -21.169 -43.796 -8.999 1.00 0.00 H ATOM 1714 HG13 VAL B 49 -20.190 -43.278 -10.394 1.00 0.00 H ATOM 1715 HG21 VAL B 49 -23.161 -44.039 -10.508 1.00 0.00 H ATOM 1716 HG22 VAL B 49 -23.690 -42.660 -11.504 1.00 0.00 H ATOM 1717 HG23 VAL B 49 -22.175 -43.511 -11.894 1.00 0.00 H ATOM 1718 H VAL B 49 -24.157 -40.875 -10.608 1.00 0.00 H ATOM 1719 N LYS B 50 -21.791 -39.742 -8.489 1.00 33.65 N ATOM 1720 CA LYS B 50 -20.690 -38.910 -8.039 1.00 35.20 C ATOM 1721 C LYS B 50 -21.090 -37.975 -6.888 1.00 37.68 C ATOM 1722 O LYS B 50 -20.340 -37.862 -5.920 1.00 38.14 O ATOM 1723 CB LYS B 50 -20.063 -38.177 -9.249 1.00 37.58 C ATOM 1724 CG LYS B 50 -20.867 -37.024 -9.862 1.00 36.34 C ATOM 1725 CD LYS B 50 -20.421 -35.629 -9.383 1.00 36.20 C ATOM 1726 CE LYS B 50 -21.275 -34.529 -10.042 1.00 37.26 C ATOM 1727 NZ LYS B 50 -21.633 -34.820 -11.471 1.00 34.19 N ATOM 1728 HA LYS B 50 -19.919 -39.550 -7.609 1.00 0.00 H ATOM 1729 HB2 LYS B 50 -19.103 -37.773 -8.927 1.00 0.00 H ATOM 1730 HB3 LYS B 50 -19.900 -38.917 -10.033 1.00 0.00 H ATOM 1731 HG2 LYS B 50 -20.757 -37.067 -10.946 1.00 0.00 H ATOM 1732 HG3 LYS B 50 -21.916 -37.159 -9.599 1.00 0.00 H ATOM 1733 HD2 LYS B 50 -20.533 -35.569 -8.300 1.00 0.00 H ATOM 1734 HD3 LYS B 50 -19.375 -35.477 -9.648 1.00 0.00 H ATOM 1735 HE2 LYS B 50 -20.717 -33.593 -10.010 1.00 0.00 H ATOM 1736 HE3 LYS B 50 -22.197 -34.420 -9.471 1.00 0.00 H ATOM 1737 HZ1 LYS B 50 -20.763 -34.916 -12.032 1.00 0.00 H ATOM 1738 HZ2 LYS B 50 -22.177 -35.705 -11.518 1.00 0.00 H ATOM 1739 HZ3 LYS B 50 -22.207 -34.039 -11.849 1.00 0.00 H ATOM 1740 H LYS B 50 -22.423 -39.340 -9.210 1.00 0.00 H ATOM 1741 N GLU B 51 -22.247 -37.313 -6.985 1.00 39.37 N ATOM 1742 CA GLU B 51 -22.944 -36.818 -5.783 1.00 35.51 C ATOM 1743 C GLU B 51 -22.970 -37.919 -4.725 1.00 33.87 C ATOM 1744 O GLU B 51 -22.674 -37.655 -3.563 1.00 34.62 O ATOM 1745 CB GLU B 51 -24.376 -36.358 -6.086 1.00 40.14 C ATOM 1746 CG GLU B 51 -24.488 -35.439 -7.298 1.00 35.71 C ATOM 1747 CD GLU B 51 -25.899 -34.915 -7.529 1.00 40.16 C ATOM 1748 OE1 GLU B 51 -26.795 -35.704 -7.926 1.00 43.65 O ATOM 1749 OE2 GLU B 51 -26.098 -33.704 -7.335 1.00 30.97 O ATOM 1750 HA GLU B 51 -22.396 -35.950 -5.416 1.00 0.00 H ATOM 1751 HB2 GLU B 51 -24.989 -37.241 -6.267 1.00 0.00 H ATOM 1752 HB3 GLU B 51 -24.757 -35.825 -5.215 1.00 0.00 H ATOM 1753 HG2 GLU B 51 -23.823 -34.588 -7.150 1.00 0.00 H ATOM 1754 HG3 GLU B 51 -24.175 -35.993 -8.183 1.00 0.00 H ATOM 1755 H GLU B 51 -22.663 -37.144 -7.923 1.00 0.00 H ATOM 1756 N VAL B 52 -23.321 -39.134 -5.129 1.00 32.82 N ATOM 1757 CA VAL B 52 -23.260 -40.307 -4.253 1.00 31.98 C ATOM 1758 C VAL B 52 -21.836 -40.576 -3.797 1.00 32.31 C ATOM 1759 O VAL B 52 -21.550 -40.652 -2.587 1.00 26.32 O ATOM 1760 CB VAL B 52 -23.822 -41.579 -4.905 1.00 32.25 C ATOM 1761 CG1 VAL B 52 -23.290 -42.843 -4.216 1.00 27.78 C ATOM 1762 CG2 VAL B 52 -25.345 -41.545 -4.899 1.00 33.81 C ATOM 1763 HA VAL B 52 -23.889 -40.064 -3.396 1.00 0.00 H ATOM 1764 HB VAL B 52 -23.483 -41.611 -5.940 1.00 0.00 H ATOM 1765 HG11 VAL B 52 -22.203 -42.866 -4.291 1.00 0.00 H ATOM 1766 HG12 VAL B 52 -23.583 -42.833 -3.166 1.00 0.00 H ATOM 1767 HG13 VAL B 52 -23.708 -43.724 -4.703 1.00 0.00 H ATOM 1768 HG21 VAL B 52 -25.702 -41.483 -3.871 1.00 0.00 H ATOM 1769 HG22 VAL B 52 -25.690 -40.675 -5.458 1.00 0.00 H ATOM 1770 HG23 VAL B 52 -25.729 -42.453 -5.364 1.00 0.00 H ATOM 1771 H VAL B 52 -23.653 -39.258 -6.107 1.00 0.00 H ATOM 1772 N MET B 53 -20.955 -40.756 -4.770 1.00 30.06 N ATOM 1773 CA MET B 53 -19.554 -40.949 -4.518 1.00 27.36 C ATOM 1774 C MET B 53 -19.175 -39.845 -3.582 1.00 26.83 C ATOM 1775 O MET B 53 -18.335 -39.999 -2.648 1.00 22.70 O ATOM 1776 CB MET B 53 -18.784 -40.855 -5.857 1.00 27.10 C ATOM 1777 CG MET B 53 -18.483 -42.238 -6.450 1.00 26.43 C ATOM 1778 SD MET B 53 -17.899 -43.454 -5.206 1.00 28.18 S ATOM 1779 CE MET B 53 -16.564 -42.412 -4.582 1.00 21.92 C ATOM 1780 HA MET B 53 -19.320 -41.922 -4.085 1.00 0.00 H ATOM 1781 HB2 MET B 53 -19.385 -40.290 -6.569 1.00 0.00 H ATOM 1782 HB3 MET B 53 -17.842 -40.334 -5.685 1.00 0.00 H ATOM 1783 HG2 MET B 53 -17.712 -42.127 -7.213 1.00 0.00 H ATOM 1784 HG3 MET B 53 -19.394 -42.623 -6.909 1.00 0.00 H ATOM 1785 HE1 MET B 53 -15.873 -42.185 -5.393 1.00 0.00 H ATOM 1786 HE2 MET B 53 -16.982 -41.485 -4.189 1.00 0.00 H ATOM 1787 HE3 MET B 53 -16.034 -42.939 -3.788 1.00 0.00 H ATOM 1788 H MET B 53 -21.291 -40.758 -5.754 1.00 0.00 H ATOM 1789 N HIS B 54 -19.866 -38.728 -3.793 1.00 22.25 N ATOM 1790 CA HIS B 54 -19.510 -37.522 -3.120 1.00 20.68 C ATOM 1791 C HIS B 54 -20.138 -37.377 -1.775 1.00 23.50 C ATOM 1792 O HIS B 54 -19.745 -36.480 -1.024 1.00 26.88 O ATOM 1793 CB HIS B 54 -19.844 -36.317 -3.964 1.00 18.77 C ATOM 1794 CG HIS B 54 -20.102 -35.067 -3.148 1.00 17.35 C ATOM 1795 ND1 HIS B 54 -19.086 -34.255 -2.692 1.00 14.82 N ATOM 1796 CD2 HIS B 54 -21.300 -34.484 -2.725 1.00 16.62 C ATOM 1797 CE1 HIS B 54 -19.605 -33.256 -2.003 1.00 15.34 C ATOM 1798 NE2 HIS B 54 -20.966 -33.406 -1.993 1.00 15.93 N ATOM 1799 HA HIS B 54 -18.433 -37.583 -2.964 1.00 0.00 H ATOM 1800 HB2 HIS B 54 -19.009 -36.124 -4.638 1.00 0.00 H ATOM 1801 HB3 HIS B 54 -20.737 -36.540 -4.548 1.00 0.00 H ATOM 1802 HD2 HIS B 54 -22.308 -34.835 -2.945 1.00 0.00 H ATOM 1803 HE1 HIS B 54 -19.047 -32.451 -1.525 1.00 0.00 H ATOM 1804 H HIS B 54 -20.670 -38.734 -4.452 1.00 0.00 H ATOM 1805 N TYR B 55 -21.140 -38.176 -1.413 1.00 24.77 N ATOM 1806 CA TYR B 55 -21.596 -38.004 -0.014 1.00 25.98 C ATOM 1807 C TYR B 55 -20.863 -38.894 0.936 1.00 26.12 C ATOM 1808 O TYR B 55 -20.326 -38.425 1.951 1.00 26.68 O ATOM 1809 CB TYR B 55 -23.114 -38.050 0.193 1.00 26.25 C ATOM 1810 CG TYR B 55 -23.772 -36.747 -0.197 1.00 27.16 C ATOM 1811 CD1 TYR B 55 -23.496 -35.525 0.462 1.00 24.92 C ATOM 1812 CD2 TYR B 55 -24.674 -36.751 -1.233 1.00 29.67 C ATOM 1813 CE1 TYR B 55 -24.127 -34.335 0.035 1.00 30.03 C ATOM 1814 CE2 TYR B 55 -25.297 -35.596 -1.653 1.00 31.89 C ATOM 1815 CZ TYR B 55 -25.042 -34.410 -1.029 1.00 27.28 C ATOM 1816 OH TYR B 55 -25.772 -33.389 -1.577 1.00 32.67 O ATOM 1817 HA TYR B 55 -21.330 -36.975 0.227 1.00 0.00 H ATOM 1818 HB3 TYR B 55 -23.321 -38.250 1.244 1.00 0.00 H ATOM 1819 HB2 TYR B 55 -23.530 -38.852 -0.417 1.00 0.00 H ATOM 1820 HD2 TYR B 55 -24.903 -37.691 -1.735 1.00 0.00 H ATOM 1821 HE2 TYR B 55 -25.997 -35.630 -2.488 1.00 0.00 H ATOM 1822 HE1 TYR B 55 -23.910 -33.383 0.519 1.00 0.00 H ATOM 1823 HD1 TYR B 55 -22.797 -35.502 1.298 1.00 0.00 H ATOM 1824 HH TYR B 55 -25.564 -32.545 -1.103 1.00 0.00 H ATOM 1825 H TYR B 55 -21.569 -38.867 -2.062 1.00 0.00 H ATOM 1826 N LEU B 56 -20.778 -40.177 0.590 1.00 27.81 N ATOM 1827 CA LEU B 56 -19.728 -41.041 1.190 1.00 27.95 C ATOM 1828 C LEU B 56 -18.413 -40.230 1.509 1.00 27.77 C ATOM 1829 O LEU B 56 -17.924 -40.182 2.660 1.00 25.61 O ATOM 1830 CB LEU B 56 -19.459 -42.244 0.259 1.00 27.90 C ATOM 1831 CG LEU B 56 -20.647 -43.212 0.154 1.00 30.70 C ATOM 1832 CD1 LEU B 56 -20.646 -43.922 -1.187 1.00 26.97 C ATOM 1833 CD2 LEU B 56 -20.707 -44.228 1.313 1.00 32.26 C ATOM 1834 HA LEU B 56 -20.087 -41.418 2.148 1.00 0.00 H ATOM 1835 HB2 LEU B 56 -19.232 -41.866 -0.738 1.00 0.00 H ATOM 1836 HB3 LEU B 56 -18.599 -42.793 0.643 1.00 0.00 H ATOM 1837 HG LEU B 56 -21.548 -42.604 0.232 1.00 0.00 H ATOM 1838 HD21 LEU B 56 -19.795 -44.825 1.319 1.00 0.00 H ATOM 1839 HD22 LEU B 56 -20.799 -43.694 2.259 1.00 0.00 H ATOM 1840 HD23 LEU B 56 -21.569 -44.881 1.178 1.00 0.00 H ATOM 1841 HD11 LEU B 56 -20.720 -43.185 -1.987 1.00 0.00 H ATOM 1842 HD12 LEU B 56 -19.720 -44.487 -1.297 1.00 0.00 H ATOM 1843 HD13 LEU B 56 -21.497 -44.602 -1.237 1.00 0.00 H ATOM 1844 H LEU B 56 -21.447 -40.575 -0.100 1.00 0.00 H ATOM 1845 N GLY B 57 -17.857 -39.565 0.508 1.00 26.49 N ATOM 1846 CA GLY B 57 -16.774 -38.590 0.724 1.00 27.67 C ATOM 1847 C GLY B 57 -16.958 -37.724 1.949 1.00 25.97 C ATOM 1848 O GLY B 57 -15.998 -37.473 2.707 1.00 26.18 O ATOM 1849 HA3 GLY B 57 -16.719 -37.940 -0.150 1.00 0.00 H ATOM 1850 HA2 GLY B 57 -15.837 -39.137 0.829 1.00 0.00 H ATOM 1851 H GLY B 57 -18.195 -39.736 -0.460 1.00 0.00 H ATOM 1852 N GLN B 58 -18.194 -37.300 2.176 1.00 29.52 N ATOM 1853 CA GLN B 58 -18.548 -36.359 3.247 1.00 25.11 C ATOM 1854 C GLN B 58 -18.736 -37.066 4.600 1.00 25.60 C ATOM 1855 O GLN B 58 -18.108 -36.681 5.621 1.00 24.09 O ATOM 1856 CB GLN B 58 -19.827 -35.620 2.835 1.00 26.56 C ATOM 1857 CG GLN B 58 -19.629 -34.507 1.803 1.00 24.30 C ATOM 1858 CD GLN B 58 -19.368 -33.154 2.443 1.00 25.02 C ATOM 1859 OE1 GLN B 58 -19.994 -32.146 2.078 1.00 24.98 O ATOM 1860 NE2 GLN B 58 -18.465 -33.116 3.461 1.00 28.14 N ATOM 1861 HA GLN B 58 -17.730 -35.652 3.382 1.00 0.00 H ATOM 1862 HB2 GLN B 58 -20.519 -36.350 2.416 1.00 0.00 H ATOM 1863 HB3 GLN B 58 -20.265 -35.178 3.730 1.00 0.00 H ATOM 1864 HG2 GLN B 58 -18.779 -34.764 1.171 1.00 0.00 H ATOM 1865 HG3 GLN B 58 -20.527 -34.436 1.190 1.00 0.00 H ATOM 1866 HE22 GLN B 58 -17.959 -33.981 3.740 1.00 0.00 H ATOM 1867 HE21 GLN B 58 -18.281 -32.222 3.960 1.00 0.00 H ATOM 1868 H GLN B 58 -18.955 -37.653 1.562 1.00 0.00 H ATOM 1869 N TYR B 59 -19.607 -38.084 4.597 1.00 27.03 N ATOM 1870 CA TYR B 59 -19.688 -39.041 5.685 1.00 23.82 C ATOM 1871 C TYR B 59 -18.273 -39.311 6.193 1.00 25.18 C ATOM 1872 O TYR B 59 -17.977 -39.056 7.378 1.00 23.84 O ATOM 1873 CB TYR B 59 -20.295 -40.354 5.175 1.00 24.07 C ATOM 1874 CG TYR B 59 -20.625 -41.284 6.296 1.00 19.92 C ATOM 1875 CD1 TYR B 59 -21.766 -41.068 7.054 1.00 19.83 C ATOM 1876 CD2 TYR B 59 -19.814 -42.391 6.579 1.00 20.89 C ATOM 1877 CE1 TYR B 59 -22.111 -41.920 8.103 1.00 19.06 C ATOM 1878 CE2 TYR B 59 -20.141 -43.267 7.601 1.00 18.01 C ATOM 1879 CZ TYR B 59 -21.283 -42.987 8.378 1.00 18.83 C ATOM 1880 OH TYR B 59 -21.666 -43.844 9.409 1.00 27.55 O ATOM 1881 HA TYR B 59 -20.313 -38.643 6.484 1.00 0.00 H ATOM 1882 HB3 TYR B 59 -19.579 -40.840 4.512 1.00 0.00 H ATOM 1883 HB2 TYR B 59 -21.207 -40.130 4.622 1.00 0.00 H ATOM 1884 HD2 TYR B 59 -18.915 -42.565 5.988 1.00 0.00 H ATOM 1885 HE2 TYR B 59 -19.532 -44.149 7.799 1.00 0.00 H ATOM 1886 HE1 TYR B 59 -23.013 -41.746 8.690 1.00 0.00 H ATOM 1887 HD1 TYR B 59 -22.406 -40.216 6.826 1.00 0.00 H ATOM 1888 HH TYR B 59 -20.937 -43.903 10.076 1.00 0.00 H ATOM 1889 H TYR B 59 -20.248 -38.192 3.786 1.00 0.00 H ATOM 1890 N ILE B 60 -17.401 -39.849 5.324 1.00 23.50 N ATOM 1891 CA ILE B 60 -16.036 -40.264 5.790 1.00 29.31 C ATOM 1892 C ILE B 60 -15.244 -39.065 6.348 1.00 29.57 C ATOM 1893 O ILE B 60 -14.619 -39.165 7.391 1.00 32.08 O ATOM 1894 CB ILE B 60 -15.198 -40.998 4.701 1.00 29.03 C ATOM 1895 CG1 ILE B 60 -15.761 -42.419 4.389 1.00 30.85 C ATOM 1896 CG2 ILE B 60 -13.711 -41.028 5.095 1.00 31.04 C ATOM 1897 CD1 ILE B 60 -15.340 -42.996 3.054 1.00 28.95 C ATOM 1898 HA ILE B 60 -16.212 -40.984 6.589 1.00 0.00 H ATOM 1899 HB ILE B 60 -15.281 -40.433 3.772 1.00 0.00 H ATOM 1900 HG12 ILE B 60 -15.422 -43.097 5.172 1.00 0.00 H ATOM 1901 HG13 ILE B 60 -16.849 -42.363 4.405 1.00 0.00 H ATOM 1902 HD11 ILE B 60 -15.682 -42.341 2.253 1.00 0.00 H ATOM 1903 HD12 ILE B 60 -14.253 -43.076 3.021 1.00 0.00 H ATOM 1904 HD13 ILE B 60 -15.782 -43.985 2.931 1.00 0.00 H ATOM 1905 HG21 ILE B 60 -13.343 -40.007 5.198 1.00 0.00 H ATOM 1906 HG22 ILE B 60 -13.598 -41.553 6.043 1.00 0.00 H ATOM 1907 HG23 ILE B 60 -13.142 -41.545 4.322 1.00 0.00 H ATOM 1908 H ILE B 60 -17.672 -39.978 4.328 1.00 0.00 H ATOM 1909 N MET B 61 -15.253 -37.923 5.648 1.00 32.58 N ATOM 1910 CA MET B 61 -14.476 -36.767 6.098 1.00 30.20 C ATOM 1911 C MET B 61 -14.910 -36.301 7.485 1.00 31.23 C ATOM 1912 O MET B 61 -14.079 -35.961 8.333 1.00 35.92 O ATOM 1913 CB MET B 61 -14.532 -35.587 5.096 1.00 28.00 C ATOM 1914 CG MET B 61 -14.127 -34.232 5.702 1.00 27.63 C ATOM 1915 SD MET B 61 -13.759 -32.929 4.495 1.00 34.32 S ATOM 1916 CE MET B 61 -15.429 -32.395 4.132 1.00 27.28 C ATOM 1917 HA MET B 61 -13.441 -37.104 6.153 1.00 0.00 H ATOM 1918 HB2 MET B 61 -13.858 -35.808 4.268 1.00 0.00 H ATOM 1919 HB3 MET B 61 -15.552 -35.504 4.721 1.00 0.00 H ATOM 1920 HG2 MET B 61 -13.238 -34.387 6.313 1.00 0.00 H ATOM 1921 HG3 MET B 61 -14.945 -33.886 6.334 1.00 0.00 H ATOM 1922 HE1 MET B 61 -15.998 -33.233 3.729 1.00 0.00 H ATOM 1923 HE2 MET B 61 -15.902 -32.039 5.047 1.00 0.00 H ATOM 1924 HE3 MET B 61 -15.400 -31.589 3.399 1.00 0.00 H ATOM 1925 H MET B 61 -15.817 -37.857 4.777 1.00 0.00 H ATOM 1926 N VAL B 62 -16.208 -36.314 7.726 1.00 30.22 N ATOM 1927 CA VAL B 62 -16.717 -35.563 8.835 1.00 29.29 C ATOM 1928 C VAL B 62 -16.721 -36.361 10.110 1.00 27.48 C ATOM 1929 O VAL B 62 -16.546 -35.796 11.214 1.00 26.23 O ATOM 1930 CB VAL B 62 -18.049 -34.936 8.477 1.00 31.79 C ATOM 1931 CG1 VAL B 62 -19.054 -35.051 9.612 1.00 32.96 C ATOM 1932 CG2 VAL B 62 -17.798 -33.511 8.050 1.00 27.86 C ATOM 1933 HA VAL B 62 -16.038 -34.737 9.045 1.00 0.00 H ATOM 1934 HB VAL B 62 -18.505 -35.476 7.647 1.00 0.00 H ATOM 1935 HG11 VAL B 62 -19.222 -36.103 9.841 1.00 0.00 H ATOM 1936 HG12 VAL B 62 -18.664 -34.544 10.494 1.00 0.00 H ATOM 1937 HG13 VAL B 62 -19.994 -34.588 9.311 1.00 0.00 H ATOM 1938 HG21 VAL B 62 -17.333 -32.964 8.870 1.00 0.00 H ATOM 1939 HG22 VAL B 62 -17.135 -33.504 7.185 1.00 0.00 H ATOM 1940 HG23 VAL B 62 -18.745 -33.040 7.787 1.00 0.00 H ATOM 1941 H VAL B 62 -16.852 -36.861 7.120 1.00 0.00 H ATOM 1942 N LYS B 63 -16.991 -37.646 9.906 1.00 24.80 N ATOM 1943 CA LYS B 63 -16.859 -38.750 10.836 1.00 24.96 C ATOM 1944 C LYS B 63 -15.416 -39.190 11.057 1.00 24.80 C ATOM 1945 O LYS B 63 -15.156 -39.977 11.959 1.00 24.64 O ATOM 1946 CB LYS B 63 -17.630 -39.944 10.301 1.00 23.72 C ATOM 1947 CG LYS B 63 -19.102 -39.667 10.032 1.00 22.24 C ATOM 1948 CD LYS B 63 -19.885 -39.614 11.312 1.00 20.55 C ATOM 1949 CE LYS B 63 -20.824 -40.841 11.400 1.00 19.61 C ATOM 1950 NZ LYS B 63 -20.073 -42.091 11.781 1.00 17.23 N ATOM 1951 HA LYS B 63 -17.250 -38.398 11.791 1.00 0.00 H ATOM 1952 HB2 LYS B 63 -17.165 -40.261 9.367 1.00 0.00 H ATOM 1953 HB3 LYS B 63 -17.562 -40.750 11.031 1.00 0.00 H ATOM 1954 HG2 LYS B 63 -19.196 -38.711 9.517 1.00 0.00 H ATOM 1955 HG3 LYS B 63 -19.504 -40.460 9.401 1.00 0.00 H ATOM 1956 HD2 LYS B 63 -19.198 -39.622 12.158 1.00 0.00 H ATOM 1957 HD3 LYS B 63 -20.479 -38.700 11.336 1.00 0.00 H ATOM 1958 HE2 LYS B 63 -21.297 -40.994 10.430 1.00 0.00 H ATOM 1959 HE3 LYS B 63 -21.591 -40.647 12.150 1.00 0.00 H ATOM 1960 HZ1 LYS B 63 -19.343 -42.287 11.066 1.00 0.00 H ATOM 1961 HZ2 LYS B 63 -19.624 -41.955 12.709 1.00 0.00 H ATOM 1962 HZ3 LYS B 63 -20.736 -42.891 11.830 1.00 0.00 H ATOM 1963 H LYS B 63 -17.342 -37.891 8.958 1.00 0.00 H ATOM 1964 N GLN B 64 -14.461 -38.694 10.271 1.00 25.08 N ATOM 1965 CA GLN B 64 -13.037 -39.032 10.525 1.00 27.38 C ATOM 1966 C GLN B 64 -12.838 -40.580 10.490 1.00 22.98 C ATOM 1967 O GLN B 64 -12.446 -41.251 11.460 1.00 18.73 O ATOM 1968 CB GLN B 64 -12.505 -38.350 11.816 1.00 26.81 C ATOM 1969 CG GLN B 64 -12.705 -36.831 11.854 1.00 30.83 C ATOM 1970 CD GLN B 64 -12.188 -36.110 13.106 1.00 30.37 C ATOM 1971 OE1 GLN B 64 -12.525 -36.437 14.275 1.00 29.93 O ATOM 1972 NE2 GLN B 64 -11.398 -35.084 12.864 1.00 29.85 N ATOM 1973 HA GLN B 64 -12.422 -38.623 9.723 1.00 0.00 H ATOM 1974 HB2 GLN B 64 -13.023 -38.785 12.671 1.00 0.00 H ATOM 1975 HB3 GLN B 64 -11.438 -38.556 11.897 1.00 0.00 H ATOM 1976 HG2 GLN B 64 -12.193 -36.406 10.990 1.00 0.00 H ATOM 1977 HG3 GLN B 64 -13.774 -36.634 11.774 1.00 0.00 H ATOM 1978 HE22 GLN B 64 -11.142 -34.845 11.885 1.00 0.00 H ATOM 1979 HE21 GLN B 64 -11.031 -34.513 13.652 1.00 0.00 H ATOM 1980 H GLN B 64 -14.713 -38.069 9.479 1.00 0.00 H ATOM 1981 N LEU B 65 -13.203 -41.154 9.360 1.00 22.93 N ATOM 1982 CA LEU B 65 -13.086 -42.572 9.218 1.00 24.85 C ATOM 1983 C LEU B 65 -11.683 -42.896 8.725 1.00 25.33 C ATOM 1984 O LEU B 65 -11.102 -43.854 9.138 1.00 21.51 O ATOM 1985 CB LEU B 65 -14.198 -43.204 8.363 1.00 29.50 C ATOM 1986 CG LEU B 65 -15.687 -43.005 8.773 1.00 29.13 C ATOM 1987 CD1 LEU B 65 -16.669 -43.598 7.762 1.00 27.02 C ATOM 1988 CD2 LEU B 65 -16.020 -43.526 10.180 1.00 25.75 C ATOM 1989 HA LEU B 65 -13.233 -43.033 10.195 1.00 0.00 H ATOM 1990 HB2 LEU B 65 -14.090 -42.803 7.355 1.00 0.00 H ATOM 1991 HB3 LEU B 65 -14.014 -44.278 8.347 1.00 0.00 H ATOM 1992 HG LEU B 65 -15.810 -41.922 8.784 1.00 0.00 H ATOM 1993 HD21 LEU B 65 -15.811 -44.595 10.229 1.00 0.00 H ATOM 1994 HD22 LEU B 65 -15.409 -43.001 10.914 1.00 0.00 H ATOM 1995 HD23 LEU B 65 -17.075 -43.351 10.391 1.00 0.00 H ATOM 1996 HD11 LEU B 65 -16.525 -43.119 6.793 1.00 0.00 H ATOM 1997 HD12 LEU B 65 -16.491 -44.669 7.669 1.00 0.00 H ATOM 1998 HD13 LEU B 65 -17.689 -43.427 8.105 1.00 0.00 H ATOM 1999 H LEU B 65 -13.574 -40.579 8.577 1.00 0.00 H ATOM 2000 N TYR B 66 -11.139 -42.083 7.842 1.00 30.79 N ATOM 2001 CA TYR B 66 -9.725 -42.147 7.547 1.00 26.94 C ATOM 2002 C TYR B 66 -8.857 -42.099 8.820 1.00 27.77 C ATOM 2003 O TYR B 66 -9.267 -41.523 9.842 1.00 26.35 O ATOM 2004 CB TYR B 66 -9.368 -41.006 6.587 1.00 27.10 C ATOM 2005 CG TYR B 66 -9.500 -39.635 7.197 1.00 24.63 C ATOM 2006 CD1 TYR B 66 -8.408 -39.004 7.769 1.00 23.42 C ATOM 2007 CD2 TYR B 66 -10.733 -38.981 7.220 1.00 25.92 C ATOM 2008 CE1 TYR B 66 -8.538 -37.744 8.356 1.00 23.12 C ATOM 2009 CE2 TYR B 66 -10.866 -37.727 7.800 1.00 26.29 C ATOM 2010 CZ TYR B 66 -9.776 -37.123 8.375 1.00 23.53 C ATOM 2011 OH TYR B 66 -9.925 -35.837 8.894 1.00 26.98 O ATOM 2012 HA TYR B 66 -9.512 -43.106 7.075 1.00 0.00 H ATOM 2013 HB3 TYR B 66 -10.030 -41.063 5.723 1.00 0.00 H ATOM 2014 HB2 TYR B 66 -8.336 -41.140 6.262 1.00 0.00 H ATOM 2015 HD2 TYR B 66 -11.604 -39.462 6.776 1.00 0.00 H ATOM 2016 HE2 TYR B 66 -11.833 -37.224 7.799 1.00 0.00 H ATOM 2017 HE1 TYR B 66 -7.671 -37.252 8.797 1.00 0.00 H ATOM 2018 HD1 TYR B 66 -7.436 -39.497 7.761 1.00 0.00 H ATOM 2019 HH TYR B 66 -9.062 -35.533 9.273 1.00 0.00 H ATOM 2020 H TYR B 66 -11.735 -41.386 7.351 1.00 0.00 H ATOM 2021 N ASP B 67 -7.694 -42.769 8.748 1.00 26.95 N ATOM 2022 CA ASP B 67 -6.679 -42.796 9.794 1.00 25.43 C ATOM 2023 C ASP B 67 -5.839 -41.560 9.541 1.00 25.81 C ATOM 2024 O ASP B 67 -5.317 -41.436 8.465 1.00 26.17 O ATOM 2025 CB ASP B 67 -5.778 -44.064 9.678 1.00 20.47 C ATOM 2026 CG ASP B 67 -4.641 -44.141 10.746 1.00 25.52 C ATOM 2027 OD1 ASP B 67 -3.985 -43.113 11.134 1.00 23.51 O ATOM 2028 OD2 ASP B 67 -4.332 -45.281 11.169 1.00 22.18 O ATOM 2029 HA ASP B 67 -7.130 -42.818 10.786 1.00 0.00 H ATOM 2030 HB2 ASP B 67 -6.411 -44.945 9.788 1.00 0.00 H ATOM 2031 HB3 ASP B 67 -5.319 -44.069 8.689 1.00 0.00 H ATOM 2032 H ASP B 67 -7.504 -43.309 7.880 1.00 0.00 H ATOM 2033 N GLN B 68 -5.725 -40.648 10.510 1.00 29.63 N ATOM 2034 CA GLN B 68 -4.831 -39.486 10.387 1.00 27.93 C ATOM 2035 C GLN B 68 -3.364 -39.700 9.911 1.00 29.33 C ATOM 2036 O GLN B 68 -2.786 -38.776 9.282 1.00 26.22 O ATOM 2037 CB GLN B 68 -4.774 -38.647 11.674 1.00 26.41 C ATOM 2038 CG GLN B 68 -6.041 -38.484 12.499 1.00 26.42 C ATOM 2039 CD GLN B 68 -7.071 -37.505 11.929 1.00 24.39 C ATOM 2040 OE1 GLN B 68 -6.776 -36.640 11.111 1.00 19.80 O ATOM 2041 NE2 GLN B 68 -8.317 -37.659 12.395 1.00 24.68 N ATOM 2042 HA GLN B 68 -5.329 -38.975 9.563 1.00 0.00 H ATOM 2043 HB2 GLN B 68 -4.026 -39.104 12.322 1.00 0.00 H ATOM 2044 HB3 GLN B 68 -4.445 -37.647 11.391 1.00 0.00 H ATOM 2045 HG2 GLN B 68 -6.516 -39.461 12.584 1.00 0.00 H ATOM 2046 HG3 GLN B 68 -5.755 -38.133 13.490 1.00 0.00 H ATOM 2047 HE22 GLN B 68 -8.524 -38.406 13.088 1.00 0.00 H ATOM 2048 HE21 GLN B 68 -9.077 -37.032 12.063 1.00 0.00 H ATOM 2049 H GLN B 68 -6.286 -40.763 11.378 1.00 0.00 H ATOM 2050 N GLN B 69 -2.748 -40.840 10.265 1.00 30.56 N ATOM 2051 CA GLN B 69 -1.411 -41.205 9.791 1.00 29.45 C ATOM 2052 C GLN B 69 -1.577 -41.824 8.434 1.00 32.34 C ATOM 2053 O GLN B 69 -0.842 -41.520 7.513 1.00 35.83 O ATOM 2054 CB GLN B 69 -0.705 -42.229 10.727 1.00 26.21 C ATOM 2055 CG GLN B 69 -0.009 -41.589 11.954 1.00 22.68 C ATOM 2056 CD GLN B 69 -0.393 -40.138 12.096 1.00 21.16 C ATOM 2057 OE1 GLN B 69 -1.275 -39.749 12.894 1.00 18.29 O ATOM 2058 NE2 GLN B 69 0.235 -39.319 11.283 1.00 24.13 N ATOM 2059 HA GLN B 69 -0.790 -40.310 9.768 1.00 0.00 H ATOM 2060 HB2 GLN B 69 -1.452 -42.936 11.087 1.00 0.00 H ATOM 2061 HB3 GLN B 69 0.047 -42.762 10.146 1.00 0.00 H ATOM 2062 HG2 GLN B 69 -0.307 -42.127 12.854 1.00 0.00 H ATOM 2063 HG3 GLN B 69 1.071 -41.662 11.830 1.00 0.00 H ATOM 2064 HE22 GLN B 69 0.962 -39.685 10.635 1.00 0.00 H ATOM 2065 HE21 GLN B 69 0.005 -38.305 11.287 1.00 0.00 H ATOM 2066 H GLN B 69 -3.243 -41.493 10.905 1.00 0.00 H ATOM 2067 N GLU B 70 -2.529 -42.733 8.332 1.00 32.27 N ATOM 2068 CA GLU B 70 -2.801 -43.314 7.040 1.00 32.28 C ATOM 2069 C GLU B 70 -4.056 -42.750 6.444 1.00 30.34 C ATOM 2070 O GLU B 70 -5.172 -43.179 6.721 1.00 29.58 O ATOM 2071 CB GLU B 70 -2.831 -44.806 7.090 1.00 30.68 C ATOM 2072 CG GLU B 70 -2.524 -45.383 5.730 1.00 26.78 C ATOM 2073 CD GLU B 70 -2.121 -46.834 5.853 1.00 28.59 C ATOM 2074 OE1 GLU B 70 -2.585 -47.491 6.790 1.00 26.07 O ATOM 2075 OE2 GLU B 70 -1.332 -47.328 5.035 1.00 33.21 O ATOM 2076 HA GLU B 70 -1.975 -43.042 6.383 1.00 0.00 H ATOM 2077 HB2 GLU B 70 -2.088 -45.157 7.806 1.00 0.00 H ATOM 2078 HB3 GLU B 70 -3.821 -45.135 7.405 1.00 0.00 H ATOM 2079 HG2 GLU B 70 -3.410 -45.308 5.099 1.00 0.00 H ATOM 2080 HG3 GLU B 70 -1.708 -44.820 5.277 1.00 0.00 H ATOM 2081 H GLU B 70 -3.073 -43.025 9.169 1.00 0.00 H ATOM 2082 N GLN B 71 -3.828 -41.767 5.601 1.00 32.99 N ATOM 2083 CA GLN B 71 -4.864 -40.871 5.155 1.00 29.86 C ATOM 2084 C GLN B 71 -5.621 -41.474 3.992 1.00 28.72 C ATOM 2085 O GLN B 71 -6.780 -41.181 3.778 1.00 21.21 O ATOM 2086 CB GLN B 71 -4.209 -39.531 4.829 1.00 30.37 C ATOM 2087 CG GLN B 71 -3.810 -38.758 6.103 1.00 29.52 C ATOM 2088 CD GLN B 71 -4.793 -37.647 6.427 1.00 28.45 C ATOM 2089 OE1 GLN B 71 -5.691 -37.385 5.632 1.00 29.48 O ATOM 2090 NE2 GLN B 71 -4.576 -36.942 7.522 1.00 22.72 N ATOM 2091 HA GLN B 71 -5.612 -40.706 5.931 1.00 0.00 H ATOM 2092 HB2 GLN B 71 -3.315 -39.712 4.232 1.00 0.00 H ATOM 2093 HB3 GLN B 71 -4.911 -38.926 4.255 1.00 0.00 H ATOM 2094 HG2 GLN B 71 -3.777 -39.454 6.941 1.00 0.00 H ATOM 2095 HG3 GLN B 71 -2.822 -38.322 5.955 1.00 0.00 H ATOM 2096 HE22 GLN B 71 -3.802 -37.205 8.165 1.00 0.00 H ATOM 2097 HE21 GLN B 71 -5.180 -36.124 7.742 1.00 0.00 H ATOM 2098 H GLN B 71 -2.861 -41.631 5.242 1.00 0.00 H ATOM 2099 N HIS B 72 -4.981 -42.354 3.235 1.00 28.86 N ATOM 2100 CA HIS B 72 -5.747 -43.045 2.171 1.00 27.68 C ATOM 2101 C HIS B 72 -6.505 -44.224 2.710 1.00 27.58 C ATOM 2102 O HIS B 72 -7.103 -45.006 1.910 1.00 33.47 O ATOM 2103 CB HIS B 72 -4.824 -43.459 1.039 1.00 26.20 C ATOM 2104 CG HIS B 72 -3.894 -44.570 1.406 1.00 27.37 C ATOM 2105 ND1 HIS B 72 -4.186 -45.886 1.152 1.00 30.58 N ATOM 2106 CD2 HIS B 72 -2.655 -44.548 2.031 1.00 29.17 C ATOM 2107 CE1 HIS B 72 -3.161 -46.648 1.599 1.00 34.85 C ATOM 2108 NE2 HIS B 72 -2.213 -45.820 2.106 1.00 34.32 N ATOM 2109 HA HIS B 72 -6.483 -42.343 1.778 1.00 0.00 H ATOM 2110 HB2 HIS B 72 -5.435 -43.784 0.196 1.00 0.00 H ATOM 2111 HB3 HIS B 72 -4.230 -42.594 0.744 1.00 0.00 H ATOM 2112 HD2 HIS B 72 -2.134 -43.663 2.395 1.00 0.00 H ATOM 2113 HE1 HIS B 72 -3.106 -47.736 1.559 1.00 0.00 H ATOM 2114 H HIS B 72 -3.971 -42.554 3.383 1.00 0.00 H ATOM 2115 N MET B 73 -6.468 -44.364 4.060 1.00 29.55 N ATOM 2116 CA MET B 73 -6.986 -45.537 4.841 1.00 23.41 C ATOM 2117 C MET B 73 -8.253 -45.332 5.707 1.00 22.74 C ATOM 2118 O MET B 73 -8.307 -44.550 6.686 1.00 20.58 O ATOM 2119 CB MET B 73 -5.893 -46.161 5.669 1.00 24.83 C ATOM 2120 CG MET B 73 -4.913 -47.002 4.833 1.00 23.94 C ATOM 2121 SD MET B 73 -5.574 -48.406 3.883 1.00 34.97 S ATOM 2122 CE MET B 73 -6.531 -49.202 5.170 1.00 29.76 C ATOM 2123 HA MET B 73 -7.324 -46.207 4.051 1.00 0.00 H ATOM 2124 HB2 MET B 73 -5.335 -45.366 6.164 1.00 0.00 H ATOM 2125 HB3 MET B 73 -6.350 -46.805 6.421 1.00 0.00 H ATOM 2126 HG2 MET B 73 -4.163 -47.399 5.517 1.00 0.00 H ATOM 2127 HG3 MET B 73 -4.434 -46.328 4.123 1.00 0.00 H ATOM 2128 HE1 MET B 73 -5.870 -49.486 5.989 1.00 0.00 H ATOM 2129 HE2 MET B 73 -7.290 -48.511 5.536 1.00 0.00 H ATOM 2130 HE3 MET B 73 -7.013 -50.092 4.765 1.00 0.00 H ATOM 2131 H MET B 73 -6.041 -43.587 4.603 1.00 0.00 H ATOM 2132 N VAL B 74 -9.291 -46.048 5.313 1.00 23.39 N ATOM 2133 CA VAL B 74 -10.611 -45.846 5.867 1.00 20.42 C ATOM 2134 C VAL B 74 -11.028 -46.887 6.910 1.00 23.02 C ATOM 2135 O VAL B 74 -11.484 -48.010 6.594 1.00 22.37 O ATOM 2136 CB VAL B 74 -11.624 -45.673 4.745 1.00 20.52 C ATOM 2137 CG1 VAL B 74 -13.017 -45.409 5.293 1.00 18.00 C ATOM 2138 CG2 VAL B 74 -11.190 -44.497 3.823 1.00 14.42 C ATOM 2139 HA VAL B 74 -10.578 -44.921 6.443 1.00 0.00 H ATOM 2140 HB VAL B 74 -11.656 -46.599 4.171 1.00 0.00 H ATOM 2141 HG11 VAL B 74 -13.327 -46.249 5.914 1.00 0.00 H ATOM 2142 HG12 VAL B 74 -13.004 -44.498 5.892 1.00 0.00 H ATOM 2143 HG13 VAL B 74 -13.715 -45.290 4.465 1.00 0.00 H ATOM 2144 HG21 VAL B 74 -11.137 -43.579 4.408 1.00 0.00 H ATOM 2145 HG22 VAL B 74 -10.211 -44.714 3.396 1.00 0.00 H ATOM 2146 HG23 VAL B 74 -11.919 -44.377 3.021 1.00 0.00 H ATOM 2147 H VAL B 74 -9.155 -46.777 4.584 1.00 0.00 H ATOM 2148 N TYR B 75 -10.910 -46.459 8.157 1.00 21.55 N ATOM 2149 CA TYR B 75 -11.169 -47.306 9.309 1.00 19.18 C ATOM 2150 C TYR B 75 -12.633 -47.216 9.736 1.00 19.37 C ATOM 2151 O TYR B 75 -13.010 -46.261 10.447 1.00 17.97 O ATOM 2152 CB TYR B 75 -10.124 -46.963 10.388 1.00 20.57 C ATOM 2153 CG TYR B 75 -8.776 -47.412 9.917 1.00 20.79 C ATOM 2154 CD1 TYR B 75 -7.761 -46.512 9.595 1.00 20.76 C ATOM 2155 CD2 TYR B 75 -8.573 -48.777 9.607 1.00 25.47 C ATOM 2156 CE1 TYR B 75 -6.551 -46.965 9.074 1.00 20.43 C ATOM 2157 CE2 TYR B 75 -7.392 -49.225 9.055 1.00 26.29 C ATOM 2158 CZ TYR B 75 -6.378 -48.328 8.810 1.00 26.28 C ATOM 2159 OH TYR B 75 -5.211 -48.819 8.273 1.00 30.48 O ATOM 2160 HA TYR B 75 -11.044 -48.364 9.080 1.00 0.00 H ATOM 2161 HB3 TYR B 75 -10.376 -47.474 11.317 1.00 0.00 H ATOM 2162 HB2 TYR B 75 -10.113 -45.886 10.558 1.00 0.00 H ATOM 2163 HD2 TYR B 75 -9.370 -49.492 9.810 1.00 0.00 H ATOM 2164 HE2 TYR B 75 -7.263 -50.280 8.815 1.00 0.00 H ATOM 2165 HE1 TYR B 75 -5.743 -46.261 8.873 1.00 0.00 H ATOM 2166 HD1 TYR B 75 -7.916 -45.445 9.752 1.00 0.00 H ATOM 2167 HH TYR B 75 -4.569 -48.076 8.147 1.00 0.00 H ATOM 2168 H TYR B 75 -10.619 -45.474 8.319 1.00 0.00 H ATOM 2169 N CYS B 76 -13.452 -48.184 9.278 1.00 17.44 N ATOM 2170 CA CYS B 76 -14.948 -48.142 9.343 1.00 19.11 C ATOM 2171 C CYS B 76 -15.780 -49.252 10.050 1.00 20.56 C ATOM 2172 O CYS B 76 -17.038 -49.203 10.094 1.00 16.93 O ATOM 2173 CB CYS B 76 -15.490 -47.962 7.923 1.00 18.76 C ATOM 2174 SG CYS B 76 -14.744 -48.883 6.576 1.00 26.25 S ATOM 2175 HA CYS B 76 -15.095 -47.311 10.033 1.00 0.00 H ATOM 2176 HB2 CYS B 76 -15.394 -46.904 7.677 1.00 0.00 H ATOM 2177 HB3 CYS B 76 -16.545 -48.233 7.948 1.00 0.00 H ATOM 2178 HG CYS B 76 -13.408 -48.551 6.478 1.00 0.00 H ATOM 2179 H CYS B 76 -13.012 -49.022 8.847 1.00 0.00 H ATOM 2180 N GLY B 77 -15.124 -50.298 10.570 1.00 24.88 N ATOM 2181 CA GLY B 77 -15.829 -51.362 11.338 1.00 26.96 C ATOM 2182 C GLY B 77 -16.761 -50.758 12.359 1.00 28.45 C ATOM 2183 O GLY B 77 -16.466 -49.687 12.890 1.00 28.90 O ATOM 2184 HA3 GLY B 77 -15.092 -51.982 11.849 1.00 0.00 H ATOM 2185 HA2 GLY B 77 -16.405 -51.979 10.648 1.00 0.00 H ATOM 2186 H GLY B 77 -14.095 -50.369 10.434 1.00 0.00 H ATOM 2187 N GLY B 78 -17.894 -51.403 12.625 1.00 27.46 N ATOM 2188 CA GLY B 78 -18.929 -50.877 13.539 1.00 31.11 C ATOM 2189 C GLY B 78 -19.807 -49.803 12.919 1.00 32.63 C ATOM 2190 O GLY B 78 -21.001 -49.650 13.236 1.00 35.19 O ATOM 2191 HA3 GLY B 78 -18.433 -50.454 14.413 1.00 0.00 H ATOM 2192 HA2 GLY B 78 -19.566 -51.705 13.850 1.00 0.00 H ATOM 2193 H GLY B 78 -18.059 -52.322 12.167 1.00 0.00 H ATOM 2194 N ASP B 79 -19.212 -49.052 12.014 1.00 31.87 N ATOM 2195 CA ASP B 79 -19.966 -48.109 11.224 1.00 33.04 C ATOM 2196 C ASP B 79 -20.841 -48.832 10.205 1.00 33.41 C ATOM 2197 O ASP B 79 -20.436 -49.829 9.581 1.00 36.25 O ATOM 2198 CB ASP B 79 -19.055 -47.090 10.501 1.00 31.59 C ATOM 2199 CG ASP B 79 -19.851 -45.920 9.950 1.00 32.71 C ATOM 2200 OD1 ASP B 79 -19.712 -44.788 10.435 1.00 29.13 O ATOM 2201 OD2 ASP B 79 -20.692 -46.154 9.055 1.00 37.89 O ATOM 2202 HA ASP B 79 -20.600 -47.557 11.917 1.00 0.00 H ATOM 2203 HB2 ASP B 79 -18.315 -46.713 11.207 1.00 0.00 H ATOM 2204 HB3 ASP B 79 -18.547 -47.592 9.677 1.00 0.00 H ATOM 2205 H ASP B 79 -18.186 -49.140 11.867 1.00 0.00 H ATOM 2206 N LEU B 80 -22.055 -48.326 10.059 1.00 30.75 N ATOM 2207 CA LEU B 80 -22.918 -48.596 8.917 1.00 31.05 C ATOM 2208 C LEU B 80 -22.114 -48.871 7.644 1.00 28.78 C ATOM 2209 O LEU B 80 -22.382 -49.871 6.967 1.00 24.96 O ATOM 2210 CB LEU B 80 -23.822 -47.378 8.657 1.00 27.89 C ATOM 2211 CG LEU B 80 -24.610 -46.702 9.785 1.00 24.87 C ATOM 2212 CD1 LEU B 80 -25.889 -46.189 9.138 1.00 21.88 C ATOM 2213 CD2 LEU B 80 -24.905 -47.640 10.971 1.00 22.25 C ATOM 2214 HA LEU B 80 -23.507 -49.481 9.158 1.00 0.00 H ATOM 2215 HB2 LEU B 80 -23.182 -46.608 8.226 1.00 0.00 H ATOM 2216 HB3 LEU B 80 -24.557 -47.694 7.917 1.00 0.00 H ATOM 2217 HG LEU B 80 -24.025 -45.896 10.227 1.00 0.00 H ATOM 2218 HD21 LEU B 80 -25.493 -48.490 10.623 1.00 0.00 H ATOM 2219 HD22 LEU B 80 -23.965 -47.995 11.394 1.00 0.00 H ATOM 2220 HD23 LEU B 80 -25.465 -47.096 11.732 1.00 0.00 H ATOM 2221 HD11 LEU B 80 -25.637 -45.481 8.349 1.00 0.00 H ATOM 2222 HD12 LEU B 80 -26.441 -47.027 8.713 1.00 0.00 H ATOM 2223 HD13 LEU B 80 -26.502 -45.693 9.891 1.00 0.00 H ATOM 2224 H LEU B 80 -22.415 -47.697 10.805 1.00 0.00 H ATOM 2225 N LEU B 81 -21.164 -47.985 7.327 1.00 28.91 N ATOM 2226 CA LEU B 81 -20.303 -48.153 6.146 1.00 30.23 C ATOM 2227 C LEU B 81 -19.565 -49.494 6.162 1.00 31.61 C ATOM 2228 O LEU B 81 -19.411 -50.131 5.116 1.00 30.08 O ATOM 2229 CB LEU B 81 -19.321 -46.999 6.022 1.00 30.27 C ATOM 2230 CG LEU B 81 -19.011 -46.321 4.673 1.00 27.33 C ATOM 2231 CD1 LEU B 81 -17.557 -45.914 4.641 1.00 27.95 C ATOM 2232 CD2 LEU B 81 -19.354 -47.149 3.442 1.00 28.98 C ATOM 2233 HA LEU B 81 -20.952 -48.150 5.271 1.00 0.00 H ATOM 2234 HB2 LEU B 81 -19.692 -46.212 6.679 1.00 0.00 H ATOM 2235 HB3 LEU B 81 -18.369 -47.369 6.402 1.00 0.00 H ATOM 2236 HG LEU B 81 -19.665 -45.451 4.617 1.00 0.00 H ATOM 2237 HD21 LEU B 81 -18.787 -48.079 3.462 1.00 0.00 H ATOM 2238 HD22 LEU B 81 -20.421 -47.372 3.442 1.00 0.00 H ATOM 2239 HD23 LEU B 81 -19.099 -46.586 2.544 1.00 0.00 H ATOM 2240 HD11 LEU B 81 -17.358 -45.217 5.455 1.00 0.00 H ATOM 2241 HD12 LEU B 81 -16.931 -46.798 4.758 1.00 0.00 H ATOM 2242 HD13 LEU B 81 -17.336 -45.434 3.687 1.00 0.00 H ATOM 2243 H LEU B 81 -21.030 -47.151 7.934 1.00 0.00 H ATOM 2244 N GLY B 82 -19.116 -49.895 7.352 1.00 31.57 N ATOM 2245 CA GLY B 82 -18.343 -51.104 7.547 1.00 29.76 C ATOM 2246 C GLY B 82 -19.002 -52.292 6.847 1.00 30.73 C ATOM 2247 O GLY B 82 -18.550 -52.724 5.786 1.00 33.49 O ATOM 2248 HA3 GLY B 82 -18.271 -51.313 8.614 1.00 0.00 H ATOM 2249 HA2 GLY B 82 -17.343 -50.958 7.138 1.00 0.00 H ATOM 2250 H GLY B 82 -19.332 -49.309 8.183 1.00 0.00 H ATOM 2251 N GLU B 83 -20.089 -52.788 7.420 1.00 32.04 N ATOM 2252 CA GLU B 83 -20.750 -53.995 6.972 1.00 28.27 C ATOM 2253 C GLU B 83 -21.343 -53.912 5.557 1.00 32.62 C ATOM 2254 O GLU B 83 -21.457 -54.928 4.874 1.00 31.28 O ATOM 2255 CB GLU B 83 -21.818 -54.408 7.979 1.00 30.07 C ATOM 2256 CG GLU B 83 -23.014 -53.476 7.994 1.00 32.22 C ATOM 2257 CD GLU B 83 -24.319 -54.216 7.954 1.00 32.22 C ATOM 2258 OE1 GLU B 83 -24.724 -54.693 9.014 1.00 40.18 O ATOM 2259 OE2 GLU B 83 -24.953 -54.307 6.864 1.00 29.58 O ATOM 2260 HA GLU B 83 -19.973 -54.757 6.912 1.00 0.00 H ATOM 2261 HB2 GLU B 83 -22.163 -55.411 7.728 1.00 0.00 H ATOM 2262 HB3 GLU B 83 -21.372 -54.417 8.974 1.00 0.00 H ATOM 2263 HG2 GLU B 83 -22.979 -52.877 8.904 1.00 0.00 H ATOM 2264 HG3 GLU B 83 -22.957 -52.820 7.126 1.00 0.00 H ATOM 2265 H GLU B 83 -20.489 -52.282 8.236 1.00 0.00 H ATOM 2266 N LEU B 84 -21.748 -52.704 5.166 1.00 34.16 N ATOM 2267 CA LEU B 84 -22.281 -52.412 3.870 1.00 38.28 C ATOM 2268 C LEU B 84 -21.132 -52.557 2.856 1.00 40.21 C ATOM 2269 O LEU B 84 -21.360 -52.841 1.676 1.00 45.07 O ATOM 2270 CB LEU B 84 -22.820 -50.989 3.854 1.00 34.47 C ATOM 2271 CG LEU B 84 -24.197 -50.823 3.236 1.00 36.47 C ATOM 2272 CD1 LEU B 84 -24.201 -49.604 2.316 1.00 37.74 C ATOM 2273 CD2 LEU B 84 -24.662 -52.061 2.474 1.00 33.77 C ATOM 2274 HA LEU B 84 -23.096 -53.091 3.618 1.00 0.00 H ATOM 2275 HB2 LEU B 84 -22.868 -50.635 4.884 1.00 0.00 H ATOM 2276 HB3 LEU B 84 -22.121 -50.370 3.291 1.00 0.00 H ATOM 2277 HG LEU B 84 -24.903 -50.679 4.054 1.00 0.00 H ATOM 2278 HD21 LEU B 84 -23.960 -52.275 1.668 1.00 0.00 H ATOM 2279 HD22 LEU B 84 -24.704 -52.911 3.155 1.00 0.00 H ATOM 2280 HD23 LEU B 84 -25.652 -51.879 2.057 1.00 0.00 H ATOM 2281 HD11 LEU B 84 -23.952 -48.714 2.894 1.00 0.00 H ATOM 2282 HD12 LEU B 84 -23.463 -49.744 1.526 1.00 0.00 H ATOM 2283 HD13 LEU B 84 -25.190 -49.487 1.874 1.00 0.00 H ATOM 2284 H LEU B 84 -21.672 -51.922 5.847 1.00 0.00 H ATOM 2285 N LEU B 85 -19.906 -52.381 3.352 1.00 41.57 N ATOM 2286 CA LEU B 85 -18.689 -52.735 2.633 1.00 36.03 C ATOM 2287 C LEU B 85 -18.338 -54.187 2.930 1.00 37.98 C ATOM 2288 O LEU B 85 -17.638 -54.822 2.147 1.00 35.64 O ATOM 2289 CB LEU B 85 -17.527 -51.830 3.039 1.00 31.84 C ATOM 2290 CG LEU B 85 -17.758 -50.323 2.962 1.00 31.79 C ATOM 2291 CD1 LEU B 85 -16.476 -49.528 2.819 1.00 28.54 C ATOM 2292 CD2 LEU B 85 -18.790 -49.884 1.909 1.00 32.34 C ATOM 2293 HA LEU B 85 -18.863 -52.603 1.565 1.00 0.00 H ATOM 2294 HB2 LEU B 85 -17.268 -52.070 4.070 1.00 0.00 H ATOM 2295 HB3 LEU B 85 -16.684 -52.067 2.390 1.00 0.00 H ATOM 2296 HG LEU B 85 -18.193 -50.087 3.933 1.00 0.00 H ATOM 2297 HD21 LEU B 85 -18.458 -50.203 0.921 1.00 0.00 H ATOM 2298 HD22 LEU B 85 -19.754 -50.340 2.135 1.00 0.00 H ATOM 2299 HD23 LEU B 85 -18.887 -48.798 1.928 1.00 0.00 H ATOM 2300 HD11 LEU B 85 -15.834 -49.719 3.679 1.00 0.00 H ATOM 2301 HD12 LEU B 85 -15.963 -49.830 1.906 1.00 0.00 H ATOM 2302 HD13 LEU B 85 -16.713 -48.465 2.770 1.00 0.00 H ATOM 2303 H LEU B 85 -19.814 -51.969 4.303 1.00 0.00 H ATOM 2304 N GLY B 86 -18.832 -54.681 4.071 1.00 36.06 N ATOM 2305 CA GLY B 86 -18.593 -56.022 4.590 1.00 34.78 C ATOM 2306 C GLY B 86 -17.394 -56.037 5.522 1.00 36.67 C ATOM 2307 O GLY B 86 -17.040 -57.090 6.039 1.00 40.20 O ATOM 2308 HA3 GLY B 86 -18.406 -56.699 3.757 1.00 0.00 H ATOM 2309 HA2 GLY B 86 -19.475 -56.356 5.137 1.00 0.00 H ATOM 2310 H GLY B 86 -19.439 -54.054 4.637 1.00 0.00 H ATOM 2311 N ARG B 87 -16.798 -54.850 5.751 1.00 42.80 N ATOM 2312 CA ARG B 87 -15.398 -54.702 6.201 1.00 42.95 C ATOM 2313 C ARG B 87 -15.166 -53.676 7.314 1.00 42.61 C ATOM 2314 O ARG B 87 -16.095 -52.968 7.722 1.00 38.76 O ATOM 2315 CB ARG B 87 -14.504 -54.292 5.008 1.00 42.17 C ATOM 2316 CG ARG B 87 -14.659 -55.111 3.734 1.00 43.73 C ATOM 2317 CD ARG B 87 -14.093 -54.346 2.552 1.00 38.28 C ATOM 2318 NE ARG B 87 -12.750 -53.829 2.828 1.00 43.70 N ATOM 2319 CZ ARG B 87 -11.626 -54.303 2.291 1.00 44.64 C ATOM 2320 NH1 ARG B 87 -11.661 -55.323 1.436 1.00 45.88 N ATOM 2321 NH2 ARG B 87 -10.459 -53.754 2.608 1.00 47.12 N ATOM 2322 HA ARG B 87 -15.143 -55.680 6.610 1.00 0.00 H ATOM 2323 HB2 ARG B 87 -14.730 -53.254 4.765 1.00 0.00 H ATOM 2324 HB3 ARG B 87 -13.465 -54.371 5.329 1.00 0.00 H ATOM 2325 HG2 ARG B 87 -14.124 -56.054 3.844 1.00 0.00 H ATOM 2326 HG3 ARG B 87 -15.716 -55.313 3.561 1.00 0.00 H ATOM 2327 HD2 ARG B 87 -14.753 -53.509 2.325 1.00 0.00 H ATOM 2328 HD3 ARG B 87 -14.044 -55.013 1.691 1.00 0.00 H ATOM 2329 HE ARG B 87 -12.668 -53.033 3.492 1.00 0.00 H ATOM 2330 HH12 ARG B 87 -10.778 -55.685 1.023 1.00 0.00 H ATOM 2331 HH11 ARG B 87 -12.571 -55.757 1.182 1.00 0.00 H ATOM 2332 HH22 ARG B 87 -9.581 -54.122 2.190 1.00 0.00 H ATOM 2333 HH21 ARG B 87 -10.424 -52.956 3.274 1.00 0.00 H ATOM 2334 H ARG B 87 -17.357 -53.986 5.602 1.00 0.00 H ATOM 2335 N GLN B 88 -13.894 -53.584 7.744 1.00 42.02 N ATOM 2336 CA GLN B 88 -13.416 -52.711 8.848 1.00 43.65 C ATOM 2337 C GLN B 88 -12.509 -51.566 8.356 1.00 46.66 C ATOM 2338 O GLN B 88 -12.247 -50.600 9.107 1.00 49.46 O ATOM 2339 CB GLN B 88 -12.677 -53.536 9.914 1.00 43.60 C ATOM 2340 CG GLN B 88 -13.169 -54.970 10.044 1.00 38.79 C ATOM 2341 CD GLN B 88 -13.879 -55.272 11.342 1.00 39.17 C ATOM 2342 OE1 GLN B 88 -14.851 -54.595 11.728 1.00 39.41 O ATOM 2343 NE2 GLN B 88 -13.398 -56.305 12.032 1.00 35.38 N ATOM 2344 HA GLN B 88 -14.305 -52.258 9.286 1.00 0.00 H ATOM 2345 HB2 GLN B 88 -11.618 -53.560 9.655 1.00 0.00 H ATOM 2346 HB3 GLN B 88 -12.803 -53.042 10.877 1.00 0.00 H ATOM 2347 HG2 GLN B 88 -13.859 -55.170 9.224 1.00 0.00 H ATOM 2348 HG3 GLN B 88 -12.309 -55.634 9.963 1.00 0.00 H ATOM 2349 HE22 GLN B 88 -12.584 -56.840 11.668 1.00 0.00 H ATOM 2350 HE21 GLN B 88 -13.837 -56.577 12.935 1.00 0.00 H ATOM 2351 H GLN B 88 -13.185 -54.174 7.263 1.00 0.00 H ATOM 2352 N SER B 89 -12.022 -51.711 7.112 1.00 48.28 N ATOM 2353 CA SER B 89 -11.346 -50.663 6.328 1.00 44.22 C ATOM 2354 C SER B 89 -11.360 -50.936 4.804 1.00 46.57 C ATOM 2355 O SER B 89 -11.789 -52.023 4.374 1.00 46.27 O ATOM 2356 CB SER B 89 -9.908 -50.383 6.857 1.00 40.17 C ATOM 2357 OG SER B 89 -9.150 -51.552 7.176 1.00 43.67 O ATOM 2358 HA SER B 89 -11.930 -49.754 6.472 1.00 0.00 H ATOM 2359 HB2 SER B 89 -9.990 -49.775 7.758 1.00 0.00 H ATOM 2360 HB3 SER B 89 -9.367 -49.826 6.092 1.00 0.00 H ATOM 2361 HG SER B 89 -8.255 -51.284 7.503 1.00 0.00 H ATOM 2362 H SER B 89 -12.132 -52.643 6.664 1.00 0.00 H ATOM 2363 N PHE B 90 -10.942 -49.939 4.001 1.00 47.45 N ATOM 2364 CA PHE B 90 -10.477 -50.155 2.599 1.00 50.45 C ATOM 2365 C PHE B 90 -9.373 -49.164 2.193 1.00 51.17 C ATOM 2366 O PHE B 90 -9.109 -48.179 2.903 1.00 51.14 O ATOM 2367 CB PHE B 90 -11.626 -50.121 1.573 1.00 47.34 C ATOM 2368 CG PHE B 90 -12.320 -48.791 1.480 1.00 48.37 C ATOM 2369 CD1 PHE B 90 -11.748 -47.728 0.787 1.00 47.41 C ATOM 2370 CD2 PHE B 90 -13.544 -48.602 2.094 1.00 48.99 C ATOM 2371 CE1 PHE B 90 -12.380 -46.501 0.705 1.00 48.44 C ATOM 2372 CE2 PHE B 90 -14.192 -47.378 2.017 1.00 51.51 C ATOM 2373 CZ PHE B 90 -13.612 -46.324 1.313 1.00 52.88 C ATOM 2374 HA PHE B 90 -10.056 -51.160 2.587 1.00 0.00 H ATOM 2375 HB2 PHE B 90 -11.218 -50.365 0.592 1.00 0.00 H ATOM 2376 HB3 PHE B 90 -12.362 -50.873 1.856 1.00 0.00 H ATOM 2377 HD2 PHE B 90 -14.004 -49.423 2.644 1.00 0.00 H ATOM 2378 HE2 PHE B 90 -15.156 -47.240 2.507 1.00 0.00 H ATOM 2379 HZ PHE B 90 -14.125 -45.365 1.241 1.00 0.00 H ATOM 2380 HE1 PHE B 90 -11.912 -45.678 0.165 1.00 0.00 H ATOM 2381 HD1 PHE B 90 -10.783 -47.866 0.299 1.00 0.00 H ATOM 2382 H PHE B 90 -10.943 -48.969 4.377 1.00 0.00 H ATOM 2383 N SER B 91 -8.703 -49.407 1.068 1.00 47.94 N ATOM 2384 CA SER B 91 -7.705 -48.427 0.630 1.00 44.53 C ATOM 2385 C SER B 91 -8.353 -47.517 -0.366 1.00 38.70 C ATOM 2386 O SER B 91 -8.782 -47.972 -1.401 1.00 34.63 O ATOM 2387 CB SER B 91 -6.473 -49.085 -0.004 1.00 48.77 C ATOM 2388 OG SER B 91 -5.741 -48.127 -0.774 1.00 46.63 O ATOM 2389 HA SER B 91 -7.357 -47.878 1.505 1.00 0.00 H ATOM 2390 HB2 SER B 91 -6.794 -49.900 -0.653 1.00 0.00 H ATOM 2391 HB3 SER B 91 -5.831 -49.481 0.783 1.00 0.00 H ATOM 2392 HG SER B 91 -4.950 -48.565 -1.177 1.00 0.00 H ATOM 2393 H SER B 91 -8.883 -50.269 0.515 1.00 0.00 H ATOM 2394 N VAL B 92 -8.426 -46.229 -0.056 1.00 40.97 N ATOM 2395 CA VAL B 92 -9.123 -45.314 -0.938 1.00 41.17 C ATOM 2396 C VAL B 92 -8.369 -45.273 -2.278 1.00 40.88 C ATOM 2397 O VAL B 92 -8.806 -44.654 -3.253 1.00 42.64 O ATOM 2398 CB VAL B 92 -9.413 -43.972 -0.225 1.00 36.80 C ATOM 2399 CG1 VAL B 92 -8.283 -42.963 -0.349 1.00 35.66 C ATOM 2400 CG2 VAL B 92 -10.703 -43.386 -0.713 1.00 34.85 C ATOM 2401 HA VAL B 92 -10.128 -45.651 -1.192 1.00 0.00 H ATOM 2402 HB VAL B 92 -9.499 -44.201 0.837 1.00 0.00 H ATOM 2403 HG11 VAL B 92 -7.377 -43.378 0.092 1.00 0.00 H ATOM 2404 HG12 VAL B 92 -8.108 -42.743 -1.402 1.00 0.00 H ATOM 2405 HG13 VAL B 92 -8.556 -42.047 0.175 1.00 0.00 H ATOM 2406 HG21 VAL B 92 -10.638 -43.210 -1.787 1.00 0.00 H ATOM 2407 HG22 VAL B 92 -11.517 -44.081 -0.506 1.00 0.00 H ATOM 2408 HG23 VAL B 92 -10.889 -42.443 -0.200 1.00 0.00 H ATOM 2409 H VAL B 92 -7.984 -45.877 0.817 1.00 0.00 H ATOM 2410 N LYS B 93 -7.235 -45.974 -2.307 1.00 42.03 N ATOM 2411 CA LYS B 93 -6.449 -46.174 -3.533 1.00 39.08 C ATOM 2412 C LYS B 93 -7.002 -47.372 -4.281 1.00 41.88 C ATOM 2413 O LYS B 93 -6.918 -47.456 -5.514 1.00 41.82 O ATOM 2414 CB LYS B 93 -4.980 -46.411 -3.200 1.00 42.08 C ATOM 2415 CG LYS B 93 -4.169 -45.123 -3.045 1.00 39.91 C ATOM 2416 CD LYS B 93 -2.834 -45.387 -2.355 1.00 37.77 C ATOM 2417 CE LYS B 93 -2.284 -44.130 -1.705 1.00 35.42 C ATOM 2418 NZ LYS B 93 -1.789 -44.413 -0.326 1.00 27.64 N ATOM 2419 HA LYS B 93 -6.520 -45.279 -4.151 1.00 0.00 H ATOM 2420 HB2 LYS B 93 -4.924 -46.968 -2.265 1.00 0.00 H ATOM 2421 HB3 LYS B 93 -4.537 -47.003 -4.001 1.00 0.00 H ATOM 2422 HG2 LYS B 93 -3.981 -44.701 -4.032 1.00 0.00 H ATOM 2423 HG3 LYS B 93 -4.742 -44.412 -2.450 1.00 0.00 H ATOM 2424 HD2 LYS B 93 -2.976 -46.149 -1.589 1.00 0.00 H ATOM 2425 HD3 LYS B 93 -2.118 -45.746 -3.094 1.00 0.00 H ATOM 2426 HE2 LYS B 93 -3.074 -43.380 -1.654 1.00 0.00 H ATOM 2427 HE3 LYS B 93 -1.460 -43.748 -2.308 1.00 0.00 H ATOM 2428 HZ1 LYS B 93 -2.572 -44.774 0.255 1.00 0.00 H ATOM 2429 HZ2 LYS B 93 -1.032 -45.125 -0.370 1.00 0.00 H ATOM 2430 HZ3 LYS B 93 -1.419 -43.537 0.095 1.00 0.00 H ATOM 2431 H LYS B 93 -6.891 -46.398 -1.422 1.00 0.00 H ATOM 2432 N ASP B 94 -7.561 -48.312 -3.526 1.00 38.19 N ATOM 2433 CA ASP B 94 -8.199 -49.460 -4.139 1.00 35.80 C ATOM 2434 C ASP B 94 -9.588 -49.624 -3.593 1.00 38.57 C ATOM 2435 O ASP B 94 -9.786 -50.291 -2.582 1.00 38.59 O ATOM 2436 CB ASP B 94 -7.383 -50.705 -3.924 1.00 31.05 C ATOM 2437 CG ASP B 94 -7.399 -51.605 -5.125 1.00 31.48 C ATOM 2438 OD1 ASP B 94 -8.013 -51.228 -6.165 1.00 30.53 O ATOM 2439 OD2 ASP B 94 -6.784 -52.683 -5.031 1.00 26.69 O ATOM 2440 HA ASP B 94 -8.266 -49.292 -5.214 1.00 0.00 H ATOM 2441 HB2 ASP B 94 -6.353 -50.418 -3.713 1.00 0.00 H ATOM 2442 HB3 ASP B 94 -7.789 -51.249 -3.071 1.00 0.00 H ATOM 2443 H ASP B 94 -7.541 -48.223 -2.490 1.00 0.00 H ATOM 2444 N PRO B 95 -10.562 -49.029 -4.294 1.00 43.01 N ATOM 2445 CA PRO B 95 -11.903 -48.750 -3.827 1.00 39.31 C ATOM 2446 C PRO B 95 -12.909 -49.884 -4.098 1.00 41.96 C ATOM 2447 O PRO B 95 -14.057 -49.812 -3.651 1.00 41.02 O ATOM 2448 CB PRO B 95 -12.262 -47.510 -4.623 1.00 42.42 C ATOM 2449 CG PRO B 95 -11.501 -47.646 -5.910 1.00 41.49 C ATOM 2450 CD PRO B 95 -10.391 -48.637 -5.702 1.00 41.25 C ATOM 2451 HA PRO B 95 -11.942 -48.632 -2.744 1.00 0.00 H ATOM 2452 HD3 PRO B 95 -10.501 -49.495 -6.365 1.00 0.00 H ATOM 2453 HD2 PRO B 95 -9.417 -48.176 -5.866 1.00 0.00 H ATOM 2454 HG3 PRO B 95 -11.084 -46.680 -6.195 1.00 0.00 H ATOM 2455 HG2 PRO B 95 -12.168 -47.999 -6.697 1.00 0.00 H ATOM 2456 HB2 PRO B 95 -13.335 -47.473 -4.813 1.00 0.00 H ATOM 2457 HB3 PRO B 95 -11.957 -46.610 -4.090 1.00 0.00 H ATOM 2458 N SER B 96 -12.442 -50.935 -4.781 1.00 42.26 N ATOM 2459 CA SER B 96 -13.274 -52.030 -5.279 1.00 36.73 C ATOM 2460 C SER B 96 -14.357 -52.614 -4.352 1.00 36.34 C ATOM 2461 O SER B 96 -15.390 -52.962 -4.854 1.00 32.21 O ATOM 2462 CB SER B 96 -12.428 -53.130 -5.927 1.00 38.48 C ATOM 2463 OG SER B 96 -11.653 -53.822 -4.969 1.00 41.94 O ATOM 2464 HA SER B 96 -13.880 -51.525 -6.031 1.00 0.00 H ATOM 2465 HB2 SER B 96 -11.762 -52.678 -6.662 1.00 0.00 H ATOM 2466 HB3 SER B 96 -13.090 -53.838 -6.426 1.00 0.00 H ATOM 2467 HG SER B 96 -11.121 -54.523 -5.421 1.00 0.00 H ATOM 2468 H SER B 96 -11.420 -50.976 -4.970 1.00 0.00 H ATOM 2469 N PRO B 97 -14.130 -52.712 -3.013 1.00 35.42 N ATOM 2470 CA PRO B 97 -15.207 -53.045 -2.028 1.00 35.90 C ATOM 2471 C PRO B 97 -16.549 -52.252 -2.114 1.00 38.08 C ATOM 2472 O PRO B 97 -17.629 -52.865 -2.045 1.00 39.60 O ATOM 2473 CB PRO B 97 -14.543 -52.773 -0.654 1.00 31.04 C ATOM 2474 CG PRO B 97 -13.211 -52.196 -0.957 1.00 27.71 C ATOM 2475 CD PRO B 97 -12.825 -52.643 -2.339 1.00 32.62 C ATOM 2476 HA PRO B 97 -15.532 -54.067 -2.224 1.00 0.00 H ATOM 2477 HD3 PRO B 97 -12.168 -51.919 -2.821 1.00 0.00 H ATOM 2478 HD2 PRO B 97 -12.337 -53.618 -2.319 1.00 0.00 H ATOM 2479 HG3 PRO B 97 -12.478 -52.552 -0.233 1.00 0.00 H ATOM 2480 HG2 PRO B 97 -13.260 -51.108 -0.918 1.00 0.00 H ATOM 2481 HB2 PRO B 97 -15.140 -52.068 -0.076 1.00 0.00 H ATOM 2482 HB3 PRO B 97 -14.436 -53.701 -0.093 1.00 0.00 H ATOM 2483 N LEU B 98 -16.484 -50.921 -2.188 1.00 40.53 N ATOM 2484 CA LEU B 98 -17.707 -50.107 -2.321 1.00 33.55 C ATOM 2485 C LEU B 98 -17.914 -49.466 -3.693 1.00 35.46 C ATOM 2486 O LEU B 98 -18.988 -48.925 -3.958 1.00 36.79 O ATOM 2487 CB LEU B 98 -17.850 -49.045 -1.227 1.00 34.52 C ATOM 2488 CG LEU B 98 -17.057 -47.755 -1.275 1.00 31.18 C ATOM 2489 CD1 LEU B 98 -17.562 -46.863 -2.385 1.00 28.13 C ATOM 2490 CD2 LEU B 98 -17.220 -47.085 0.078 1.00 20.47 C ATOM 2491 HA LEU B 98 -18.498 -50.847 -2.198 1.00 0.00 H ATOM 2492 HB2 LEU B 98 -18.902 -48.760 -1.208 1.00 0.00 H ATOM 2493 HB3 LEU B 98 -17.590 -49.533 -0.287 1.00 0.00 H ATOM 2494 HG LEU B 98 -16.005 -47.951 -1.480 1.00 0.00 H ATOM 2495 HD21 LEU B 98 -18.276 -46.883 0.257 1.00 0.00 H ATOM 2496 HD22 LEU B 98 -16.838 -47.745 0.857 1.00 0.00 H ATOM 2497 HD23 LEU B 98 -16.663 -46.148 0.088 1.00 0.00 H ATOM 2498 HD11 LEU B 98 -17.458 -47.379 -3.340 1.00 0.00 H ATOM 2499 HD12 LEU B 98 -18.612 -46.627 -2.211 1.00 0.00 H ATOM 2500 HD13 LEU B 98 -16.979 -45.942 -2.403 1.00 0.00 H ATOM 2501 H LEU B 98 -15.557 -50.451 -2.151 1.00 0.00 H ATOM 2502 N TYR B 99 -16.884 -49.470 -4.541 1.00 34.93 N ATOM 2503 CA TYR B 99 -17.179 -49.496 -5.952 1.00 29.92 C ATOM 2504 C TYR B 99 -18.066 -50.758 -6.102 1.00 27.69 C ATOM 2505 O TYR B 99 -19.025 -50.764 -6.853 1.00 23.23 O ATOM 2506 CB TYR B 99 -15.922 -49.653 -6.789 1.00 29.22 C ATOM 2507 CG TYR B 99 -15.197 -48.396 -7.300 1.00 27.12 C ATOM 2508 CD1 TYR B 99 -15.717 -47.127 -7.154 1.00 30.84 C ATOM 2509 CD2 TYR B 99 -13.984 -48.511 -7.984 1.00 26.20 C ATOM 2510 CE1 TYR B 99 -15.066 -46.021 -7.641 1.00 23.38 C ATOM 2511 CE2 TYR B 99 -13.318 -47.396 -8.460 1.00 25.35 C ATOM 2512 CZ TYR B 99 -13.875 -46.138 -8.291 1.00 27.31 C ATOM 2513 OH TYR B 99 -13.212 -44.984 -8.770 1.00 23.76 O ATOM 2514 HA TYR B 99 -17.651 -48.574 -6.291 1.00 0.00 H ATOM 2515 HB3 TYR B 99 -16.194 -50.242 -7.665 1.00 0.00 H ATOM 2516 HB2 TYR B 99 -15.206 -50.211 -6.186 1.00 0.00 H ATOM 2517 HD2 TYR B 99 -13.554 -49.499 -8.146 1.00 0.00 H ATOM 2518 HE2 TYR B 99 -12.359 -47.506 -8.966 1.00 0.00 H ATOM 2519 HE1 TYR B 99 -15.509 -45.034 -7.505 1.00 0.00 H ATOM 2520 HD1 TYR B 99 -16.669 -46.999 -6.639 1.00 0.00 H ATOM 2521 HH TYR B 99 -13.754 -44.183 -8.561 1.00 0.00 H ATOM 2522 H TYR B 99 -15.903 -49.455 -4.196 1.00 0.00 H ATOM 2523 N ASP B 100 -17.735 -51.825 -5.364 1.00 28.40 N ATOM 2524 CA ASP B 100 -18.533 -53.053 -5.366 1.00 33.43 C ATOM 2525 C ASP B 100 -19.859 -52.889 -4.595 1.00 33.52 C ATOM 2526 O ASP B 100 -20.864 -53.563 -4.869 1.00 26.72 O ATOM 2527 CB ASP B 100 -17.704 -54.209 -4.772 1.00 31.53 C ATOM 2528 CG ASP B 100 -16.975 -55.031 -5.807 1.00 34.57 C ATOM 2529 OD1 ASP B 100 -17.336 -55.005 -7.008 1.00 38.94 O ATOM 2530 OD2 ASP B 100 -16.027 -55.738 -5.408 1.00 35.16 O ATOM 2531 HA ASP B 100 -18.793 -53.280 -6.400 1.00 0.00 H ATOM 2532 HB2 ASP B 100 -16.968 -53.788 -4.087 1.00 0.00 H ATOM 2533 HB3 ASP B 100 -18.376 -54.867 -4.222 1.00 0.00 H ATOM 2534 H ASP B 100 -16.883 -51.780 -4.770 1.00 0.00 H ATOM 2535 N MET B 101 -19.859 -51.975 -3.620 1.00 38.06 N ATOM 2536 CA MET B 101 -20.992 -51.814 -2.692 1.00 37.97 C ATOM 2537 C MET B 101 -21.990 -50.805 -3.260 1.00 41.98 C ATOM 2538 O MET B 101 -23.174 -50.821 -2.919 1.00 45.87 O ATOM 2539 CB MET B 101 -20.471 -51.488 -1.272 1.00 36.02 C ATOM 2540 CG MET B 101 -21.390 -50.741 -0.305 1.00 36.60 C ATOM 2541 SD MET B 101 -21.810 -49.129 -0.943 1.00 34.83 S ATOM 2542 CE MET B 101 -21.538 -48.080 0.515 1.00 29.42 C ATOM 2543 HA MET B 101 -21.547 -52.747 -2.589 1.00 0.00 H ATOM 2544 HB2 MET B 101 -20.211 -52.436 -0.800 1.00 0.00 H ATOM 2545 HB3 MET B 101 -19.572 -50.884 -1.391 1.00 0.00 H ATOM 2546 HG2 MET B 101 -20.882 -50.625 0.653 1.00 0.00 H ATOM 2547 HG3 MET B 101 -22.304 -51.318 -0.163 1.00 0.00 H ATOM 2548 HE1 MET B 101 -22.191 -48.408 1.324 1.00 0.00 H ATOM 2549 HE2 MET B 101 -20.498 -48.162 0.831 1.00 0.00 H ATOM 2550 HE3 MET B 101 -21.762 -47.044 0.262 1.00 0.00 H ATOM 2551 H MET B 101 -19.030 -51.356 -3.513 1.00 0.00 H ATOM 2552 N LEU B 102 -21.536 -49.966 -4.179 1.00 40.30 N ATOM 2553 CA LEU B 102 -22.495 -49.238 -4.979 1.00 37.57 C ATOM 2554 C LEU B 102 -23.095 -50.233 -5.929 1.00 41.61 C ATOM 2555 O LEU B 102 -24.306 -50.447 -5.964 1.00 32.07 O ATOM 2556 CB LEU B 102 -21.853 -48.092 -5.739 1.00 30.46 C ATOM 2557 CG LEU B 102 -21.281 -47.046 -4.785 1.00 29.74 C ATOM 2558 CD1 LEU B 102 -20.958 -45.717 -5.423 1.00 26.44 C ATOM 2559 CD2 LEU B 102 -22.255 -46.852 -3.623 1.00 23.89 C ATOM 2560 HA LEU B 102 -23.252 -48.784 -4.339 1.00 0.00 H ATOM 2561 HB2 LEU B 102 -21.048 -48.484 -6.360 1.00 0.00 H ATOM 2562 HB3 LEU B 102 -22.604 -47.621 -6.374 1.00 0.00 H ATOM 2563 HG LEU B 102 -20.322 -47.433 -4.440 1.00 0.00 H ATOM 2564 HD21 LEU B 102 -23.216 -46.513 -4.009 1.00 0.00 H ATOM 2565 HD22 LEU B 102 -22.386 -47.798 -3.098 1.00 0.00 H ATOM 2566 HD23 LEU B 102 -21.855 -46.106 -2.936 1.00 0.00 H ATOM 2567 HD11 LEU B 102 -20.218 -45.863 -6.210 1.00 0.00 H ATOM 2568 HD12 LEU B 102 -21.865 -45.291 -5.850 1.00 0.00 H ATOM 2569 HD13 LEU B 102 -20.558 -45.041 -4.668 1.00 0.00 H ATOM 2570 H LEU B 102 -20.514 -49.834 -4.322 1.00 0.00 H ATOM 2571 N ARG B 103 -22.230 -50.870 -6.701 1.00 40.80 N ATOM 2572 CA ARG B 103 -22.732 -51.677 -7.771 1.00 40.94 C ATOM 2573 C ARG B 103 -23.864 -52.623 -7.328 1.00 36.05 C ATOM 2574 O ARG B 103 -24.674 -52.998 -8.133 1.00 38.72 O ATOM 2575 CB ARG B 103 -21.585 -52.403 -8.433 1.00 38.09 C ATOM 2576 CG ARG B 103 -20.850 -51.526 -9.424 1.00 40.51 C ATOM 2577 CD ARG B 103 -20.448 -52.392 -10.595 1.00 46.86 C ATOM 2578 NE ARG B 103 -21.528 -53.349 -10.933 1.00 48.60 N ATOM 2579 CZ ARG B 103 -21.354 -54.513 -11.569 1.00 52.39 C ATOM 2580 NH1 ARG B 103 -20.140 -54.888 -11.971 1.00 50.76 N ATOM 2581 NH2 ARG B 103 -22.401 -55.303 -11.823 1.00 54.16 N ATOM 2582 HA ARG B 103 -23.195 -51.021 -8.508 1.00 0.00 H ATOM 2583 HB2 ARG B 103 -20.884 -52.728 -7.664 1.00 0.00 H ATOM 2584 HB3 ARG B 103 -21.977 -53.274 -8.958 1.00 0.00 H ATOM 2585 HG2 ARG B 103 -21.503 -50.722 -9.764 1.00 0.00 H ATOM 2586 HG3 ARG B 103 -19.963 -51.099 -8.956 1.00 0.00 H ATOM 2587 HD2 ARG B 103 -19.546 -52.947 -10.337 1.00 0.00 H ATOM 2588 HD3 ARG B 103 -20.249 -51.757 -11.458 1.00 0.00 H ATOM 2589 HE ARG B 103 -22.497 -53.096 -10.654 1.00 0.00 H ATOM 2590 HH12 ARG B 103 -20.013 -55.794 -12.465 1.00 0.00 H ATOM 2591 HH11 ARG B 103 -19.320 -54.274 -11.791 1.00 0.00 H ATOM 2592 HH22 ARG B 103 -22.262 -56.207 -12.318 1.00 0.00 H ATOM 2593 HH21 ARG B 103 -23.355 -55.014 -11.526 1.00 0.00 H ATOM 2594 H ARG B 103 -21.207 -50.786 -6.534 1.00 0.00 H ATOM 2595 N LYS B 104 -23.928 -52.976 -6.046 1.00 39.67 N ATOM 2596 CA LYS B 104 -24.996 -53.845 -5.537 1.00 34.86 C ATOM 2597 C LYS B 104 -26.021 -53.068 -4.721 1.00 39.43 C ATOM 2598 O LYS B 104 -27.114 -53.577 -4.453 1.00 40.84 O ATOM 2599 CB LYS B 104 -24.411 -55.002 -4.733 1.00 35.24 C ATOM 2600 CG LYS B 104 -25.362 -55.628 -3.714 1.00 30.28 C ATOM 2601 CD LYS B 104 -24.581 -56.047 -2.471 1.00 25.86 C ATOM 2602 CE LYS B 104 -25.370 -57.081 -1.683 1.00 27.56 C ATOM 2603 NZ LYS B 104 -24.441 -58.040 -1.025 1.00 27.16 N ATOM 2604 HA LYS B 104 -25.522 -54.258 -6.397 1.00 0.00 H ATOM 2605 HB2 LYS B 104 -24.106 -55.780 -5.433 1.00 0.00 H ATOM 2606 HB3 LYS B 104 -23.536 -54.633 -4.197 1.00 0.00 H ATOM 2607 HG2 LYS B 104 -26.125 -54.901 -3.435 1.00 0.00 H ATOM 2608 HG3 LYS B 104 -25.840 -56.503 -4.154 1.00 0.00 H ATOM 2609 HD2 LYS B 104 -23.625 -56.475 -2.773 1.00 0.00 H ATOM 2610 HD3 LYS B 104 -24.404 -55.173 -1.844 1.00 0.00 H ATOM 2611 HE2 LYS B 104 -26.030 -57.624 -2.360 1.00 0.00 H ATOM 2612 HE3 LYS B 104 -25.967 -56.577 -0.923 1.00 0.00 H ATOM 2613 HZ1 LYS B 104 -23.873 -58.523 -1.750 1.00 0.00 H ATOM 2614 HZ2 LYS B 104 -23.812 -57.523 -0.377 1.00 0.00 H ATOM 2615 HZ3 LYS B 104 -24.991 -58.742 -0.490 1.00 0.00 H ATOM 2616 H LYS B 104 -23.202 -52.627 -5.388 1.00 0.00 H ATOM 2617 N ASN B 105 -25.665 -51.831 -4.380 1.00 39.97 N ATOM 2618 CA ASN B 105 -26.556 -50.916 -3.670 1.00 40.93 C ATOM 2619 C ASN B 105 -26.961 -49.651 -4.487 1.00 38.53 C ATOM 2620 O ASN B 105 -27.586 -48.715 -3.970 1.00 41.20 O ATOM 2621 CB ASN B 105 -26.021 -50.632 -2.246 1.00 41.53 C ATOM 2622 CG ASN B 105 -26.566 -51.620 -1.189 1.00 40.88 C ATOM 2623 OD1 ASN B 105 -27.765 -51.618 -0.883 1.00 46.15 O ATOM 2624 ND2 ASN B 105 -25.682 -52.431 -0.595 1.00 36.41 N ATOM 2625 HA ASN B 105 -27.513 -51.423 -3.547 1.00 0.00 H ATOM 2626 HB2 ASN B 105 -24.934 -50.705 -2.262 1.00 0.00 H ATOM 2627 HB3 ASN B 105 -26.312 -49.621 -1.960 1.00 0.00 H ATOM 2628 HD22 ASN B 105 -24.681 -52.406 -0.878 1.00 0.00 H ATOM 2629 HD21 ASN B 105 -25.996 -53.086 0.149 1.00 0.00 H ATOM 2630 H ASN B 105 -24.711 -51.502 -4.630 1.00 0.00 H ATOM 2631 N LEU B 106 -26.651 -49.658 -5.781 1.00 33.58 N ATOM 2632 CA LEU B 106 -27.306 -48.773 -6.763 1.00 35.02 C ATOM 2633 C LEU B 106 -27.889 -49.608 -7.865 1.00 31.45 C ATOM 2634 O LEU B 106 -27.185 -49.891 -8.806 1.00 35.50 O ATOM 2635 CB LEU B 106 -26.332 -47.805 -7.404 1.00 33.33 C ATOM 2636 CG LEU B 106 -25.514 -46.923 -6.470 1.00 32.45 C ATOM 2637 CD1 LEU B 106 -24.566 -46.116 -7.324 1.00 26.00 C ATOM 2638 CD2 LEU B 106 -26.468 -46.054 -5.673 1.00 29.58 C ATOM 2639 HA LEU B 106 -28.068 -48.208 -6.226 1.00 0.00 H ATOM 2640 HB2 LEU B 106 -25.632 -48.390 -8.000 1.00 0.00 H ATOM 2641 HB3 LEU B 106 -26.905 -47.148 -8.059 1.00 0.00 H ATOM 2642 HG LEU B 106 -24.926 -47.500 -5.756 1.00 0.00 H ATOM 2643 HD21 LEU B 106 -27.050 -45.435 -6.356 1.00 0.00 H ATOM 2644 HD22 LEU B 106 -27.139 -46.689 -5.094 1.00 0.00 H ATOM 2645 HD23 LEU B 106 -25.898 -45.415 -4.998 1.00 0.00 H ATOM 2646 HD11 LEU B 106 -23.915 -46.791 -7.879 1.00 0.00 H ATOM 2647 HD12 LEU B 106 -25.138 -45.505 -8.022 1.00 0.00 H ATOM 2648 HD13 LEU B 106 -23.963 -45.471 -6.685 1.00 0.00 H ATOM 2649 H LEU B 106 -25.916 -50.315 -6.114 1.00 0.00 H ATOM 2650 N VAL B 107 -29.201 -49.847 -7.879 1.00 33.58 N ATOM 2651 CA VAL B 107 -30.198 -48.882 -7.441 1.00 28.87 C ATOM 2652 C VAL B 107 -31.254 -49.566 -6.606 1.00 27.42 C ATOM 2653 O VAL B 107 -32.207 -48.870 -6.220 1.00 26.30 O ATOM 2654 CB VAL B 107 -30.938 -48.187 -8.636 1.00 26.45 C ATOM 2655 CG1 VAL B 107 -29.993 -47.745 -9.761 1.00 24.62 C ATOM 2656 CG2 VAL B 107 -32.067 -49.066 -9.144 1.00 23.30 C ATOM 2657 HA VAL B 107 -29.654 -48.129 -6.870 1.00 0.00 H ATOM 2658 HB VAL B 107 -31.371 -47.264 -8.251 1.00 0.00 H ATOM 2659 HG11 VAL B 107 -29.267 -47.034 -9.366 1.00 0.00 H ATOM 2660 HG12 VAL B 107 -29.472 -48.616 -10.159 1.00 0.00 H ATOM 2661 HG13 VAL B 107 -30.571 -47.272 -10.555 1.00 0.00 H ATOM 2662 HG21 VAL B 107 -31.660 -50.018 -9.484 1.00 0.00 H ATOM 2663 HG22 VAL B 107 -32.780 -49.241 -8.338 1.00 0.00 H ATOM 2664 HG23 VAL B 107 -32.569 -48.567 -9.973 1.00 0.00 H ATOM 2665 H VAL B 107 -29.529 -50.773 -8.221 1.00 0.00 H TER 2666 VAL B 107 HETATM 2667 O HOH 1 -22.218 -14.534 2.922 1.00 18.41 O HETATM 2668 O HOH 2 -20.486 -12.690 3.240 1.00 29.47 O HETATM 2669 O HOH 3 -18.343 -10.866 3.744 1.00 29.16 O HETATM 2670 O HOH 4 3.118 -28.868 5.021 1.00 16.27 O HETATM 2671 O HOH 5 0.228 -22.934 14.749 1.00 14.17 O HETATM 2672 O HOH 6 -15.001 -17.658 -3.412 1.00 22.69 O HETATM 2673 O HOH 7 -20.301 -26.620 6.202 1.00 24.50 O HETATM 2674 O HOH 8 4.888 -21.872 7.759 1.00 30.92 O HETATM 2675 O HOH 9 -8.033 -15.520 -1.710 1.00 19.48 O HETATM 2676 O HOH 10 -5.252 -16.493 16.561 1.00 26.77 O HETATM 2677 O HOH 11 -14.973 -37.120 -3.405 1.00 11.52 O HETATM 2678 O HOH 12 0.179 -12.003 -1.170 1.00 21.45 O HETATM 2679 O HOH 13 -4.770 -12.829 13.502 1.00 21.67 O HETATM 2680 O HOH 14 -9.315 -40.224 -5.190 1.00 14.05 O HETATM 2681 O HOH 15 -4.571 -43.919 -11.100 1.00 21.98 O HETATM 2682 O HOH 16 -11.572 -30.408 9.688 1.00 12.50 O HETATM 2683 O HOH 17 -14.481 -31.497 8.768 1.00 33.09 O HETATM 2684 O HOH 18 -6.223 -30.875 10.666 1.00 23.91 O HETATM 2685 O HOH 19 -21.809 -13.904 9.275 1.00 23.23 O HETATM 2686 O HOH 20 6.295 -39.458 7.501 1.00 24.45 O HETATM 2687 O HOH 21 -22.104 -19.180 9.880 1.00 23.54 O HETATM 2688 O HOH 22 -8.595 -7.366 9.642 1.00 24.00 O HETATM 2689 O HOH 23 -7.263 -25.990 -8.539 1.00 26.08 O HETATM 2690 O HOH 24 -27.092 -18.821 0.988 1.00 18.33 O HETATM 2691 O HOH 25 -18.361 -6.057 6.751 1.00 14.28 O HETATM 2692 O HOH 26 6.175 -37.295 4.186 1.00 23.35 O HETATM 2693 O HOH 27 -7.946 -21.261 -7.437 1.00 20.47 O HETATM 2694 O HOH 28 6.583 -37.007 9.650 1.00 16.23 O HETATM 2695 O HOH 29 -0.091 -33.375 -9.056 1.00 29.57 O HETATM 2696 O HOH 30 6.191 -25.157 -1.291 1.00 24.86 O HETATM 2697 O HOH 31 2.086 -16.957 -2.477 1.00 25.65 O HETATM 2698 O HOH 32 0.143 -15.496 4.153 1.00 18.04 O HETATM 2699 O HOH 33 4.678 -35.164 6.337 1.00 15.23 O HETATM 2700 O HOH 34 4.195 -37.630 10.098 1.00 27.56 O HETATM 2701 O HOH 35 -2.202 -12.399 15.360 1.00 19.61 O HETATM 2702 O HOH 36 -1.996 -13.718 19.126 1.00 31.25 O HETATM 2703 O HOH 37 -2.065 -40.093 -9.832 1.00 18.89 O HETATM 2704 O HOH 38 -25.803 -15.725 6.889 1.00 22.90 O HETATM 2705 O HOH 39 -21.194 -20.329 14.304 1.00 27.67 O HETATM 2706 O HOH 40 -20.537 -21.619 9.667 1.00 18.49 O HETATM 2707 O HOH 41 -15.699 -38.668 -5.466 1.00 18.09 O HETATM 2708 O HOH 42 -2.615 -30.498 15.224 1.00 27.75 O HETATM 2709 O HOH 43 3.857 -38.750 5.149 1.00 22.51 O HETATM 2710 O HOH 44 -16.947 -35.409 -3.804 1.00 19.83 O HETATM 2711 O HOH 45 -26.445 -56.258 -9.224 1.00 30.29 O HETATM 2712 O HOH 46 -18.116 -36.734 -6.242 1.00 24.00 O HETATM 2713 O HOH 47 -36.612 -41.074 1.189 1.00 21.45 O HETATM 2714 O HOH 48 -34.897 -37.084 2.486 1.00 16.97 O HETATM 2715 O HOH 49 -13.547 -44.039 -5.423 1.00 26.53 O HETATM 2716 O HOH 50 -8.166 -32.292 13.196 1.00 27.24 O HETATM 2717 O HOH 51 -40.763 -43.525 -2.022 1.00 33.62 O HETATM 2718 O HOH 52 -28.802 -53.368 -8.141 1.00 21.04 O HETATM 2719 O HOH 53 -24.947 -54.189 -11.382 1.00 29.00 O HETATM 2720 O HOH 54 -20.634 -57.308 7.760 1.00 29.62 O HETATM 2721 O HOH 55 -11.279 -58.091 7.641 1.00 29.03 O HETATM 2722 O HOH 56 -11.047 -55.265 7.286 1.00 25.84 O HETATM 2723 O HOH 57 -6.834 -52.390 4.377 1.00 41.56 O HETATM 2724 O HOH 58 -31.083 -39.082 -16.753 1.00 25.60 O HETATM 2725 O HOH 59 -4.994 -49.788 -2.836 1.00 33.09 O HETATM 2726 O HOH 60 -18.927 -31.323 0.319 1.00 14.57 O HETATM 2727 O HOH 61 -18.972 -32.192 -5.388 1.00 16.38 O HETATM 2728 O HOH 62 -13.054 -41.497 -7.493 1.00 20.05 O HETATM 2729 O HOH 63 -25.994 -39.389 -14.582 1.00 35.18 O HETATM 2730 O HOH 64 -29.741 -34.361 -5.974 1.00 23.88 O HETATM 2731 O HOH 65 -8.686 -40.258 12.672 1.00 23.57 O HETATM 2732 O HOH 66 -18.225 -56.184 9.461 1.00 28.50 O HETATM 2733 O HOH 67 -2.993 -50.264 2.756 1.00 19.60 O HETATM 2734 O HOH 68 -29.236 -40.979 8.226 1.00 20.72 O HETATM 2735 O HOH 69 -34.505 -35.821 -4.380 1.00 19.00 O HETATM 2736 O HOH 70 -35.611 -37.804 -5.917 1.00 22.12 O HETATM 2737 O HOH 71 -22.858 -45.323 12.643 1.00 15.07 O HETATM 2738 O HOH 72 -11.909 -49.569 12.808 1.00 27.75 O HETATM 2739 O HOH 73 -20.954 -53.820 11.224 1.00 27.04 O HETATM 2740 O HOH 74 -11.361 -50.342 -8.162 1.00 20.50 O HETATM 2741 O HOH 75 -15.600 -57.275 -2.567 1.00 17.47 O HETATM 2742 O HOH 76 -34.380 -51.309 -3.435 1.00 22.67 O HETATM 2743 O HOH 77 -28.289 -39.705 -15.945 1.00 21.59 O HETATM 2744 C4 UNN A 78 -10.183 -34.351 1.674 1.00 -0.08 C HETATM 2745 C8 UNN A 78 -9.228 -35.314 1.356 1.00 -0.03 C HETATM 2746 C7 UNN A 78 -9.264 -36.501 0.675 1.00 -0.04 C HETATM 2747 C6 UNN A 78 -8.053 -37.122 0.589 1.00 0.02 C HETATM 2748 N5 UNN A 78 -7.253 -36.288 1.288 1.00 -0.28 N HETATM 2749 C9 UNN A 78 -7.905 -35.208 1.754 1.00 0.07 C HETATM 2750 C3 UNN A 78 -7.497 -34.113 2.468 1.00 -0.01 C HETATM 2751 C2 UNN A 78 -8.436 -33.182 2.807 1.00 0.03 C HETATM 2752 C1 UNN A 78 -9.766 -33.281 2.422 1.00 -0.07 C HETATM 2753 H8 UNN A 78 -10.474 -32.513 2.713 1.00 0.05 H HETATM 2754 CL UNN A 78 -8.020 -31.777 3.779 1.00 -0.09 CL HETATM 2755 C27 UNN A 78 -6.064 -33.989 2.915 1.00 -0.03 C HETATM 2756 H12 UNN A 78 -5.933 -33.048 3.470 1.00 0.04 H HETATM 2757 H13 UNN A 78 -5.404 -33.990 2.035 1.00 0.04 H HETATM 2758 H14 UNN A 78 -5.808 -34.838 3.566 1.00 0.04 H HETATM 2759 H9 UNN A 78 -6.250 -36.461 1.447 1.00 0.23 H HETATM 2760 H2 UNN A 78 -7.796 -38.053 0.085 1.00 0.09 H HETATM 2761 C10 UNN A 78 -10.463 -36.984 0.016 1.00 -0.05 C HETATM 2762 C11 UNN A 78 -10.675 -38.146 -0.829 1.00 0.13 C HETATM 2763 N12 UNN A 78 -9.771 -39.081 -1.273 1.00 -0.21 N HETATM 2764 C13 UNN A 78 -10.563 -39.870 -2.039 1.00 0.32 C HETATM 2765 N14 UNN A 78 -11.899 -39.509 -2.216 1.00 -0.15 N HETATM 2766 C15 UNN A 78 -11.975 -38.419 -1.444 1.00 0.25 C HETATM 2767 O17 UNN A 78 -13.006 -37.676 -1.176 1.00 -0.38 O HETATM 2768 C18 UNN A 78 -12.970 -40.181 -3.004 1.00 0.09 C HETATM 2769 C19 UNN A 78 -13.820 -41.218 -2.269 1.00 -0.02 C HETATM 2770 C20 UNN A 78 -15.041 -40.886 -1.633 1.00 -0.06 C HETATM 2771 C21 UNN A 78 -15.781 -41.866 -0.954 1.00 -0.04 C HETATM 2772 C22 UNN A 78 -15.355 -43.206 -0.966 1.00 0.16 C HETATM 2773 C23 UNN A 78 -14.161 -43.522 -1.612 1.00 0.16 C HETATM 2774 C24 UNN A 78 -13.417 -42.554 -2.272 1.00 -0.03 C HETATM 2775 H7 UNN A 78 -12.512 -42.839 -2.796 1.00 0.05 H HETATM 2776 F25 UNN A 78 -13.723 -44.790 -1.624 1.00 -0.19 F HETATM 2777 F26 UNN A 78 -16.048 -44.198 -0.316 1.00 -0.19 F HETATM 2778 H6 UNN A 78 -16.683 -41.590 -0.419 1.00 0.06 H HETATM 2779 H5 UNN A 78 -15.407 -39.866 -1.671 1.00 0.05 H HETATM 2780 H10 UNN A 78 -12.490 -40.687 -3.854 1.00 0.07 H HETATM 2781 H11 UNN A 78 -13.648 -39.400 -3.378 1.00 0.07 H HETATM 2782 O16 UNN A 78 -10.020 -40.877 -2.650 1.00 -0.38 O HETATM 2783 H4 UNN A 78 -8.792 -39.158 -1.082 1.00 0.23 H HETATM 2784 H3 UNN A 78 -11.350 -36.375 0.182 1.00 0.04 H HETATM 2785 H1 UNN A 78 -11.211 -34.444 1.344 1.00 0.05 H CONECT 1 2 17 18 19 CONECT 17 1 CONECT 18 1 CONECT 19 1 CONECT 1334 1335 1350 1351 1352 CONECT 1350 1334 CONECT 1351 1334 CONECT 1352 1334 CONECT 2744 2745 2752 2785 CONECT 2745 2744 2746 2749 CONECT 2746 2745 2747 2761 CONECT 2747 2746 2748 2760 CONECT 2748 2747 2749 2759 CONECT 2749 2745 2748 2750 CONECT 2750 2749 2751 2755 CONECT 2751 2750 2752 2754 CONECT 2752 2744 2751 2753 CONECT 2753 2752 CONECT 2754 2751 CONECT 2755 2750 2756 2757 2758 CONECT 2756 2755 CONECT 2757 2755 CONECT 2758 2755 CONECT 2759 2748 CONECT 2760 2747 CONECT 2761 2746 2762 2784 CONECT 2762 2761 2763 2766 CONECT 2763 2762 2764 2783 CONECT 2764 2763 2765 2782 CONECT 2765 2764 2766 2768 CONECT 2766 2762 2765 2767 CONECT 2767 2766 CONECT 2768 2765 2769 2780 2781 CONECT 2769 2768 2770 2774 CONECT 2770 2769 2771 2779 CONECT 2771 2770 2772 2778 CONECT 2772 2771 2773 2777 CONECT 2773 2772 2774 2776 CONECT 2774 2769 2773 2775 CONECT 2775 2774 CONECT 2776 2773 CONECT 2777 2772 CONECT 2778 2771 CONECT 2779 2770 CONECT 2780 2768 CONECT 2781 2768 CONECT 2782 2764 CONECT 2783 2763 CONECT 2784 2761 CONECT 2785 2744 MASTER 0 0 0 0 0 0 0 0 2783 2 50 14 END
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Related entries of code: 3u15
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RCSB PDB
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
3vbg
RCSB PDB
PDBbind
03M
Entry Information
PDB ID
3u15
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
human MDMX
Ligand Name
03M
EC.Number
E.C.-.-.-.-
Resolution
1.8(Å)
Affinity (Kd/Ki/IC50)
Kd=0.078uM
Release Year
2012
Protein/NA Sequence
Check fasta file
Primary Reference
(2012) Proc.Natl.Acad.Sci.USA Vol. 109: pp. 11788-11793
Ligand Properties
Formula
C
2
0
H
1
4
ClF
2
N
3
O
2
Molecular Weight
401.794
Exact Mass
401.074
No. of atoms
42
No. of bonds
45
Polar Surface Area
65.2
LOGP Value
4.08 (
Computed with XLOGP3
)
4.77 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 3
No. of Nitrogen and Oxygen Atoms: 5
No. of Rings: 4
Canonical SMILES
O=C1N/C(=C\c2c[nH]c3c2ccc(c3C)Cl)/C(=O)N1Cc1ccc(c(c1)F)F
InChI String
InChI=1S/C20H14ClF2N3O2/c1-10-14(21)4-3-13-12(8-24-18(10)13)7-17-19(27)26(20(28)25-17)9-11-2-5-15(22)16(23)6-11/h2-8,24H,9H2,1H3,(H,25,28)/b17-7-
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):
O15151
Entrez Gene ID
NCBI Entrez Gene ID:
4194
ASD
Information of known allosteric effects of PDB entries
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