Browse entries in the PDBbind-CN Database
HEADER 2Z5T_COMPLEX COMPND 2Z5T_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 M 89 PRO GLY GLU GLY THR GLN VAL HIS PRO ARG ALA PRO LEU SEQRES 2 M 89 LEU GLN ILE LEU LYS VAL ALA GLY ALA GLN GLU GLU VAL SEQRES 3 M 89 PHE THR VAL LYS GLU VAL MET HIS TYR LEU GLY GLN TYR SEQRES 4 M 89 ILE MET MET LYS GLN LEU TYR ASP LYS GLN ARG GLN HIS SEQRES 5 M 89 ILE VAL HIS CYS HIS ASP ASP PRO LEU GLY GLU LEU LEU SEQRES 6 M 89 GLU VAL GLY SER PHE SER VAL LYS ASN PRO SER PRO LEU SEQRES 7 M 89 TYR GLU MET LEU LYS ARG ASN LEU VAL ILE LEU HET GLU A 213 193 ATOM 1 N PRO M 18 -12.662 -1.106 29.376 1.00 41.84 N ATOM 2 CA PRO M 18 -11.765 -1.006 28.229 1.00 41.64 C ATOM 3 C PRO M 18 -10.528 -1.893 28.391 1.00 41.48 C ATOM 4 O PRO M 18 -9.621 -1.563 29.160 1.00 41.58 O ATOM 5 CB PRO M 18 -11.383 0.477 28.228 1.00 41.63 C ATOM 6 CG PRO M 18 -12.594 1.174 28.798 1.00 41.73 C ATOM 7 CD PRO M 18 -13.359 0.167 29.641 1.00 41.84 C ATOM 8 HA PRO M 18 -12.227 -1.340 27.300 1.00 0.00 H ATOM 9 HD3 PRO M 18 -13.309 0.426 30.699 1.00 0.00 H ATOM 10 HD2 PRO M 18 -14.402 0.112 29.331 1.00 0.00 H ATOM 11 HG3 PRO M 18 -13.228 1.537 27.989 1.00 0.00 H ATOM 12 HG2 PRO M 18 -12.281 2.014 29.418 1.00 0.00 H ATOM 13 HB2 PRO M 18 -10.507 0.651 28.853 1.00 0.00 H ATOM 14 HB3 PRO M 18 -11.179 0.823 27.215 1.00 0.00 H ATOM 15 N GLY M 19 -10.492 -3.004 27.659 1.00 41.20 N ATOM 16 CA GLY M 19 -9.430 -3.996 27.821 1.00 40.74 C ATOM 17 C GLY M 19 -8.600 -4.313 26.589 1.00 40.36 C ATOM 18 O GLY M 19 -7.388 -4.526 26.694 1.00 40.46 O ATOM 19 HA3 GLY M 19 -9.893 -4.924 28.156 1.00 0.00 H ATOM 20 HA2 GLY M 19 -8.751 -3.631 28.592 1.00 0.00 H ATOM 21 H GLY M 19 -11.238 -3.171 26.954 1.00 0.00 H ATOM 22 N GLU M 20 -9.252 -4.347 25.426 1.00 39.85 N ATOM 23 CA GLU M 20 -8.622 -4.757 24.163 1.00 39.26 C ATOM 24 C GLU M 20 -7.580 -3.752 23.662 1.00 38.26 C ATOM 25 O GLU M 20 -7.768 -3.121 22.616 1.00 38.60 O ATOM 26 CB GLU M 20 -9.695 -4.990 23.091 1.00 39.52 C ATOM 27 CG GLU M 20 -10.429 -6.323 23.202 1.00 40.69 C ATOM 28 CD GLU M 20 -9.935 -7.360 22.198 1.00 42.25 C ATOM 29 OE1 GLU M 20 -8.737 -7.721 22.234 1.00 43.17 O ATOM 30 OE2 GLU M 20 -10.756 -7.821 21.374 1.00 42.78 O ATOM 31 HA GLU M 20 -8.090 -5.688 24.361 1.00 0.00 H ATOM 32 HB2 GLU M 20 -10.431 -4.190 23.167 1.00 0.00 H ATOM 33 HB3 GLU M 20 -9.214 -4.947 22.114 1.00 0.00 H ATOM 34 HG2 GLU M 20 -10.285 -6.717 24.208 1.00 0.00 H ATOM 35 HG3 GLU M 20 -11.491 -6.150 23.030 1.00 0.00 H ATOM 36 H GLU M 20 -10.254 -4.070 25.412 1.00 0.00 H ATOM 37 N GLY M 21 -6.484 -3.616 24.412 1.00 36.97 N ATOM 38 CA GLY M 21 -5.422 -2.642 24.120 1.00 34.83 C ATOM 39 C GLY M 21 -5.951 -1.267 23.747 1.00 33.50 C ATOM 40 O GLY M 21 -5.301 -0.532 22.991 1.00 33.62 O ATOM 41 HA3 GLY M 21 -4.825 -3.020 23.290 1.00 0.00 H ATOM 42 HA2 GLY M 21 -4.792 -2.542 25.004 1.00 0.00 H ATOM 43 H GLY M 21 -6.376 -4.230 25.245 1.00 0.00 H ATOM 44 N THR M 22 -7.132 -0.937 24.283 1.00 31.56 N ATOM 45 CA THR M 22 -7.891 0.282 23.962 1.00 29.64 C ATOM 46 C THR M 22 -7.042 1.541 24.145 1.00 27.87 C ATOM 47 O THR M 22 -6.314 1.646 25.125 1.00 27.74 O ATOM 48 CB THR M 22 -9.162 0.393 24.869 1.00 29.85 C ATOM 49 OG1 THR M 22 -9.824 -0.879 24.946 1.00 30.50 O ATOM 50 CG2 THR M 22 -10.140 1.440 24.346 1.00 29.66 C ATOM 51 HA THR M 22 -8.186 0.207 22.915 1.00 0.00 H ATOM 52 HB THR M 22 -8.831 0.701 25.861 1.00 0.00 H ATOM 53 HG1 THR M 22 -10.096 -1.164 24.038 1.00 0.00 H ATOM 54 HG23 THR M 22 -9.639 2.406 24.287 1.00 0.00 H ATOM 55 HG21 THR M 22 -10.487 1.148 23.355 1.00 0.00 H ATOM 56 HG22 THR M 22 -10.991 1.511 25.024 1.00 0.00 H ATOM 57 H THR M 22 -7.544 -1.591 24.979 1.00 0.00 H ATOM 58 N GLN M 23 -7.145 2.485 23.207 1.00 25.79 N ATOM 59 CA GLN M 23 -6.425 3.762 23.296 1.00 23.85 C ATOM 60 C GLN M 23 -7.293 4.851 23.908 1.00 22.71 C ATOM 61 O GLN M 23 -8.443 5.044 23.506 1.00 22.11 O ATOM 62 CB GLN M 23 -5.906 4.218 21.926 1.00 23.78 C ATOM 63 CG GLN M 23 -4.997 3.206 21.214 1.00 22.99 C ATOM 64 CD GLN M 23 -3.601 3.101 21.799 1.00 22.14 C ATOM 65 OE1 GLN M 23 -2.942 2.077 21.647 1.00 22.59 O ATOM 66 NE2 GLN M 23 -3.140 4.155 22.463 1.00 21.91 N ATOM 67 HA GLN M 23 -5.569 3.592 23.949 1.00 0.00 H ATOM 68 HB2 GLN M 23 -6.766 4.412 21.285 1.00 0.00 H ATOM 69 HB3 GLN M 23 -5.343 5.141 22.066 1.00 0.00 H ATOM 70 HG2 GLN M 23 -5.467 2.224 21.273 1.00 0.00 H ATOM 71 HG3 GLN M 23 -4.908 3.503 20.169 1.00 0.00 H ATOM 72 HE22 GLN M 23 -3.732 5.003 22.568 1.00 0.00 H ATOM 73 HE21 GLN M 23 -2.187 4.132 22.878 1.00 0.00 H ATOM 74 H GLN M 23 -7.757 2.310 22.384 1.00 0.00 H ATOM 75 N VAL M 24 -6.732 5.562 24.884 1.00 21.31 N ATOM 76 CA VAL M 24 -7.485 6.551 25.648 1.00 20.04 C ATOM 77 C VAL M 24 -6.754 7.889 25.806 1.00 19.45 C ATOM 78 O VAL M 24 -5.524 7.951 25.809 1.00 19.19 O ATOM 79 CB VAL M 24 -7.915 6.012 27.056 1.00 20.04 C ATOM 80 CG1 VAL M 24 -8.842 4.810 26.925 1.00 19.46 C ATOM 81 CG2 VAL M 24 -6.697 5.675 27.933 1.00 19.65 C ATOM 82 HA VAL M 24 -8.380 6.736 25.054 1.00 0.00 H ATOM 83 HB VAL M 24 -8.465 6.811 27.554 1.00 0.00 H ATOM 84 HG11 VAL M 24 -9.737 5.101 26.375 1.00 0.00 H ATOM 85 HG12 VAL M 24 -8.327 4.013 26.389 1.00 0.00 H ATOM 86 HG13 VAL M 24 -9.123 4.459 27.918 1.00 0.00 H ATOM 87 HG21 VAL M 24 -6.097 4.910 27.441 1.00 0.00 H ATOM 88 HG22 VAL M 24 -6.096 6.573 28.078 1.00 0.00 H ATOM 89 HG23 VAL M 24 -7.038 5.305 28.900 1.00 0.00 H ATOM 90 H VAL M 24 -5.728 5.408 25.108 1.00 0.00 H ATOM 91 N HIS M 25 -7.539 8.955 25.920 1.00 18.59 N ATOM 92 CA HIS M 25 -7.037 10.254 26.313 1.00 17.97 C ATOM 93 C HIS M 25 -7.593 10.551 27.706 1.00 17.43 C ATOM 94 O HIS M 25 -8.809 10.639 27.874 1.00 17.35 O ATOM 95 CB HIS M 25 -7.457 11.328 25.301 1.00 18.00 C ATOM 96 CG HIS M 25 -6.977 12.704 25.646 1.00 19.11 C ATOM 97 ND1 HIS M 25 -5.642 13.008 25.818 1.00 19.52 N ATOM 98 CD2 HIS M 25 -7.654 13.857 25.862 1.00 19.62 C ATOM 99 CE1 HIS M 25 -5.518 14.286 26.128 1.00 19.35 C ATOM 100 NE2 HIS M 25 -6.724 14.825 26.156 1.00 20.43 N ATOM 101 HA HIS M 25 -5.947 10.258 26.335 1.00 0.00 H ATOM 102 HB2 HIS M 25 -7.054 11.058 24.325 1.00 0.00 H ATOM 103 HB3 HIS M 25 -8.546 11.346 25.250 1.00 0.00 H ATOM 104 HD2 HIS M 25 -8.734 13.992 25.812 1.00 0.00 H ATOM 105 HE1 HIS M 25 -4.581 14.807 26.327 1.00 0.00 H ATOM 106 H HIS M 25 -8.554 8.852 25.719 1.00 0.00 H ATOM 107 N PRO M 26 -6.712 10.664 28.720 1.00 16.95 N ATOM 108 CA PRO M 26 -7.177 10.994 30.074 1.00 16.95 C ATOM 109 C PRO M 26 -7.566 12.463 30.241 1.00 16.74 C ATOM 110 O PRO M 26 -6.907 13.343 29.702 1.00 16.90 O ATOM 111 CB PRO M 26 -5.963 10.667 30.968 1.00 16.76 C ATOM 112 CG PRO M 26 -4.983 9.936 30.072 1.00 17.33 C ATOM 113 CD PRO M 26 -5.259 10.453 28.688 1.00 16.90 C ATOM 114 HA PRO M 26 -8.080 10.436 30.322 1.00 0.00 H ATOM 115 HD3 PRO M 26 -4.728 11.386 28.501 1.00 0.00 H ATOM 116 HD2 PRO M 26 -4.982 9.721 27.930 1.00 0.00 H ATOM 117 HG3 PRO M 26 -5.150 8.860 30.119 1.00 0.00 H ATOM 118 HG2 PRO M 26 -3.957 10.157 30.366 1.00 0.00 H ATOM 119 HB2 PRO M 26 -5.516 11.583 31.354 1.00 0.00 H ATOM 120 HB3 PRO M 26 -6.264 10.032 31.801 1.00 0.00 H ATOM 121 N ARG M 27 -8.621 12.718 31.008 1.00 16.90 N ATOM 122 CA ARG M 27 -9.022 14.084 31.337 1.00 16.87 C ATOM 123 C ARG M 27 -7.894 14.798 32.097 1.00 16.53 C ATOM 124 O ARG M 27 -7.061 14.151 32.747 1.00 16.27 O ATOM 125 CB ARG M 27 -10.327 14.088 32.145 1.00 16.82 C ATOM 126 CG ARG M 27 -11.471 13.318 31.471 1.00 17.92 C ATOM 127 CD ARG M 27 -12.832 13.626 32.087 1.00 17.73 C ATOM 128 NE ARG M 27 -13.876 12.727 31.580 1.00 21.13 N ATOM 129 CZ ARG M 27 -14.549 12.895 30.436 1.00 22.49 C ATOM 130 NH1 ARG M 27 -14.309 13.934 29.644 1.00 22.82 N ATOM 131 NH2 ARG M 27 -15.471 12.011 30.074 1.00 22.86 N ATOM 132 HA ARG M 27 -9.206 14.628 30.411 1.00 0.00 H ATOM 133 HB2 ARG M 27 -10.132 13.635 33.117 1.00 0.00 H ATOM 134 HB3 ARG M 27 -10.643 15.122 32.285 1.00 0.00 H ATOM 135 HG2 ARG M 27 -11.497 13.586 30.415 1.00 0.00 H ATOM 136 HG3 ARG M 27 -11.278 12.250 31.569 1.00 0.00 H ATOM 137 HD2 ARG M 27 -13.104 14.654 31.847 1.00 0.00 H ATOM 138 HD3 ARG M 27 -12.764 13.513 33.169 1.00 0.00 H ATOM 139 HE ARG M 27 -14.111 11.893 32.156 1.00 0.00 H ATOM 140 HH12 ARG M 27 -14.843 14.047 28.759 1.00 0.00 H ATOM 141 HH11 ARG M 27 -13.587 14.634 29.909 1.00 0.00 H ATOM 142 HH22 ARG M 27 -15.995 12.140 29.185 1.00 0.00 H ATOM 143 HH21 ARG M 27 -15.669 11.189 30.679 1.00 0.00 H ATOM 144 H ARG M 27 -9.176 11.923 31.384 1.00 0.00 H ATOM 145 N ALA M 28 -7.891 16.127 32.014 1.00 15.78 N ATOM 146 CA ALA M 28 -6.842 16.975 32.585 1.00 15.28 C ATOM 147 C ALA M 28 -6.365 16.627 34.008 1.00 14.68 C ATOM 148 O ALA M 28 -5.164 16.518 34.229 1.00 14.54 O ATOM 149 CB ALA M 28 -7.243 18.454 32.492 1.00 15.30 C ATOM 150 HA ALA M 28 -5.969 16.768 31.966 1.00 0.00 H ATOM 151 HB1 ALA M 28 -7.390 18.724 31.446 1.00 0.00 H ATOM 152 HB2 ALA M 28 -8.170 18.613 33.043 1.00 0.00 H ATOM 153 HB3 ALA M 28 -6.453 19.071 32.920 1.00 0.00 H ATOM 154 H ALA M 28 -8.678 16.589 31.515 1.00 0.00 H ATOM 155 N PRO M 29 -7.293 16.443 34.971 1.00 14.51 N ATOM 156 CA PRO M 29 -6.823 16.172 36.331 1.00 14.01 C ATOM 157 C PRO M 29 -6.016 14.877 36.437 1.00 13.46 C ATOM 158 O PRO M 29 -5.004 14.857 37.128 1.00 13.03 O ATOM 159 CB PRO M 29 -8.123 16.070 37.140 1.00 14.23 C ATOM 160 CG PRO M 29 -9.149 16.774 36.313 1.00 14.62 C ATOM 161 CD PRO M 29 -8.770 16.467 34.910 1.00 14.70 C ATOM 162 HA PRO M 29 -6.142 16.946 36.684 1.00 0.00 H ATOM 163 HD3 PRO M 29 -9.167 15.501 34.598 1.00 0.00 H ATOM 164 HD2 PRO M 29 -9.123 17.241 34.229 1.00 0.00 H ATOM 165 HG3 PRO M 29 -9.119 17.848 36.494 1.00 0.00 H ATOM 166 HG2 PRO M 29 -10.148 16.397 36.534 1.00 0.00 H ATOM 167 HB2 PRO M 29 -8.401 15.027 37.289 1.00 0.00 H ATOM 168 HB3 PRO M 29 -8.011 16.557 38.109 1.00 0.00 H ATOM 169 N LEU M 30 -6.464 13.823 35.747 1.00 12.94 N ATOM 170 CA LEU M 30 -5.732 12.547 35.678 1.00 12.38 C ATOM 171 C LEU M 30 -4.433 12.652 34.871 1.00 12.24 C ATOM 172 O LEU M 30 -3.403 12.108 35.271 1.00 12.36 O ATOM 173 CB LEU M 30 -6.620 11.418 35.121 1.00 11.88 C ATOM 174 CG LEU M 30 -5.981 10.024 35.095 1.00 11.83 C ATOM 175 CD1 LEU M 30 -5.489 9.593 36.497 1.00 11.56 C ATOM 176 CD2 LEU M 30 -6.913 8.974 34.493 1.00 11.48 C ATOM 177 HA LEU M 30 -5.456 12.301 36.703 1.00 0.00 H ATOM 178 HB2 LEU M 30 -7.519 11.364 35.735 1.00 0.00 H ATOM 179 HB3 LEU M 30 -6.895 11.680 34.099 1.00 0.00 H ATOM 180 HG LEU M 30 -5.109 10.094 34.444 1.00 0.00 H ATOM 181 HD21 LEU M 30 -7.826 8.918 35.086 1.00 0.00 H ATOM 182 HD22 LEU M 30 -7.160 9.254 33.469 1.00 0.00 H ATOM 183 HD23 LEU M 30 -6.416 8.004 34.497 1.00 0.00 H ATOM 184 HD11 LEU M 30 -4.745 10.305 36.854 1.00 0.00 H ATOM 185 HD12 LEU M 30 -6.333 9.571 37.186 1.00 0.00 H ATOM 186 HD13 LEU M 30 -5.043 8.600 36.435 1.00 0.00 H ATOM 187 H LEU M 30 -7.367 13.908 35.238 1.00 0.00 H ATOM 188 N LEU M 31 -4.488 13.351 33.743 1.00 11.99 N ATOM 189 CA LEU M 31 -3.295 13.597 32.935 1.00 12.38 C ATOM 190 C LEU M 31 -2.177 14.298 33.725 1.00 11.90 C ATOM 191 O LEU M 31 -1.017 13.924 33.606 1.00 11.94 O ATOM 192 CB LEU M 31 -3.646 14.377 31.662 1.00 12.11 C ATOM 193 CG LEU M 31 -2.567 14.476 30.584 1.00 12.72 C ATOM 194 CD1 LEU M 31 -2.100 13.102 30.074 1.00 12.28 C ATOM 195 CD2 LEU M 31 -3.025 15.366 29.429 1.00 12.80 C ATOM 196 HA LEU M 31 -2.905 12.621 32.645 1.00 0.00 H ATOM 197 HB2 LEU M 31 -4.516 13.898 31.213 1.00 0.00 H ATOM 198 HB3 LEU M 31 -3.906 15.393 31.960 1.00 0.00 H ATOM 199 HG LEU M 31 -1.701 14.940 31.055 1.00 0.00 H ATOM 200 HD21 LEU M 31 -3.927 14.946 28.984 1.00 0.00 H ATOM 201 HD22 LEU M 31 -3.236 16.367 29.805 1.00 0.00 H ATOM 202 HD23 LEU M 31 -2.237 15.418 28.677 1.00 0.00 H ATOM 203 HD11 LEU M 31 -1.688 12.528 30.904 1.00 0.00 H ATOM 204 HD12 LEU M 31 -2.948 12.567 29.647 1.00 0.00 H ATOM 205 HD13 LEU M 31 -1.334 13.240 29.311 1.00 0.00 H ATOM 206 H LEU M 31 -5.402 13.733 33.427 1.00 0.00 H ATOM 207 N GLN M 32 -2.527 15.290 34.539 1.00 11.90 N ATOM 208 CA GLN M 32 -1.531 15.974 35.388 1.00 12.43 C ATOM 209 C GLN M 32 -0.772 15.006 36.303 1.00 11.39 C ATOM 210 O GLN M 32 0.427 15.143 36.495 1.00 10.90 O ATOM 211 CB GLN M 32 -2.185 17.075 36.236 1.00 12.12 C ATOM 212 CG GLN M 32 -1.921 18.501 35.763 1.00 14.16 C ATOM 213 CD GLN M 32 -2.232 19.542 36.842 1.00 14.74 C ATOM 214 OE1 GLN M 32 -1.327 20.180 37.384 1.00 17.59 O ATOM 215 NE2 GLN M 32 -3.516 19.703 37.163 1.00 17.70 N ATOM 216 HA GLN M 32 -0.811 16.424 34.705 1.00 0.00 H ATOM 217 HB2 GLN M 32 -3.263 16.911 36.229 1.00 0.00 H ATOM 218 HB3 GLN M 32 -1.811 16.983 37.256 1.00 0.00 H ATOM 219 HG2 GLN M 32 -0.871 18.589 35.484 1.00 0.00 H ATOM 220 HG3 GLN M 32 -2.545 18.702 34.892 1.00 0.00 H ATOM 221 HE22 GLN M 32 -4.247 19.143 36.680 1.00 0.00 H ATOM 222 HE21 GLN M 32 -3.787 20.389 37.897 1.00 0.00 H ATOM 223 H GLN M 32 -3.522 15.590 34.578 1.00 0.00 H ATOM 224 N ILE M 33 -1.499 14.045 36.863 1.00 11.23 N ATOM 225 CA ILE M 33 -0.953 13.008 37.747 1.00 11.37 C ATOM 226 C ILE M 33 0.032 12.074 37.033 1.00 11.30 C ATOM 227 O ILE M 33 1.104 11.767 37.562 1.00 11.66 O ATOM 228 CB ILE M 33 -2.102 12.225 38.434 1.00 11.20 C ATOM 229 CG1 ILE M 33 -2.632 13.053 39.612 1.00 11.73 C ATOM 230 CG2 ILE M 33 -1.645 10.842 38.893 1.00 11.32 C ATOM 231 CD1 ILE M 33 -3.998 12.669 40.089 1.00 12.42 C ATOM 232 HA ILE M 33 -0.371 13.512 38.519 1.00 0.00 H ATOM 233 HB ILE M 33 -2.903 12.065 37.713 1.00 0.00 H ATOM 234 HG12 ILE M 33 -1.938 12.940 40.445 1.00 0.00 H ATOM 235 HG13 ILE M 33 -2.662 14.098 39.305 1.00 0.00 H ATOM 236 HD11 ILE M 33 -4.713 12.789 39.275 1.00 0.00 H ATOM 237 HD12 ILE M 33 -3.988 11.629 40.416 1.00 0.00 H ATOM 238 HD13 ILE M 33 -4.284 13.310 40.923 1.00 0.00 H ATOM 239 HG21 ILE M 33 -1.305 10.268 38.031 1.00 0.00 H ATOM 240 HG22 ILE M 33 -0.827 10.949 39.605 1.00 0.00 H ATOM 241 HG23 ILE M 33 -2.478 10.325 39.369 1.00 0.00 H ATOM 242 H ILE M 33 -2.519 14.026 36.662 1.00 0.00 H ATOM 243 N LEU M 34 -0.323 11.654 35.822 1.00 11.22 N ATOM 244 CA LEU M 34 0.515 10.752 35.048 1.00 10.83 C ATOM 245 C LEU M 34 1.804 11.440 34.607 1.00 11.36 C ATOM 246 O LEU M 34 2.850 10.798 34.538 1.00 11.36 O ATOM 247 CB LEU M 34 -0.256 10.192 33.847 1.00 10.32 C ATOM 248 CG LEU M 34 -1.646 9.585 34.109 1.00 10.00 C ATOM 249 CD1 LEU M 34 -2.317 9.119 32.807 1.00 6.37 C ATOM 250 CD2 LEU M 34 -1.636 8.458 35.171 1.00 8.69 C ATOM 251 HA LEU M 34 0.793 9.915 35.688 1.00 0.00 H ATOM 252 HB2 LEU M 34 -0.385 11.007 33.134 1.00 0.00 H ATOM 253 HB3 LEU M 34 0.360 9.413 33.399 1.00 0.00 H ATOM 254 HG LEU M 34 -2.246 10.392 34.529 1.00 0.00 H ATOM 255 HD21 LEU M 34 -0.984 7.651 34.837 1.00 0.00 H ATOM 256 HD22 LEU M 34 -1.268 8.855 36.117 1.00 0.00 H ATOM 257 HD23 LEU M 34 -2.649 8.077 35.304 1.00 0.00 H ATOM 258 HD11 LEU M 34 -2.434 9.970 32.136 1.00 0.00 H ATOM 259 HD12 LEU M 34 -1.695 8.361 32.330 1.00 0.00 H ATOM 260 HD13 LEU M 34 -3.296 8.697 33.035 1.00 0.00 H ATOM 261 H LEU M 34 -1.224 11.979 35.418 1.00 0.00 H ATOM 262 N LYS M 35 1.729 12.743 34.319 1.00 11.87 N ATOM 263 CA LYS M 35 2.909 13.513 33.887 1.00 12.75 C ATOM 264 C LYS M 35 3.900 13.743 35.030 1.00 12.37 C ATOM 265 O LYS M 35 5.102 13.815 34.799 1.00 12.14 O ATOM 266 CB LYS M 35 2.509 14.831 33.209 1.00 12.66 C ATOM 267 CG LYS M 35 1.873 14.630 31.812 1.00 13.96 C ATOM 268 CD LYS M 35 1.573 15.955 31.118 1.00 14.47 C ATOM 269 CE LYS M 35 0.702 15.781 29.852 1.00 17.06 C ATOM 270 NZ LYS M 35 1.455 15.554 28.575 1.00 19.37 N ATOM 271 HA LYS M 35 3.424 12.907 33.142 1.00 0.00 H ATOM 272 HB2 LYS M 35 1.790 15.345 33.847 1.00 0.00 H ATOM 273 HB3 LYS M 35 3.400 15.448 33.098 1.00 0.00 H ATOM 274 HG2 LYS M 35 2.562 14.057 31.192 1.00 0.00 H ATOM 275 HG3 LYS M 35 0.942 14.075 31.927 1.00 0.00 H ATOM 276 HD2 LYS M 35 1.046 16.604 31.818 1.00 0.00 H ATOM 277 HD3 LYS M 35 2.516 16.421 30.832 1.00 0.00 H ATOM 278 HE2 LYS M 35 0.101 16.682 29.732 1.00 0.00 H ATOM 279 HE3 LYS M 35 0.045 14.926 30.011 1.00 0.00 H ATOM 280 HZ1 LYS M 35 2.079 16.366 28.393 1.00 0.00 H ATOM 281 HZ2 LYS M 35 2.026 14.689 28.660 1.00 0.00 H ATOM 282 HZ3 LYS M 35 0.781 15.450 27.790 1.00 0.00 H ATOM 283 H LYS M 35 0.812 13.227 34.402 1.00 0.00 H ATOM 284 N VAL M 36 3.378 13.861 36.254 1.00 12.47 N ATOM 285 CA VAL M 36 4.198 13.900 37.476 1.00 12.53 C ATOM 286 C VAL M 36 4.939 12.567 37.642 1.00 12.57 C ATOM 287 O VAL M 36 6.127 12.549 37.966 1.00 12.85 O ATOM 288 CB VAL M 36 3.332 14.216 38.728 1.00 12.69 C ATOM 289 CG1 VAL M 36 4.086 13.911 40.007 1.00 13.08 C ATOM 290 CG2 VAL M 36 2.857 15.690 38.715 1.00 11.80 C ATOM 291 HA VAL M 36 4.929 14.702 37.379 1.00 0.00 H ATOM 292 HB VAL M 36 2.453 13.573 38.693 1.00 0.00 H ATOM 293 HG11 VAL M 36 4.354 12.855 40.026 1.00 0.00 H ATOM 294 HG12 VAL M 36 4.991 14.517 40.047 1.00 0.00 H ATOM 295 HG13 VAL M 36 3.454 14.142 40.864 1.00 0.00 H ATOM 296 HG21 VAL M 36 3.725 16.350 38.713 1.00 0.00 H ATOM 297 HG22 VAL M 36 2.260 15.870 37.821 1.00 0.00 H ATOM 298 HG23 VAL M 36 2.253 15.884 39.602 1.00 0.00 H ATOM 299 H VAL M 36 2.344 13.928 36.348 1.00 0.00 H ATOM 300 N ALA M 37 4.236 11.466 37.368 1.00 12.34 N ATOM 301 CA ALA M 37 4.804 10.119 37.404 1.00 12.21 C ATOM 302 C ALA M 37 5.804 9.840 36.282 1.00 12.33 C ATOM 303 O ALA M 37 6.398 8.758 36.238 1.00 12.26 O ATOM 304 CB ALA M 37 3.690 9.085 37.373 1.00 12.10 C ATOM 305 HA ALA M 37 5.363 10.049 38.337 1.00 0.00 H ATOM 306 HB1 ALA M 37 3.042 9.225 38.238 1.00 0.00 H ATOM 307 HB2 ALA M 37 3.109 9.206 36.459 1.00 0.00 H ATOM 308 HB3 ALA M 37 4.123 8.085 37.400 1.00 0.00 H ATOM 309 H ALA M 37 3.233 11.572 37.116 1.00 0.00 H ATOM 310 N GLY M 38 5.964 10.792 35.366 1.00 12.41 N ATOM 311 CA GLY M 38 6.991 10.703 34.328 1.00 12.97 C ATOM 312 C GLY M 38 6.505 10.525 32.899 1.00 13.53 C ATOM 313 O GLY M 38 7.320 10.454 31.982 1.00 13.30 O ATOM 314 HA3 GLY M 38 7.630 9.853 34.568 1.00 0.00 H ATOM 315 HA2 GLY M 38 7.579 11.620 34.365 1.00 0.00 H ATOM 316 H GLY M 38 5.340 11.624 35.389 1.00 0.00 H ATOM 317 N ALA M 39 5.187 10.444 32.705 1.00 14.00 N ATOM 318 CA ALA M 39 4.607 10.217 31.373 1.00 14.62 C ATOM 319 C ALA M 39 4.757 11.450 30.494 1.00 15.24 C ATOM 320 O ALA M 39 4.362 12.545 30.885 1.00 15.04 O ATOM 321 CB ALA M 39 3.136 9.819 31.483 1.00 14.31 C ATOM 322 HA ALA M 39 5.154 9.397 30.907 1.00 0.00 H ATOM 323 HB1 ALA M 39 3.052 8.901 32.065 1.00 0.00 H ATOM 324 HB2 ALA M 39 2.581 10.616 31.977 1.00 0.00 H ATOM 325 HB3 ALA M 39 2.729 9.657 30.485 1.00 0.00 H ATOM 326 H ALA M 39 4.550 10.545 33.521 1.00 0.00 H ATOM 327 N GLN M 40 5.355 11.264 29.320 1.00 16.05 N ATOM 328 CA GLN M 40 5.469 12.326 28.326 1.00 17.15 C ATOM 329 C GLN M 40 4.568 11.949 27.151 1.00 17.21 C ATOM 330 O GLN M 40 5.024 11.595 26.055 1.00 17.22 O ATOM 331 CB GLN M 40 6.924 12.534 27.910 1.00 16.79 C ATOM 332 CG GLN M 40 7.808 13.006 29.060 1.00 18.16 C ATOM 333 CD GLN M 40 9.242 13.306 28.640 1.00 18.76 C ATOM 334 OE1 GLN M 40 10.156 13.281 29.462 1.00 21.76 O ATOM 335 NE2 GLN M 40 9.440 13.605 27.367 1.00 20.18 N ATOM 336 HA GLN M 40 5.144 13.282 28.737 1.00 0.00 H ATOM 337 HB2 GLN M 40 7.317 11.589 27.534 1.00 0.00 H ATOM 338 HB3 GLN M 40 6.956 13.281 27.117 1.00 0.00 H ATOM 339 HG2 GLN M 40 7.374 13.914 29.479 1.00 0.00 H ATOM 340 HG3 GLN M 40 7.827 12.228 29.823 1.00 0.00 H ATOM 341 HE22 GLN M 40 8.638 13.615 26.704 1.00 0.00 H ATOM 342 HE21 GLN M 40 10.397 13.830 27.029 1.00 0.00 H ATOM 343 H GLN M 40 5.755 10.329 29.103 1.00 0.00 H ATOM 344 N GLU M 41 3.269 12.037 27.409 1.00 17.28 N ATOM 345 CA GLU M 41 2.289 11.383 26.583 1.00 17.51 C ATOM 346 C GLU M 41 0.918 12.040 26.714 1.00 17.19 C ATOM 347 O GLU M 41 0.580 12.618 27.752 1.00 17.49 O ATOM 348 CB GLU M 41 2.218 9.915 27.006 1.00 17.79 C ATOM 349 CG GLU M 41 1.821 8.957 25.922 1.00 20.08 C ATOM 350 CD GLU M 41 2.797 8.919 24.762 1.00 22.30 C ATOM 351 OE1 GLU M 41 3.974 8.541 24.959 1.00 22.74 O ATOM 352 OE2 GLU M 41 2.362 9.253 23.643 1.00 24.17 O ATOM 353 HA GLU M 41 2.584 11.467 25.537 1.00 0.00 H ATOM 354 HB2 GLU M 41 3.202 9.621 27.373 1.00 0.00 H ATOM 355 HB3 GLU M 41 1.491 9.831 27.814 1.00 0.00 H ATOM 356 HG2 GLU M 41 1.756 7.957 26.351 1.00 0.00 H ATOM 357 HG3 GLU M 41 0.843 9.252 25.541 1.00 0.00 H ATOM 358 H GLU M 41 2.952 12.593 28.229 1.00 0.00 H ATOM 359 N GLU M 42 0.132 11.936 25.649 1.00 16.65 N ATOM 360 CA GLU M 42 -1.232 12.422 25.628 1.00 15.89 C ATOM 361 C GLU M 42 -2.208 11.263 25.384 1.00 14.93 C ATOM 362 O GLU M 42 -3.375 11.325 25.778 1.00 14.93 O ATOM 363 CB GLU M 42 -1.353 13.475 24.533 1.00 16.39 C ATOM 364 CG GLU M 42 -2.390 14.538 24.800 1.00 18.89 C ATOM 365 CD GLU M 42 -1.927 15.634 25.756 1.00 20.09 C ATOM 366 OE1 GLU M 42 -0.724 15.710 26.100 1.00 21.34 O ATOM 367 OE2 GLU M 42 -2.791 16.437 26.151 1.00 21.54 O ATOM 368 HA GLU M 42 -1.485 12.868 26.590 1.00 0.00 H ATOM 369 HB2 GLU M 42 -0.385 13.963 24.421 1.00 0.00 H ATOM 370 HB3 GLU M 42 -1.614 12.971 23.602 1.00 0.00 H ATOM 371 HG2 GLU M 42 -2.657 15.002 23.851 1.00 0.00 H ATOM 372 HG3 GLU M 42 -3.270 14.058 25.229 1.00 0.00 H ATOM 373 H GLU M 42 0.513 11.486 24.792 1.00 0.00 H ATOM 374 N VAL M 43 -1.708 10.210 24.740 1.00 13.70 N ATOM 375 CA VAL M 43 -2.463 8.995 24.413 1.00 12.64 C ATOM 376 C VAL M 43 -1.863 7.797 25.162 1.00 11.93 C ATOM 377 O VAL M 43 -0.648 7.652 25.225 1.00 10.85 O ATOM 378 CB VAL M 43 -2.437 8.712 22.876 1.00 12.60 C ATOM 379 CG1 VAL M 43 -3.102 7.393 22.538 1.00 12.10 C ATOM 380 CG2 VAL M 43 -3.134 9.828 22.125 1.00 13.53 C ATOM 381 HA VAL M 43 -3.498 9.145 24.719 1.00 0.00 H ATOM 382 HB VAL M 43 -1.391 8.658 22.574 1.00 0.00 H ATOM 383 HG11 VAL M 43 -2.578 6.583 23.046 1.00 0.00 H ATOM 384 HG12 VAL M 43 -4.141 7.417 22.866 1.00 0.00 H ATOM 385 HG13 VAL M 43 -3.063 7.234 21.460 1.00 0.00 H ATOM 386 HG21 VAL M 43 -4.170 9.897 22.458 1.00 0.00 H ATOM 387 HG22 VAL M 43 -2.624 10.771 22.323 1.00 0.00 H ATOM 388 HG23 VAL M 43 -3.108 9.617 21.056 1.00 0.00 H ATOM 389 H VAL M 43 -0.711 10.252 24.448 1.00 0.00 H ATOM 390 N PHE M 44 -2.733 6.951 25.717 1.00 11.84 N ATOM 391 CA PHE M 44 -2.344 5.787 26.533 1.00 11.92 C ATOM 392 C PHE M 44 -3.256 4.593 26.255 1.00 11.73 C ATOM 393 O PHE M 44 -4.409 4.763 25.849 1.00 11.64 O ATOM 394 CB PHE M 44 -2.512 6.104 28.027 1.00 11.87 C ATOM 395 CG PHE M 44 -1.704 7.272 28.520 1.00 12.57 C ATOM 396 CD1 PHE M 44 -0.541 7.062 29.264 1.00 12.55 C ATOM 397 CD2 PHE M 44 -2.120 8.581 28.278 1.00 12.44 C ATOM 398 CE1 PHE M 44 0.213 8.140 29.741 1.00 13.01 C ATOM 399 CE2 PHE M 44 -1.372 9.665 28.743 1.00 13.41 C ATOM 400 CZ PHE M 44 -0.205 9.441 29.487 1.00 12.70 C ATOM 401 HA PHE M 44 -1.309 5.558 26.280 1.00 0.00 H ATOM 402 HB2 PHE M 44 -3.565 6.318 28.212 1.00 0.00 H ATOM 403 HB3 PHE M 44 -2.216 5.223 28.596 1.00 0.00 H ATOM 404 HD2 PHE M 44 -3.039 8.760 27.720 1.00 0.00 H ATOM 405 HE2 PHE M 44 -1.695 10.684 28.528 1.00 0.00 H ATOM 406 HZ PHE M 44 0.373 10.284 29.865 1.00 0.00 H ATOM 407 HE1 PHE M 44 1.125 7.960 30.310 1.00 0.00 H ATOM 408 HD1 PHE M 44 -0.216 6.044 29.476 1.00 0.00 H ATOM 409 H PHE M 44 -3.747 7.124 25.564 1.00 0.00 H ATOM 410 N THR M 45 -2.751 3.388 26.498 1.00 12.01 N ATOM 411 CA THR M 45 -3.625 2.249 26.775 1.00 12.40 C ATOM 412 C THR M 45 -3.916 2.238 28.281 1.00 12.63 C ATOM 413 O THR M 45 -3.193 2.865 29.067 1.00 12.31 O ATOM 414 CB THR M 45 -2.981 0.909 26.398 1.00 12.78 C ATOM 415 OG1 THR M 45 -1.871 0.657 27.267 1.00 13.13 O ATOM 416 CG2 THR M 45 -2.513 0.909 24.926 1.00 12.67 C ATOM 417 HA THR M 45 -4.530 2.360 26.178 1.00 0.00 H ATOM 418 HB THR M 45 -3.725 0.120 26.511 1.00 0.00 H ATOM 419 HG1 THR M 45 -1.454 -0.208 27.025 1.00 0.00 H ATOM 420 HG23 THR M 45 -3.366 1.102 24.275 1.00 0.00 H ATOM 421 HG21 THR M 45 -1.763 1.687 24.785 1.00 0.00 H ATOM 422 HG22 THR M 45 -2.081 -0.062 24.683 1.00 0.00 H ATOM 423 H THR M 45 -1.720 3.253 26.491 1.00 0.00 H ATOM 424 N VAL M 46 -4.969 1.531 28.679 1.00 12.77 N ATOM 425 CA VAL M 46 -5.298 1.358 30.092 1.00 13.10 C ATOM 426 C VAL M 46 -4.109 0.769 30.870 1.00 13.32 C ATOM 427 O VAL M 46 -3.830 1.188 31.995 1.00 13.72 O ATOM 428 CB VAL M 46 -6.592 0.506 30.274 1.00 13.17 C ATOM 429 CG1 VAL M 46 -6.908 0.271 31.750 1.00 12.98 C ATOM 430 CG2 VAL M 46 -7.762 1.197 29.593 1.00 13.04 C ATOM 431 HA VAL M 46 -5.503 2.343 30.511 1.00 0.00 H ATOM 432 HB VAL M 46 -6.423 -0.467 29.813 1.00 0.00 H ATOM 433 HG11 VAL M 46 -6.078 -0.258 32.218 1.00 0.00 H ATOM 434 HG12 VAL M 46 -7.055 1.230 32.246 1.00 0.00 H ATOM 435 HG13 VAL M 46 -7.816 -0.326 31.835 1.00 0.00 H ATOM 436 HG21 VAL M 46 -7.911 2.180 30.039 1.00 0.00 H ATOM 437 HG22 VAL M 46 -7.548 1.307 28.530 1.00 0.00 H ATOM 438 HG23 VAL M 46 -8.663 0.597 29.724 1.00 0.00 H ATOM 439 H VAL M 46 -5.578 1.087 27.962 1.00 0.00 H ATOM 440 N LYS M 47 -3.406 -0.179 30.250 1.00 13.35 N ATOM 441 CA LYS M 47 -2.219 -0.796 30.828 1.00 13.46 C ATOM 442 C LYS M 47 -1.145 0.246 31.147 1.00 13.20 C ATOM 443 O LYS M 47 -0.541 0.202 32.225 1.00 12.94 O ATOM 444 CB LYS M 47 -1.660 -1.866 29.884 1.00 13.49 C ATOM 445 CG LYS M 47 -0.350 -2.500 30.355 1.00 13.80 C ATOM 446 CD LYS M 47 0.021 -3.711 29.520 1.00 14.30 C ATOM 447 CE LYS M 47 1.223 -4.424 30.121 1.00 17.27 C ATOM 448 NZ LYS M 47 1.165 -5.895 29.850 1.00 19.30 N ATOM 449 HA LYS M 47 -2.513 -1.269 31.765 1.00 0.00 H ATOM 450 HB2 LYS M 47 -2.405 -2.656 29.784 1.00 0.00 H ATOM 451 HB3 LYS M 47 -1.486 -1.406 28.911 1.00 0.00 H ATOM 452 HG2 LYS M 47 0.448 -1.761 30.279 1.00 0.00 H ATOM 453 HG3 LYS M 47 -0.460 -2.808 31.395 1.00 0.00 H ATOM 454 HD2 LYS M 47 -0.825 -4.398 29.488 1.00 0.00 H ATOM 455 HD3 LYS M 47 0.264 -3.388 28.508 1.00 0.00 H ATOM 456 HE2 LYS M 47 1.233 -4.260 31.199 1.00 0.00 H ATOM 457 HE3 LYS M 47 2.135 -4.016 29.684 1.00 0.00 H ATOM 458 HZ1 LYS M 47 0.299 -6.290 30.269 1.00 0.00 H ATOM 459 HZ2 LYS M 47 1.160 -6.057 28.823 1.00 0.00 H ATOM 460 HZ3 LYS M 47 1.996 -6.357 30.271 1.00 0.00 H ATOM 461 H LYS M 47 -3.719 -0.493 29.309 1.00 0.00 H ATOM 462 N GLU M 48 -0.925 1.173 30.209 1.00 12.56 N ATOM 463 CA GLU M 48 0.017 2.287 30.394 1.00 12.79 C ATOM 464 C GLU M 48 -0.419 3.264 31.491 1.00 11.92 C ATOM 465 O GLU M 48 0.407 3.757 32.243 1.00 12.14 O ATOM 466 CB GLU M 48 0.268 3.027 29.069 1.00 12.59 C ATOM 467 CG GLU M 48 1.254 2.287 28.148 1.00 13.49 C ATOM 468 CD GLU M 48 1.191 2.715 26.684 1.00 13.73 C ATOM 469 OE1 GLU M 48 0.417 3.638 26.327 1.00 13.82 O ATOM 470 OE2 GLU M 48 1.924 2.102 25.877 1.00 15.14 O ATOM 471 HA GLU M 48 0.955 1.843 30.728 1.00 0.00 H ATOM 472 HB2 GLU M 48 -0.682 3.136 28.546 1.00 0.00 H ATOM 473 HB3 GLU M 48 0.674 4.014 29.293 1.00 0.00 H ATOM 474 HG2 GLU M 48 2.265 2.469 28.514 1.00 0.00 H ATOM 475 HG3 GLU M 48 1.036 1.220 28.201 1.00 0.00 H ATOM 476 H GLU M 48 -1.442 1.103 29.310 1.00 0.00 H ATOM 477 N VAL M 49 -1.717 3.532 31.576 1.00 11.31 N ATOM 478 CA VAL M 49 -2.272 4.366 32.641 1.00 10.71 C ATOM 479 C VAL M 49 -2.014 3.733 34.016 1.00 10.39 C ATOM 480 O VAL M 49 -1.540 4.400 34.919 1.00 10.15 O ATOM 481 CB VAL M 49 -3.792 4.618 32.439 1.00 10.55 C ATOM 482 CG1 VAL M 49 -4.424 5.186 33.712 1.00 9.33 C ATOM 483 CG2 VAL M 49 -4.022 5.560 31.262 1.00 10.06 C ATOM 484 HA VAL M 49 -1.766 5.330 32.597 1.00 0.00 H ATOM 485 HB VAL M 49 -4.271 3.664 32.220 1.00 0.00 H ATOM 486 HG11 VAL M 49 -4.291 4.478 34.530 1.00 0.00 H ATOM 487 HG12 VAL M 49 -3.942 6.130 33.965 1.00 0.00 H ATOM 488 HG13 VAL M 49 -5.488 5.353 33.544 1.00 0.00 H ATOM 489 HG21 VAL M 49 -3.526 6.511 31.457 1.00 0.00 H ATOM 490 HG22 VAL M 49 -3.612 5.114 30.356 1.00 0.00 H ATOM 491 HG23 VAL M 49 -5.092 5.726 31.135 1.00 0.00 H ATOM 492 H VAL M 49 -2.360 3.135 30.861 1.00 0.00 H ATOM 493 N MET M 50 -2.305 2.440 34.145 1.00 10.15 N ATOM 494 CA MET M 50 -2.073 1.703 35.388 1.00 10.50 C ATOM 495 C MET M 50 -0.596 1.669 35.756 1.00 10.02 C ATOM 496 O MET M 50 -0.248 1.765 36.935 1.00 9.93 O ATOM 497 CB MET M 50 -2.629 0.275 35.305 1.00 10.63 C ATOM 498 CG MET M 50 -4.141 0.197 35.085 1.00 11.97 C ATOM 499 SD MET M 50 -5.085 1.034 36.376 1.00 16.22 S ATOM 500 CE MET M 50 -4.570 0.117 37.815 1.00 15.33 C ATOM 501 HA MET M 50 -2.607 2.237 36.174 1.00 0.00 H ATOM 502 HB2 MET M 50 -2.137 -0.235 34.477 1.00 0.00 H ATOM 503 HB3 MET M 50 -2.393 -0.238 36.237 1.00 0.00 H ATOM 504 HG2 MET M 50 -4.436 -0.852 35.064 1.00 0.00 H ATOM 505 HG3 MET M 50 -4.377 0.659 34.126 1.00 0.00 H ATOM 506 HE1 MET M 50 -4.836 -0.933 37.690 1.00 0.00 H ATOM 507 HE2 MET M 50 -3.490 0.208 37.935 1.00 0.00 H ATOM 508 HE3 MET M 50 -5.070 0.517 38.697 1.00 0.00 H ATOM 509 H MET M 50 -2.712 1.935 33.332 1.00 0.00 H ATOM 510 N HIS M 51 0.264 1.538 34.747 1.00 9.86 N ATOM 511 CA HIS M 51 1.703 1.613 34.964 1.00 9.93 C ATOM 512 C HIS M 51 2.061 2.921 35.646 1.00 9.70 C ATOM 513 O HIS M 51 2.737 2.914 36.674 1.00 9.93 O ATOM 514 CB HIS M 51 2.493 1.472 33.658 1.00 10.08 C ATOM 515 CG HIS M 51 3.923 1.909 33.772 1.00 10.32 C ATOM 516 ND1 HIS M 51 4.929 1.065 34.195 1.00 10.53 N ATOM 517 CD2 HIS M 51 4.512 3.107 33.538 1.00 9.56 C ATOM 518 CE1 HIS M 51 6.077 1.718 34.199 1.00 9.50 C ATOM 519 NE2 HIS M 51 5.852 2.959 33.804 1.00 9.66 N ATOM 520 HA HIS M 51 1.978 0.777 35.606 1.00 0.00 H ATOM 521 HB2 HIS M 51 2.475 0.425 33.355 1.00 0.00 H ATOM 522 HB3 HIS M 51 2.007 2.078 32.894 1.00 0.00 H ATOM 523 HD2 HIS M 51 4.016 4.017 33.202 1.00 0.00 H ATOM 524 HE1 HIS M 51 7.045 1.304 34.480 1.00 0.00 H ATOM 525 H HIS M 51 -0.099 1.379 33.785 1.00 0.00 H ATOM 526 N TYR M 52 1.601 4.035 35.079 1.00 9.60 N ATOM 527 CA TYR M 52 1.947 5.365 35.608 1.00 9.47 C ATOM 528 C TYR M 52 1.270 5.699 36.936 1.00 9.14 C ATOM 529 O TYR M 52 1.817 6.454 37.729 1.00 9.28 O ATOM 530 CB TYR M 52 1.736 6.468 34.560 1.00 9.12 C ATOM 531 CG TYR M 52 2.822 6.471 33.506 1.00 10.03 C ATOM 532 CD1 TYR M 52 4.112 6.879 33.821 1.00 9.71 C ATOM 533 CD2 TYR M 52 2.564 6.050 32.197 1.00 9.41 C ATOM 534 CE1 TYR M 52 5.117 6.869 32.874 1.00 10.32 C ATOM 535 CE2 TYR M 52 3.567 6.044 31.242 1.00 9.16 C ATOM 536 CZ TYR M 52 4.842 6.453 31.590 1.00 9.71 C ATOM 537 OH TYR M 52 5.857 6.450 30.663 1.00 10.56 O ATOM 538 HA TYR M 52 3.013 5.321 35.833 1.00 0.00 H ATOM 539 HB3 TYR M 52 1.732 7.435 35.063 1.00 0.00 H ATOM 540 HB2 TYR M 52 0.774 6.310 34.073 1.00 0.00 H ATOM 541 HD2 TYR M 52 1.561 5.722 31.925 1.00 0.00 H ATOM 542 HE2 TYR M 52 3.353 5.719 30.224 1.00 0.00 H ATOM 543 HE1 TYR M 52 6.124 7.189 33.142 1.00 0.00 H ATOM 544 HD1 TYR M 52 4.335 7.213 34.834 1.00 0.00 H ATOM 545 HH TYR M 52 5.617 7.047 29.911 1.00 0.00 H ATOM 546 H TYR M 52 0.984 3.964 34.245 1.00 0.00 H ATOM 547 N LEU M 53 0.095 5.128 37.183 1.00 8.80 N ATOM 548 CA LEU M 53 -0.545 5.257 38.499 1.00 8.70 C ATOM 549 C LEU M 53 0.265 4.581 39.613 1.00 8.52 C ATOM 550 O LEU M 53 0.478 5.168 40.676 1.00 8.11 O ATOM 551 CB LEU M 53 -1.989 4.733 38.470 1.00 8.76 C ATOM 552 CG LEU M 53 -3.044 5.674 37.874 1.00 8.96 C ATOM 553 CD1 LEU M 53 -4.406 4.971 37.749 1.00 9.30 C ATOM 554 CD2 LEU M 53 -3.163 6.959 38.703 1.00 8.95 C ATOM 555 HA LEU M 53 -0.574 6.322 38.730 1.00 0.00 H ATOM 556 HB2 LEU M 53 -1.997 3.813 37.885 1.00 0.00 H ATOM 557 HB3 LEU M 53 -2.283 4.512 39.496 1.00 0.00 H ATOM 558 HG LEU M 53 -2.718 5.949 36.871 1.00 0.00 H ATOM 559 HD21 LEU M 53 -3.454 6.706 39.723 1.00 0.00 H ATOM 560 HD22 LEU M 53 -2.202 7.472 38.715 1.00 0.00 H ATOM 561 HD23 LEU M 53 -3.918 7.608 38.259 1.00 0.00 H ATOM 562 HD11 LEU M 53 -4.306 4.102 37.099 1.00 0.00 H ATOM 563 HD12 LEU M 53 -4.741 4.652 38.736 1.00 0.00 H ATOM 564 HD13 LEU M 53 -5.133 5.663 37.324 1.00 0.00 H ATOM 565 H LEU M 53 -0.378 4.582 36.434 1.00 0.00 H ATOM 566 N GLY M 54 0.721 3.354 39.355 1.00 8.58 N ATOM 567 CA GLY M 54 1.640 2.653 40.259 1.00 8.65 C ATOM 568 C GLY M 54 2.936 3.422 40.471 1.00 8.64 C ATOM 569 O GLY M 54 3.419 3.551 41.609 1.00 8.25 O ATOM 570 HA3 GLY M 54 1.876 1.678 39.833 1.00 0.00 H ATOM 571 HA2 GLY M 54 1.150 2.518 41.223 1.00 0.00 H ATOM 572 H GLY M 54 0.414 2.878 38.483 1.00 0.00 H ATOM 573 N GLN M 55 3.494 3.941 39.379 1.00 8.67 N ATOM 574 CA GLN M 55 4.694 4.777 39.452 1.00 9.59 C ATOM 575 C GLN M 55 4.497 5.934 40.425 1.00 9.54 C ATOM 576 O GLN M 55 5.366 6.203 41.255 1.00 9.79 O ATOM 577 CB GLN M 55 5.061 5.339 38.079 1.00 9.71 C ATOM 578 CG GLN M 55 5.741 4.340 37.153 1.00 12.70 C ATOM 579 CD GLN M 55 7.071 3.845 37.698 1.00 14.48 C ATOM 580 OE1 GLN M 55 7.223 2.665 37.980 1.00 15.59 O ATOM 581 NE2 GLN M 55 8.034 4.756 37.862 1.00 16.17 N ATOM 582 HA GLN M 55 5.505 4.141 39.807 1.00 0.00 H ATOM 583 HB2 GLN M 55 4.147 5.685 37.596 1.00 0.00 H ATOM 584 HB3 GLN M 55 5.735 6.183 38.225 1.00 0.00 H ATOM 585 HG2 GLN M 55 5.080 3.484 37.017 1.00 0.00 H ATOM 586 HG3 GLN M 55 5.915 4.820 36.190 1.00 0.00 H ATOM 587 HE22 GLN M 55 7.859 5.749 37.608 1.00 0.00 H ATOM 588 HE21 GLN M 55 8.959 4.472 38.244 1.00 0.00 H ATOM 589 H GLN M 55 3.067 3.748 38.451 1.00 0.00 H ATOM 590 N TYR M 56 3.342 6.597 40.309 1.00 9.24 N ATOM 591 CA TYR M 56 2.994 7.787 41.090 1.00 8.96 C ATOM 592 C TYR M 56 2.888 7.491 42.588 1.00 8.83 C ATOM 593 O TYR M 56 3.455 8.212 43.419 1.00 8.42 O ATOM 594 CB TYR M 56 1.677 8.369 40.557 1.00 8.52 C ATOM 595 CG TYR M 56 1.164 9.583 41.296 1.00 8.67 C ATOM 596 CD1 TYR M 56 1.523 10.879 40.885 1.00 8.73 C ATOM 597 CD2 TYR M 56 0.304 9.450 42.388 1.00 6.98 C ATOM 598 CE1 TYR M 56 1.043 12.000 41.549 1.00 7.39 C ATOM 599 CE2 TYR M 56 -0.184 10.569 43.056 1.00 7.32 C ATOM 600 CZ TYR M 56 0.199 11.837 42.631 1.00 7.99 C ATOM 601 OH TYR M 56 -0.268 12.952 43.279 1.00 9.75 O ATOM 602 HA TYR M 56 3.796 8.516 40.975 1.00 0.00 H ATOM 603 HB3 TYR M 56 0.916 7.591 40.617 1.00 0.00 H ATOM 604 HB2 TYR M 56 1.829 8.648 39.514 1.00 0.00 H ATOM 605 HD2 TYR M 56 0.011 8.455 42.722 1.00 0.00 H ATOM 606 HE2 TYR M 56 -0.859 10.453 43.904 1.00 0.00 H ATOM 607 HE1 TYR M 56 1.329 12.999 41.220 1.00 0.00 H ATOM 608 HD1 TYR M 56 2.189 11.006 40.031 1.00 0.00 H ATOM 609 HH TYR M 56 0.014 12.923 44.228 1.00 0.00 H ATOM 610 H TYR M 56 2.646 6.246 39.621 1.00 0.00 H ATOM 611 N ILE M 57 2.147 6.438 42.921 1.00 8.91 N ATOM 612 CA ILE M 57 1.958 6.016 44.310 1.00 9.44 C ATOM 613 C ILE M 57 3.313 5.665 44.926 1.00 10.41 C ATOM 614 O ILE M 57 3.598 6.007 46.077 1.00 9.99 O ATOM 615 CB ILE M 57 0.978 4.816 44.405 1.00 8.94 C ATOM 616 CG1 ILE M 57 -0.441 5.277 44.024 1.00 9.11 C ATOM 617 CG2 ILE M 57 1.002 4.189 45.812 1.00 8.11 C ATOM 618 CD1 ILE M 57 -1.362 4.175 43.554 1.00 8.07 C ATOM 619 HA ILE M 57 1.515 6.840 44.869 1.00 0.00 H ATOM 620 HB ILE M 57 1.296 4.044 43.704 1.00 0.00 H ATOM 621 HG12 ILE M 57 -0.892 5.746 44.899 1.00 0.00 H ATOM 622 HG13 ILE M 57 -0.355 6.012 43.224 1.00 0.00 H ATOM 623 HD11 ILE M 57 -0.937 3.701 42.669 1.00 0.00 H ATOM 624 HD12 ILE M 57 -1.474 3.434 44.346 1.00 0.00 H ATOM 625 HD13 ILE M 57 -2.337 4.597 43.309 1.00 0.00 H ATOM 626 HG21 ILE M 57 2.009 3.835 46.034 1.00 0.00 H ATOM 627 HG22 ILE M 57 0.708 4.938 46.547 1.00 0.00 H ATOM 628 HG23 ILE M 57 0.306 3.351 45.847 1.00 0.00 H ATOM 629 H ILE M 57 1.684 5.893 42.166 1.00 0.00 H ATOM 630 N MET M 58 4.140 5.004 44.122 1.00 11.53 N ATOM 631 CA MET M 58 5.457 4.555 44.532 1.00 13.65 C ATOM 632 C MET M 58 6.384 5.734 44.777 1.00 13.69 C ATOM 633 O MET M 58 7.012 5.818 45.837 1.00 13.48 O ATOM 634 CB MET M 58 6.044 3.644 43.461 1.00 13.26 C ATOM 635 CG MET M 58 6.917 2.560 44.001 1.00 14.96 C ATOM 636 SD MET M 58 7.291 1.296 42.781 1.00 16.57 S ATOM 637 CE MET M 58 8.408 2.146 41.690 1.00 16.30 C ATOM 638 HA MET M 58 5.358 4.002 45.466 1.00 0.00 H ATOM 639 HB2 MET M 58 5.222 3.182 42.914 1.00 0.00 H ATOM 640 HB3 MET M 58 6.636 4.254 42.778 1.00 0.00 H ATOM 641 HG2 MET M 58 6.410 2.091 44.844 1.00 0.00 H ATOM 642 HG3 MET M 58 7.853 3.003 44.342 1.00 0.00 H ATOM 643 HE1 MET M 58 7.907 3.015 41.263 1.00 0.00 H ATOM 644 HE2 MET M 58 9.285 2.470 42.250 1.00 0.00 H ATOM 645 HE3 MET M 58 8.715 1.473 40.890 1.00 0.00 H ATOM 646 H MET M 58 3.827 4.799 43.152 1.00 0.00 H ATOM 647 N MET M 59 6.451 6.658 43.816 1.00 14.18 N ATOM 648 CA MET M 59 7.395 7.768 43.936 1.00 15.16 C ATOM 649 C MET M 59 6.984 8.819 44.965 1.00 14.72 C ATOM 650 O MET M 59 7.844 9.437 45.587 1.00 14.97 O ATOM 651 CB MET M 59 7.827 8.356 42.573 1.00 14.97 C ATOM 652 CG MET M 59 6.749 8.865 41.631 1.00 16.82 C ATOM 653 SD MET M 59 7.282 8.750 39.885 1.00 17.50 S ATOM 654 CE MET M 59 8.484 10.078 39.770 1.00 17.89 C ATOM 655 HA MET M 59 8.302 7.327 44.350 1.00 0.00 H ATOM 656 HB2 MET M 59 8.496 9.192 42.780 1.00 0.00 H ATOM 657 HB3 MET M 59 8.375 7.576 42.044 1.00 0.00 H ATOM 658 HG2 MET M 59 6.533 9.907 41.868 1.00 0.00 H ATOM 659 HG3 MET M 59 5.847 8.268 41.767 1.00 0.00 H ATOM 660 HE1 MET M 59 8.000 11.026 40.007 1.00 0.00 H ATOM 661 HE2 MET M 59 9.294 9.895 40.476 1.00 0.00 H ATOM 662 HE3 MET M 59 8.885 10.117 38.757 1.00 0.00 H ATOM 663 H MET M 59 5.832 6.588 42.983 1.00 0.00 H ATOM 664 N LYS M 60 5.679 8.983 45.173 1.00 14.71 N ATOM 665 CA LYS M 60 5.169 9.839 46.243 1.00 15.01 C ATOM 666 C LYS M 60 4.972 9.075 47.561 1.00 14.37 C ATOM 667 O LYS M 60 4.547 9.651 48.560 1.00 14.23 O ATOM 668 CB LYS M 60 3.901 10.602 45.811 1.00 14.69 C ATOM 669 CG LYS M 60 4.220 11.733 44.828 1.00 16.04 C ATOM 670 CD LYS M 60 3.085 12.733 44.620 1.00 16.51 C ATOM 671 CE LYS M 60 3.105 13.861 45.661 1.00 19.16 C ATOM 672 NZ LYS M 60 1.935 14.803 45.513 1.00 18.46 N ATOM 673 HA LYS M 60 5.936 10.588 46.439 1.00 0.00 H ATOM 674 HB2 LYS M 60 3.215 9.903 45.333 1.00 0.00 H ATOM 675 HB3 LYS M 60 3.427 11.027 46.696 1.00 0.00 H ATOM 676 HG2 LYS M 60 5.087 12.276 45.204 1.00 0.00 H ATOM 677 HG3 LYS M 60 4.462 11.287 43.863 1.00 0.00 H ATOM 678 HD2 LYS M 60 3.181 13.171 43.626 1.00 0.00 H ATOM 679 HD3 LYS M 60 2.134 12.205 44.693 1.00 0.00 H ATOM 680 HE2 LYS M 60 4.028 14.429 45.545 1.00 0.00 H ATOM 681 HE3 LYS M 60 3.075 13.419 46.657 1.00 0.00 H ATOM 682 HZ1 LYS M 60 1.958 15.237 44.568 1.00 0.00 H ATOM 683 HZ2 LYS M 60 1.048 14.273 45.630 1.00 0.00 H ATOM 684 HZ3 LYS M 60 1.995 15.546 46.239 1.00 0.00 H ATOM 685 H LYS M 60 5.003 8.488 44.557 1.00 0.00 H ATOM 686 N GLN M 61 5.312 7.783 47.542 1.00 14.00 N ATOM 687 CA GLN M 61 5.291 6.909 48.727 1.00 13.71 C ATOM 688 C GLN M 61 3.943 6.954 49.454 1.00 13.45 C ATOM 689 O GLN M 61 3.873 7.159 50.664 1.00 13.47 O ATOM 690 CB GLN M 61 6.476 7.218 49.666 1.00 13.59 C ATOM 691 CG GLN M 61 7.844 6.886 49.053 1.00 13.44 C ATOM 692 CD GLN M 61 9.014 7.575 49.751 1.00 13.26 C ATOM 693 OE1 GLN M 61 9.029 7.719 50.972 1.00 11.03 O ATOM 694 NE2 GLN M 61 10.009 7.993 48.966 1.00 12.43 N ATOM 695 HA GLN M 61 5.413 5.883 48.380 1.00 0.00 H ATOM 696 HB2 GLN M 61 6.455 8.280 49.910 1.00 0.00 H ATOM 697 HB3 GLN M 61 6.355 6.634 50.578 1.00 0.00 H ATOM 698 HG2 GLN M 61 7.995 5.808 49.111 1.00 0.00 H ATOM 699 HG3 GLN M 61 7.837 7.195 48.008 1.00 0.00 H ATOM 700 HE22 GLN M 61 9.955 7.850 47.937 1.00 0.00 H ATOM 701 HE21 GLN M 61 10.839 8.461 49.383 1.00 0.00 H ATOM 702 H GLN M 61 5.610 7.370 46.635 1.00 0.00 H ATOM 703 N LEU M 62 2.869 6.758 48.702 1.00 13.21 N ATOM 704 CA LEU M 62 1.531 6.908 49.265 1.00 13.31 C ATOM 705 C LEU M 62 1.067 5.657 50.003 1.00 13.37 C ATOM 706 O LEU M 62 0.207 5.731 50.887 1.00 13.31 O ATOM 707 CB LEU M 62 0.518 7.337 48.195 1.00 13.05 C ATOM 708 CG LEU M 62 0.708 8.711 47.531 1.00 12.88 C ATOM 709 CD1 LEU M 62 -0.479 9.030 46.618 1.00 11.43 C ATOM 710 CD2 LEU M 62 0.903 9.842 48.553 1.00 12.54 C ATOM 711 HA LEU M 62 1.590 7.705 50.006 1.00 0.00 H ATOM 712 HB2 LEU M 62 0.545 6.588 47.404 1.00 0.00 H ATOM 713 HB3 LEU M 62 -0.467 7.336 48.662 1.00 0.00 H ATOM 714 HG LEU M 62 1.621 8.651 46.939 1.00 0.00 H ATOM 715 HD21 LEU M 62 0.027 9.901 49.199 1.00 0.00 H ATOM 716 HD22 LEU M 62 1.788 9.637 49.156 1.00 0.00 H ATOM 717 HD23 LEU M 62 1.032 10.788 48.026 1.00 0.00 H ATOM 718 HD11 LEU M 62 -0.555 8.267 45.843 1.00 0.00 H ATOM 719 HD12 LEU M 62 -1.396 9.043 47.207 1.00 0.00 H ATOM 720 HD13 LEU M 62 -0.328 10.006 46.156 1.00 0.00 H ATOM 721 H LEU M 62 2.981 6.495 47.702 1.00 0.00 H ATOM 722 N TYR M 63 1.652 4.515 49.650 1.00 13.48 N ATOM 723 CA TYR M 63 1.312 3.249 50.294 1.00 13.89 C ATOM 724 C TYR M 63 1.701 3.269 51.772 1.00 14.33 C ATOM 725 O TYR M 63 2.655 3.943 52.166 1.00 14.17 O ATOM 726 CB TYR M 63 1.977 2.075 49.577 1.00 13.62 C ATOM 727 CG TYR M 63 3.481 2.220 49.440 1.00 13.57 C ATOM 728 CD1 TYR M 63 4.340 1.753 50.435 1.00 13.07 C ATOM 729 CD2 TYR M 63 4.039 2.833 48.319 1.00 12.66 C ATOM 730 CE1 TYR M 63 5.718 1.889 50.312 1.00 13.72 C ATOM 731 CE2 TYR M 63 5.407 2.974 48.186 1.00 13.15 C ATOM 732 CZ TYR M 63 6.241 2.492 49.184 1.00 13.26 C ATOM 733 OH TYR M 63 7.594 2.639 49.059 1.00 13.82 O ATOM 734 HA TYR M 63 0.232 3.118 50.228 1.00 0.00 H ATOM 735 HB3 TYR M 63 1.546 1.992 48.579 1.00 0.00 H ATOM 736 HB2 TYR M 63 1.768 1.165 50.139 1.00 0.00 H ATOM 737 HD2 TYR M 63 3.384 3.208 47.533 1.00 0.00 H ATOM 738 HE2 TYR M 63 5.827 3.459 47.305 1.00 0.00 H ATOM 739 HE1 TYR M 63 6.379 1.524 51.098 1.00 0.00 H ATOM 740 HD1 TYR M 63 3.925 1.274 51.322 1.00 0.00 H ATOM 741 HH TYR M 63 8.042 2.245 49.849 1.00 0.00 H ATOM 742 H TYR M 63 2.369 4.524 48.897 1.00 0.00 H ATOM 743 N ASP M 64 0.929 2.552 52.578 1.00 15.14 N ATOM 744 CA ASP M 64 1.226 2.334 53.990 1.00 16.07 C ATOM 745 C ASP M 64 2.551 1.569 54.110 1.00 16.67 C ATOM 746 O ASP M 64 2.750 0.578 53.417 1.00 16.25 O ATOM 747 CB ASP M 64 0.075 1.537 54.602 1.00 16.33 C ATOM 748 CG ASP M 64 0.080 1.554 56.111 1.00 17.40 C ATOM 749 OD1 ASP M 64 -0.653 2.381 56.685 1.00 19.87 O ATOM 750 OD2 ASP M 64 0.802 0.740 56.721 1.00 18.82 O ATOM 751 HA ASP M 64 1.328 3.280 54.521 1.00 0.00 H ATOM 752 HB2 ASP M 64 -0.866 1.962 54.253 1.00 0.00 H ATOM 753 HB3 ASP M 64 0.152 0.503 54.266 1.00 0.00 H ATOM 754 H ASP M 64 0.068 2.123 52.183 1.00 0.00 H ATOM 755 N LYS M 65 3.456 2.048 54.967 1.00 17.67 N ATOM 756 CA LYS M 65 4.782 1.434 55.151 1.00 18.97 C ATOM 757 C LYS M 65 4.695 -0.014 55.624 1.00 18.96 C ATOM 758 O LYS M 65 5.449 -0.877 55.167 1.00 19.39 O ATOM 759 CB LYS M 65 5.613 2.215 56.176 1.00 19.17 C ATOM 760 CG LYS M 65 6.085 3.600 55.761 1.00 20.13 C ATOM 761 CD LYS M 65 6.880 4.234 56.917 1.00 20.72 C ATOM 762 CE LYS M 65 7.364 5.656 56.593 1.00 24.72 C ATOM 763 NZ LYS M 65 8.334 5.717 55.442 1.00 25.91 N ATOM 764 HA LYS M 65 5.259 1.460 54.171 1.00 0.00 H ATOM 765 HB2 LYS M 65 5.007 2.328 57.075 1.00 0.00 H ATOM 766 HB3 LYS M 65 6.497 1.620 56.407 1.00 0.00 H ATOM 767 HG2 LYS M 65 6.723 3.519 54.881 1.00 0.00 H ATOM 768 HG3 LYS M 65 5.223 4.224 55.527 1.00 0.00 H ATOM 769 HD2 LYS M 65 6.241 4.275 57.799 1.00 0.00 H ATOM 770 HD3 LYS M 65 7.748 3.609 57.128 1.00 0.00 H ATOM 771 HE2 LYS M 65 7.853 6.064 57.478 1.00 0.00 H ATOM 772 HE3 LYS M 65 6.496 6.267 56.345 1.00 0.00 H ATOM 773 HZ1 LYS M 65 9.174 5.147 55.668 1.00 0.00 H ATOM 774 HZ2 LYS M 65 7.878 5.341 54.586 1.00 0.00 H ATOM 775 HZ3 LYS M 65 8.617 6.705 55.281 1.00 0.00 H ATOM 776 H LYS M 65 3.214 2.890 55.528 1.00 0.00 H ATOM 777 N GLN M 66 3.771 -0.264 56.543 1.00 19.12 N ATOM 778 CA GLN M 66 3.610 -1.572 57.168 1.00 19.29 C ATOM 779 C GLN M 66 2.699 -2.521 56.400 1.00 18.60 C ATOM 780 O GLN M 66 2.952 -3.716 56.364 1.00 19.29 O ATOM 781 CB GLN M 66 3.089 -1.406 58.602 1.00 19.56 C ATOM 782 CG GLN M 66 4.178 -1.331 59.645 1.00 21.94 C ATOM 783 CD GLN M 66 5.199 -0.260 59.347 1.00 25.36 C ATOM 784 OE1 GLN M 66 4.874 0.929 59.293 1.00 27.94 O ATOM 785 NE2 GLN M 66 6.446 -0.673 59.148 1.00 26.22 N ATOM 786 HA GLN M 66 4.600 -2.029 57.166 1.00 0.00 H ATOM 787 HB2 GLN M 66 2.504 -0.488 58.650 1.00 0.00 H ATOM 788 HB3 GLN M 66 2.448 -2.257 58.835 1.00 0.00 H ATOM 789 HG2 GLN M 66 3.721 -1.118 60.611 1.00 0.00 H ATOM 790 HG3 GLN M 66 4.686 -2.294 59.689 1.00 0.00 H ATOM 791 HE22 GLN M 66 6.673 -1.686 59.204 1.00 0.00 H ATOM 792 HE21 GLN M 66 7.195 0.017 58.937 1.00 0.00 H ATOM 793 H GLN M 66 3.134 0.506 56.830 1.00 0.00 H ATOM 794 N ARG M 67 1.626 -2.001 55.813 1.00 17.55 N ATOM 795 CA ARG M 67 0.653 -2.856 55.140 1.00 16.72 C ATOM 796 C ARG M 67 0.454 -2.324 53.729 1.00 15.44 C ATOM 797 O ARG M 67 -0.459 -1.545 53.464 1.00 15.61 O ATOM 798 CB ARG M 67 -0.655 -2.919 55.941 1.00 16.67 C ATOM 799 CG ARG M 67 -0.420 -3.157 57.449 1.00 17.62 C ATOM 800 CD ARG M 67 -1.704 -3.373 58.233 1.00 17.62 C ATOM 801 NE ARG M 67 -2.426 -4.550 57.760 1.00 19.14 N ATOM 802 CZ ARG M 67 -3.671 -4.535 57.289 1.00 19.62 C ATOM 803 NH1 ARG M 67 -4.367 -3.405 57.251 1.00 19.50 N ATOM 804 NH2 ARG M 67 -4.225 -5.666 56.872 1.00 20.37 N ATOM 805 HA ARG M 67 1.016 -3.882 55.077 1.00 0.00 H ATOM 806 HB2 ARG M 67 -1.187 -1.976 55.815 1.00 0.00 H ATOM 807 HB3 ARG M 67 -1.265 -3.734 55.550 1.00 0.00 H ATOM 808 HG2 ARG M 67 0.209 -4.039 57.566 1.00 0.00 H ATOM 809 HG3 ARG M 67 0.094 -2.288 57.860 1.00 0.00 H ATOM 810 HD2 ARG M 67 -2.341 -2.496 58.119 1.00 0.00 H ATOM 811 HD3 ARG M 67 -1.458 -3.507 59.286 1.00 0.00 H ATOM 812 HE ARG M 67 -1.933 -5.465 57.793 1.00 0.00 H ATOM 813 HH12 ARG M 67 -5.339 -3.405 56.881 1.00 0.00 H ATOM 814 HH11 ARG M 67 -3.940 -2.520 57.591 1.00 0.00 H ATOM 815 HH22 ARG M 67 -5.197 -5.664 56.503 1.00 0.00 H ATOM 816 HH21 ARG M 67 -3.687 -6.555 56.915 1.00 0.00 H ATOM 817 H ARG M 67 1.478 -0.972 55.833 1.00 0.00 H ATOM 818 N GLN M 68 1.324 -2.773 52.832 1.00 14.04 N ATOM 819 CA GLN M 68 1.615 -2.062 51.590 1.00 12.81 C ATOM 820 C GLN M 68 0.576 -2.180 50.467 1.00 12.31 C ATOM 821 O GLN M 68 0.731 -1.570 49.401 1.00 11.66 O ATOM 822 CB GLN M 68 3.038 -2.389 51.114 1.00 12.90 C ATOM 823 CG GLN M 68 4.114 -1.894 52.091 1.00 11.88 C ATOM 824 CD GLN M 68 5.491 -1.695 51.462 1.00 11.75 C ATOM 825 OE1 GLN M 68 5.676 -1.857 50.261 1.00 9.96 O ATOM 826 NE2 GLN M 68 6.464 -1.328 52.291 1.00 12.38 N ATOM 827 HA GLN M 68 1.547 -1.006 51.850 1.00 0.00 H ATOM 828 HB2 GLN M 68 3.132 -3.470 51.009 1.00 0.00 H ATOM 829 HB3 GLN M 68 3.200 -1.915 50.146 1.00 0.00 H ATOM 830 HG2 GLN M 68 3.787 -0.940 52.505 1.00 0.00 H ATOM 831 HG3 GLN M 68 4.208 -2.625 52.894 1.00 0.00 H ATOM 832 HE22 GLN M 68 6.264 -1.202 53.304 1.00 0.00 H ATOM 833 HE21 GLN M 68 7.425 -1.167 51.927 1.00 0.00 H ATOM 834 H GLN M 68 1.819 -3.668 53.022 1.00 0.00 H ATOM 835 N HIS M 69 -0.476 -2.963 50.719 1.00 11.58 N ATOM 836 CA HIS M 69 -1.646 -3.007 49.843 1.00 11.13 C ATOM 837 C HIS M 69 -2.578 -1.807 50.104 1.00 10.67 C ATOM 838 O HIS M 69 -3.460 -1.524 49.306 1.00 10.64 O ATOM 839 CB HIS M 69 -2.402 -4.347 49.989 1.00 10.91 C ATOM 840 CG HIS M 69 -3.059 -4.524 51.321 1.00 11.15 C ATOM 841 ND1 HIS M 69 -2.375 -4.956 52.439 1.00 10.31 N ATOM 842 CD2 HIS M 69 -4.335 -4.300 51.721 1.00 10.05 C ATOM 843 CE1 HIS M 69 -3.201 -4.985 53.470 1.00 11.13 C ATOM 844 NE2 HIS M 69 -4.395 -4.591 53.061 1.00 9.93 N ATOM 845 HA HIS M 69 -1.296 -2.937 48.813 1.00 0.00 H ATOM 846 HB2 HIS M 69 -3.170 -4.395 49.217 1.00 0.00 H ATOM 847 HB3 HIS M 69 -1.692 -5.161 49.844 1.00 0.00 H ATOM 848 HD2 HIS M 69 -5.158 -3.954 51.096 1.00 0.00 H ATOM 849 HE1 HIS M 69 -2.942 -5.283 54.486 1.00 0.00 H ATOM 850 H HIS M 69 -0.463 -3.563 51.568 1.00 0.00 H ATOM 851 N ILE M 70 -2.371 -1.108 51.222 1.00 10.35 N ATOM 852 CA ILE M 70 -3.173 0.062 51.576 1.00 10.11 C ATOM 853 C ILE M 70 -2.489 1.329 51.068 1.00 10.65 C ATOM 854 O ILE M 70 -1.313 1.550 51.343 1.00 10.49 O ATOM 855 CB ILE M 70 -3.417 0.155 53.118 1.00 10.19 C ATOM 856 CG1 ILE M 70 -4.088 -1.126 53.654 1.00 9.60 C ATOM 857 CG2 ILE M 70 -4.264 1.387 53.475 1.00 9.32 C ATOM 858 CD1 ILE M 70 -5.557 -1.295 53.215 1.00 6.68 C ATOM 859 HA ILE M 70 -4.148 -0.041 51.099 1.00 0.00 H ATOM 860 HB ILE M 70 -2.442 0.259 53.595 1.00 0.00 H ATOM 861 HG12 ILE M 70 -3.522 -1.986 53.296 1.00 0.00 H ATOM 862 HG13 ILE M 70 -4.056 -1.100 54.743 1.00 0.00 H ATOM 863 HD11 ILE M 70 -6.142 -0.449 53.576 1.00 0.00 H ATOM 864 HD12 ILE M 70 -5.607 -1.336 52.127 1.00 0.00 H ATOM 865 HD13 ILE M 70 -5.956 -2.219 53.633 1.00 0.00 H ATOM 866 HG21 ILE M 70 -3.746 2.289 53.150 1.00 0.00 H ATOM 867 HG22 ILE M 70 -5.229 1.320 52.974 1.00 0.00 H ATOM 868 HG23 ILE M 70 -4.415 1.422 54.554 1.00 0.00 H ATOM 869 H ILE M 70 -1.611 -1.407 51.866 1.00 0.00 H ATOM 870 N VAL M 71 -3.228 2.148 50.319 1.00 11.17 N ATOM 871 CA VAL M 71 -2.705 3.392 49.763 1.00 11.72 C ATOM 872 C VAL M 71 -3.402 4.578 50.433 1.00 12.48 C ATOM 873 O VAL M 71 -4.631 4.652 50.436 1.00 12.43 O ATOM 874 CB VAL M 71 -2.898 3.452 48.218 1.00 11.75 C ATOM 875 CG1 VAL M 71 -2.405 4.780 47.644 1.00 11.21 C ATOM 876 CG2 VAL M 71 -2.193 2.287 47.540 1.00 10.60 C ATOM 877 HA VAL M 71 -1.634 3.436 49.960 1.00 0.00 H ATOM 878 HB VAL M 71 -3.967 3.376 48.018 1.00 0.00 H ATOM 879 HG11 VAL M 71 -2.965 5.599 48.095 1.00 0.00 H ATOM 880 HG12 VAL M 71 -1.344 4.898 47.865 1.00 0.00 H ATOM 881 HG13 VAL M 71 -2.555 4.786 46.564 1.00 0.00 H ATOM 882 HG21 VAL M 71 -1.127 2.329 47.763 1.00 0.00 H ATOM 883 HG22 VAL M 71 -2.606 1.349 47.910 1.00 0.00 H ATOM 884 HG23 VAL M 71 -2.342 2.351 46.462 1.00 0.00 H ATOM 885 H VAL M 71 -4.216 1.890 50.123 1.00 0.00 H ATOM 886 N HIS M 72 -2.617 5.487 51.014 1.00 13.18 N ATOM 887 CA HIS M 72 -3.166 6.662 51.691 1.00 14.23 C ATOM 888 C HIS M 72 -3.115 7.869 50.769 1.00 14.96 C ATOM 889 O HIS M 72 -2.073 8.491 50.598 1.00 15.29 O ATOM 890 CB HIS M 72 -2.429 6.945 53.005 1.00 14.35 C ATOM 891 CG HIS M 72 -2.556 5.853 54.021 1.00 14.67 C ATOM 892 ND1 HIS M 72 -3.765 5.486 54.574 1.00 15.57 N ATOM 893 CD2 HIS M 72 -1.623 5.058 54.597 1.00 15.56 C ATOM 894 CE1 HIS M 72 -3.575 4.504 55.436 1.00 16.38 C ATOM 895 NE2 HIS M 72 -2.282 4.227 55.471 1.00 17.47 N ATOM 896 HA HIS M 72 -4.207 6.456 51.939 1.00 0.00 H ATOM 897 HB2 HIS M 72 -1.371 7.085 52.782 1.00 0.00 H ATOM 898 HB3 HIS M 72 -2.833 7.862 53.434 1.00 0.00 H ATOM 899 HD2 HIS M 72 -0.550 5.074 54.404 1.00 0.00 H ATOM 900 HE1 HIS M 72 -4.351 4.007 56.019 1.00 0.00 H ATOM 901 H HIS M 72 -1.586 5.357 50.985 1.00 0.00 H ATOM 902 N CYS M 73 -4.249 8.190 50.163 1.00 15.96 N ATOM 903 CA CYS M 73 -4.281 9.195 49.108 1.00 17.31 C ATOM 904 C CYS M 73 -4.949 10.497 49.551 1.00 17.51 C ATOM 905 O CYS M 73 -5.108 11.417 48.754 1.00 17.69 O ATOM 906 CB CYS M 73 -4.952 8.628 47.849 1.00 17.10 C ATOM 907 SG CYS M 73 -6.532 7.837 48.152 1.00 20.13 S ATOM 908 HA CYS M 73 -3.247 9.447 48.873 1.00 0.00 H ATOM 909 HB2 CYS M 73 -4.281 7.893 47.405 1.00 0.00 H ATOM 910 HB3 CYS M 73 -5.108 9.447 47.146 1.00 0.00 H ATOM 911 HG CYS M 73 -7.406 8.754 48.700 1.00 0.00 H ATOM 912 H CYS M 73 -5.131 7.717 50.445 1.00 0.00 H ATOM 913 N HIS M 74 -5.325 10.572 50.826 1.00 18.05 N ATOM 914 CA HIS M 74 -5.875 11.794 51.390 1.00 18.89 C ATOM 915 C HIS M 74 -4.818 12.894 51.303 1.00 19.45 C ATOM 916 O HIS M 74 -3.619 12.607 51.340 1.00 19.78 O ATOM 917 CB HIS M 74 -6.337 11.565 52.830 1.00 19.03 C ATOM 918 CG HIS M 74 -5.223 11.279 53.787 1.00 19.58 C ATOM 919 ND1 HIS M 74 -4.698 12.240 54.624 1.00 20.31 N ATOM 920 CD2 HIS M 74 -4.527 10.145 54.034 1.00 19.45 C ATOM 921 CE1 HIS M 74 -3.728 11.709 55.347 1.00 20.39 C ATOM 922 NE2 HIS M 74 -3.605 10.438 55.009 1.00 20.31 N ATOM 923 HA HIS M 74 -6.753 12.103 50.822 1.00 0.00 H ATOM 924 HB2 HIS M 74 -6.860 12.459 53.169 1.00 0.00 H ATOM 925 HB3 HIS M 74 -7.024 10.719 52.840 1.00 0.00 H ATOM 926 HD2 HIS M 74 -4.671 9.179 53.550 1.00 0.00 H ATOM 927 HE1 HIS M 74 -3.131 12.231 56.095 1.00 0.00 H ATOM 928 H HIS M 74 -5.223 9.735 51.434 1.00 0.00 H ATOM 929 N ASP M 75 -5.261 14.140 51.134 1.00 19.63 N ATOM 930 CA ASP M 75 -4.347 15.292 50.999 1.00 19.84 C ATOM 931 C ASP M 75 -3.304 15.124 49.878 1.00 19.25 C ATOM 932 O ASP M 75 -2.172 15.617 49.966 1.00 19.80 O ATOM 933 CB ASP M 75 -3.688 15.629 52.347 1.00 20.52 C ATOM 934 CG ASP M 75 -4.707 15.772 53.471 1.00 22.18 C ATOM 935 OD1 ASP M 75 -5.531 16.717 53.426 1.00 25.16 O ATOM 936 OD2 ASP M 75 -4.696 14.928 54.392 1.00 23.28 O ATOM 937 HA ASP M 75 -4.962 16.139 50.695 1.00 0.00 H ATOM 938 HB2 ASP M 75 -2.991 14.832 52.605 1.00 0.00 H ATOM 939 HB3 ASP M 75 -3.143 16.568 52.246 1.00 0.00 H ATOM 940 H ASP M 75 -6.287 14.307 51.096 1.00 0.00 H ATOM 941 N ASP M 76 -3.704 14.417 48.829 1.00 18.10 N ATOM 942 CA ASP M 76 -2.931 14.316 47.603 1.00 16.75 C ATOM 943 C ASP M 76 -3.910 14.473 46.453 1.00 15.74 C ATOM 944 O ASP M 76 -5.056 14.041 46.571 1.00 15.86 O ATOM 945 CB ASP M 76 -2.245 12.946 47.517 1.00 16.69 C ATOM 946 CG ASP M 76 -1.286 12.843 46.341 1.00 16.31 C ATOM 947 OD1 ASP M 76 -0.121 13.267 46.478 1.00 15.60 O ATOM 948 OD2 ASP M 76 -1.698 12.339 45.275 1.00 16.23 O ATOM 949 HA ASP M 76 -2.155 15.081 47.571 1.00 0.00 H ATOM 950 HB2 ASP M 76 -1.687 12.776 48.438 1.00 0.00 H ATOM 951 HB3 ASP M 76 -3.011 12.178 47.411 1.00 0.00 H ATOM 952 H ASP M 76 -4.612 13.912 48.887 1.00 0.00 H ATOM 953 N PRO M 77 -3.476 15.098 45.340 1.00 14.81 N ATOM 954 CA PRO M 77 -4.310 15.187 44.139 1.00 14.31 C ATOM 955 C PRO M 77 -4.955 13.864 43.709 1.00 13.89 C ATOM 956 O PRO M 77 -6.045 13.879 43.127 1.00 13.64 O ATOM 957 CB PRO M 77 -3.324 15.667 43.079 1.00 14.02 C ATOM 958 CG PRO M 77 -2.386 16.549 43.870 1.00 14.51 C ATOM 959 CD PRO M 77 -2.182 15.781 45.143 1.00 14.84 C ATOM 960 HA PRO M 77 -5.165 15.842 44.306 1.00 0.00 H ATOM 961 HD3 PRO M 77 -1.372 15.060 45.038 1.00 0.00 H ATOM 962 HD2 PRO M 77 -1.964 16.452 45.974 1.00 0.00 H ATOM 963 HG3 PRO M 77 -2.837 17.521 44.068 1.00 0.00 H ATOM 964 HG2 PRO M 77 -1.443 16.689 43.342 1.00 0.00 H ATOM 965 HB2 PRO M 77 -2.791 14.829 42.630 1.00 0.00 H ATOM 966 HB3 PRO M 77 -3.831 16.233 42.298 1.00 0.00 H ATOM 967 N LEU M 78 -4.291 12.739 43.992 1.00 13.43 N ATOM 968 CA LEU M 78 -4.856 11.426 43.683 1.00 12.95 C ATOM 969 C LEU M 78 -6.140 11.160 44.472 1.00 12.48 C ATOM 970 O LEU M 78 -7.092 10.615 43.922 1.00 12.15 O ATOM 971 CB LEU M 78 -3.841 10.296 43.893 1.00 12.84 C ATOM 972 CG LEU M 78 -4.319 8.884 43.509 1.00 12.92 C ATOM 973 CD1 LEU M 78 -4.777 8.823 42.046 1.00 11.34 C ATOM 974 CD2 LEU M 78 -3.248 7.824 43.802 1.00 12.76 C ATOM 975 HA LEU M 78 -5.113 11.442 42.624 1.00 0.00 H ATOM 976 HB2 LEU M 78 -2.958 10.524 43.296 1.00 0.00 H ATOM 977 HB3 LEU M 78 -3.570 10.282 44.949 1.00 0.00 H ATOM 978 HG LEU M 78 -5.183 8.656 44.134 1.00 0.00 H ATOM 979 HD21 LEU M 78 -2.348 8.050 43.230 1.00 0.00 H ATOM 980 HD22 LEU M 78 -3.014 7.830 44.867 1.00 0.00 H ATOM 981 HD23 LEU M 78 -3.624 6.841 43.517 1.00 0.00 H ATOM 982 HD11 LEU M 78 -5.602 9.520 41.895 1.00 0.00 H ATOM 983 HD12 LEU M 78 -3.946 9.095 41.395 1.00 0.00 H ATOM 984 HD13 LEU M 78 -5.107 7.811 41.812 1.00 0.00 H ATOM 985 H LEU M 78 -3.355 12.799 44.441 1.00 0.00 H ATOM 986 N GLY M 79 -6.156 11.546 45.746 1.00 12.22 N ATOM 987 CA GLY M 79 -7.366 11.480 46.558 1.00 12.71 C ATOM 988 C GLY M 79 -8.528 12.297 46.004 1.00 13.20 C ATOM 989 O GLY M 79 -9.676 11.885 46.108 1.00 12.94 O ATOM 990 HA3 GLY M 79 -7.131 11.851 47.556 1.00 0.00 H ATOM 991 HA2 GLY M 79 -7.679 10.438 46.623 1.00 0.00 H ATOM 992 H GLY M 79 -5.280 11.905 46.175 1.00 0.00 H ATOM 993 N GLU M 80 -8.233 13.460 45.425 1.00 13.85 N ATOM 994 CA GLU M 80 -9.265 14.299 44.796 1.00 15.22 C ATOM 995 C GLU M 80 -10.000 13.519 43.697 1.00 14.80 C ATOM 996 O GLU M 80 -11.230 13.573 43.600 1.00 14.68 O ATOM 997 CB GLU M 80 -8.657 15.606 44.242 1.00 15.02 C ATOM 998 CG GLU M 80 -8.021 16.506 45.318 1.00 17.01 C ATOM 999 CD GLU M 80 -7.010 17.544 44.791 1.00 18.35 C ATOM 1000 OE1 GLU M 80 -6.285 18.127 45.637 1.00 22.86 O ATOM 1001 OE2 GLU M 80 -6.925 17.799 43.560 1.00 22.54 O ATOM 1002 HA GLU M 80 -9.993 14.573 45.560 1.00 0.00 H ATOM 1003 HB2 GLU M 80 -7.888 15.345 43.514 1.00 0.00 H ATOM 1004 HB3 GLU M 80 -9.448 16.170 43.747 1.00 0.00 H ATOM 1005 HG2 GLU M 80 -8.822 17.043 45.826 1.00 0.00 H ATOM 1006 HG3 GLU M 80 -7.505 15.865 46.033 1.00 0.00 H ATOM 1007 H GLU M 80 -7.245 13.784 45.417 1.00 0.00 H ATOM 1008 N LEU M 81 -9.239 12.780 42.888 1.00 14.63 N ATOM 1009 CA LEU M 81 -9.805 11.997 41.783 1.00 14.48 C ATOM 1010 C LEU M 81 -10.546 10.745 42.231 1.00 14.30 C ATOM 1011 O LEU M 81 -11.604 10.420 41.693 1.00 14.13 O ATOM 1012 CB LEU M 81 -8.722 11.627 40.770 1.00 14.36 C ATOM 1013 CG LEU M 81 -8.261 12.774 39.877 1.00 14.96 C ATOM 1014 CD1 LEU M 81 -7.270 12.243 38.879 1.00 15.69 C ATOM 1015 CD2 LEU M 81 -9.445 13.422 39.155 1.00 15.79 C ATOM 1016 HA LEU M 81 -10.546 12.645 41.314 1.00 0.00 H ATOM 1017 HB2 LEU M 81 -7.857 11.256 41.319 1.00 0.00 H ATOM 1018 HB3 LEU M 81 -9.112 10.835 40.131 1.00 0.00 H ATOM 1019 HG LEU M 81 -7.793 13.540 40.495 1.00 0.00 H ATOM 1020 HD21 LEU M 81 -9.943 12.676 38.536 1.00 0.00 H ATOM 1021 HD22 LEU M 81 -10.148 13.813 39.891 1.00 0.00 H ATOM 1022 HD23 LEU M 81 -9.084 14.236 38.526 1.00 0.00 H ATOM 1023 HD11 LEU M 81 -6.416 11.819 39.407 1.00 0.00 H ATOM 1024 HD12 LEU M 81 -7.744 11.471 38.274 1.00 0.00 H ATOM 1025 HD13 LEU M 81 -6.934 13.056 38.235 1.00 0.00 H ATOM 1026 H LEU M 81 -8.211 12.758 43.045 1.00 0.00 H ATOM 1027 N LEU M 82 -9.974 10.051 43.209 1.00 14.22 N ATOM 1028 CA LEU M 82 -10.531 8.804 43.713 1.00 14.21 C ATOM 1029 C LEU M 82 -11.745 9.038 44.587 1.00 14.41 C ATOM 1030 O LEU M 82 -12.645 8.191 44.643 1.00 14.23 O ATOM 1031 CB LEU M 82 -9.474 8.026 44.496 1.00 14.12 C ATOM 1032 CG LEU M 82 -8.299 7.438 43.708 1.00 13.85 C ATOM 1033 CD1 LEU M 82 -7.308 6.844 44.683 1.00 14.00 C ATOM 1034 CD2 LEU M 82 -8.752 6.384 42.699 1.00 13.43 C ATOM 1035 HA LEU M 82 -10.848 8.220 42.849 1.00 0.00 H ATOM 1036 HB2 LEU M 82 -9.060 8.701 45.245 1.00 0.00 H ATOM 1037 HB3 LEU M 82 -9.980 7.199 44.994 1.00 0.00 H ATOM 1038 HG LEU M 82 -7.831 8.239 43.136 1.00 0.00 H ATOM 1039 HD21 LEU M 82 -9.250 5.569 43.225 1.00 0.00 H ATOM 1040 HD22 LEU M 82 -9.445 6.836 41.989 1.00 0.00 H ATOM 1041 HD23 LEU M 82 -7.884 5.997 42.165 1.00 0.00 H ATOM 1042 HD11 LEU M 82 -6.950 7.624 45.355 1.00 0.00 H ATOM 1043 HD12 LEU M 82 -7.795 6.059 45.262 1.00 0.00 H ATOM 1044 HD13 LEU M 82 -6.467 6.422 44.133 1.00 0.00 H ATOM 1045 H LEU M 82 -9.095 10.412 43.631 1.00 0.00 H ATOM 1046 N GLU M 83 -11.753 10.188 45.271 1.00 14.42 N ATOM 1047 CA GLU M 83 -12.867 10.627 46.118 1.00 14.59 C ATOM 1048 C GLU M 83 -12.973 9.818 47.406 1.00 13.86 C ATOM 1049 O GLU M 83 -14.023 9.795 48.049 1.00 13.74 O ATOM 1050 CB GLU M 83 -14.189 10.631 45.328 1.00 14.62 C ATOM 1051 CG GLU M 83 -14.235 11.740 44.271 1.00 15.70 C ATOM 1052 CD GLU M 83 -15.341 11.555 43.237 1.00 15.90 C ATOM 1053 OE1 GLU M 83 -15.336 12.302 42.237 1.00 18.15 O ATOM 1054 OE2 GLU M 83 -16.205 10.673 43.412 1.00 16.94 O ATOM 1055 HA GLU M 83 -12.658 11.653 46.423 1.00 0.00 H ATOM 1056 HB2 GLU M 83 -14.303 9.668 44.830 1.00 0.00 H ATOM 1057 HB3 GLU M 83 -15.014 10.778 46.026 1.00 0.00 H ATOM 1058 HG2 GLU M 83 -14.392 12.692 44.777 1.00 0.00 H ATOM 1059 HG3 GLU M 83 -13.277 11.760 43.751 1.00 0.00 H ATOM 1060 H GLU M 83 -10.920 10.807 45.198 1.00 0.00 H ATOM 1061 N VAL M 84 -11.868 9.163 47.761 1.00 13.25 N ATOM 1062 CA VAL M 84 -11.710 8.422 49.010 1.00 12.95 C ATOM 1063 C VAL M 84 -10.384 8.825 49.661 1.00 13.06 C ATOM 1064 O VAL M 84 -9.468 9.293 48.979 1.00 13.28 O ATOM 1065 CB VAL M 84 -11.749 6.872 48.807 1.00 13.23 C ATOM 1066 CG1 VAL M 84 -13.142 6.402 48.406 1.00 13.35 C ATOM 1067 CG2 VAL M 84 -10.697 6.401 47.778 1.00 12.35 C ATOM 1068 HA VAL M 84 -12.553 8.676 49.653 1.00 0.00 H ATOM 1069 HB VAL M 84 -11.499 6.418 49.766 1.00 0.00 H ATOM 1070 HG11 VAL M 84 -13.853 6.668 49.188 1.00 0.00 H ATOM 1071 HG12 VAL M 84 -13.431 6.883 47.471 1.00 0.00 H ATOM 1072 HG13 VAL M 84 -13.135 5.320 48.273 1.00 0.00 H ATOM 1073 HG21 VAL M 84 -10.892 6.877 46.817 1.00 0.00 H ATOM 1074 HG22 VAL M 84 -9.701 6.676 48.126 1.00 0.00 H ATOM 1075 HG23 VAL M 84 -10.758 5.318 47.667 1.00 0.00 H ATOM 1076 H VAL M 84 -11.062 9.181 47.103 1.00 0.00 H ATOM 1077 N GLY M 85 -10.296 8.658 50.981 1.00 12.87 N ATOM 1078 CA GLY M 85 -9.087 8.985 51.743 1.00 12.43 C ATOM 1079 C GLY M 85 -8.023 7.919 51.620 1.00 12.32 C ATOM 1080 O GLY M 85 -6.834 8.201 51.733 1.00 12.39 O ATOM 1081 HA3 GLY M 85 -9.354 9.094 52.794 1.00 0.00 H ATOM 1082 HA2 GLY M 85 -8.683 9.927 51.372 1.00 0.00 H ATOM 1083 H GLY M 85 -11.120 8.280 51.491 1.00 0.00 H ATOM 1084 N SER M 86 -8.461 6.686 51.392 1.00 12.17 N ATOM 1085 CA SER M 86 -7.564 5.563 51.194 1.00 12.38 C ATOM 1086 C SER M 86 -8.275 4.439 50.449 1.00 12.11 C ATOM 1087 O SER M 86 -9.495 4.459 50.274 1.00 12.22 O ATOM 1088 CB SER M 86 -7.009 5.058 52.533 1.00 12.48 C ATOM 1089 OG SER M 86 -8.012 4.401 53.278 1.00 14.63 O ATOM 1090 HA SER M 86 -6.723 5.903 50.589 1.00 0.00 H ATOM 1091 HB2 SER M 86 -6.635 5.906 53.107 1.00 0.00 H ATOM 1092 HB3 SER M 86 -6.192 4.362 52.342 1.00 0.00 H ATOM 1093 HG SER M 86 -7.631 4.085 54.135 1.00 0.00 H ATOM 1094 H SER M 86 -9.487 6.519 51.354 1.00 0.00 H ATOM 1095 N PHE M 87 -7.499 3.473 49.982 1.00 11.79 N ATOM 1096 CA PHE M 87 -8.056 2.290 49.353 1.00 11.63 C ATOM 1097 C PHE M 87 -7.056 1.141 49.441 1.00 11.63 C ATOM 1098 O PHE M 87 -5.862 1.359 49.673 1.00 11.25 O ATOM 1099 CB PHE M 87 -8.490 2.574 47.896 1.00 11.57 C ATOM 1100 CG PHE M 87 -7.352 2.676 46.911 1.00 11.26 C ATOM 1101 CD1 PHE M 87 -7.054 1.614 46.061 1.00 11.42 C ATOM 1102 CD2 PHE M 87 -6.597 3.844 46.810 1.00 11.02 C ATOM 1103 CE1 PHE M 87 -6.001 1.703 45.130 1.00 12.85 C ATOM 1104 CE2 PHE M 87 -5.545 3.945 45.893 1.00 11.94 C ATOM 1105 CZ PHE M 87 -5.247 2.875 45.046 1.00 12.10 C ATOM 1106 HA PHE M 87 -8.959 1.997 49.889 1.00 0.00 H ATOM 1107 HB2 PHE M 87 -9.148 1.767 47.573 1.00 0.00 H ATOM 1108 HB3 PHE M 87 -9.038 3.516 47.882 1.00 0.00 H ATOM 1109 HD2 PHE M 87 -6.830 4.691 47.455 1.00 0.00 H ATOM 1110 HE2 PHE M 87 -4.957 4.861 45.839 1.00 0.00 H ATOM 1111 HZ PHE M 87 -4.433 2.954 44.326 1.00 0.00 H ATOM 1112 HE1 PHE M 87 -5.775 0.860 44.477 1.00 0.00 H ATOM 1113 HD1 PHE M 87 -7.645 0.700 46.117 1.00 0.00 H ATOM 1114 H PHE M 87 -6.467 3.564 50.068 1.00 0.00 H ATOM 1115 N SER M 88 -7.572 -0.073 49.276 1.00 11.65 N ATOM 1116 CA SER M 88 -6.766 -1.269 49.150 1.00 12.02 C ATOM 1117 C SER M 88 -6.582 -1.620 47.672 1.00 12.40 C ATOM 1118 O SER M 88 -7.533 -1.510 46.889 1.00 12.13 O ATOM 1119 CB SER M 88 -7.449 -2.429 49.869 1.00 11.67 C ATOM 1120 OG SER M 88 -6.729 -3.634 49.666 1.00 11.32 O ATOM 1121 HA SER M 88 -5.790 -1.089 49.600 1.00 0.00 H ATOM 1122 HB2 SER M 88 -8.461 -2.546 49.481 1.00 0.00 H ATOM 1123 HB3 SER M 88 -7.493 -2.213 50.936 1.00 0.00 H ATOM 1124 HG SER M 88 -7.186 -4.374 50.139 1.00 0.00 H ATOM 1125 H SER M 88 -8.607 -0.168 49.235 1.00 0.00 H ATOM 1126 N VAL M 89 -5.375 -2.053 47.294 1.00 12.49 N ATOM 1127 CA VAL M 89 -5.143 -2.499 45.910 1.00 13.23 C ATOM 1128 C VAL M 89 -5.867 -3.823 45.607 1.00 13.59 C ATOM 1129 O VAL M 89 -6.085 -4.152 44.445 1.00 13.66 O ATOM 1130 CB VAL M 89 -3.630 -2.536 45.484 1.00 12.99 C ATOM 1131 CG1 VAL M 89 -2.857 -1.332 46.050 1.00 12.74 C ATOM 1132 CG2 VAL M 89 -2.962 -3.853 45.868 1.00 13.51 C ATOM 1133 HA VAL M 89 -5.588 -1.727 45.282 1.00 0.00 H ATOM 1134 HB VAL M 89 -3.603 -2.466 44.397 1.00 0.00 H ATOM 1135 HG11 VAL M 89 -3.300 -0.409 45.675 1.00 0.00 H ATOM 1136 HG12 VAL M 89 -2.911 -1.347 47.139 1.00 0.00 H ATOM 1137 HG13 VAL M 89 -1.815 -1.390 45.735 1.00 0.00 H ATOM 1138 HG21 VAL M 89 -3.016 -3.985 46.949 1.00 0.00 H ATOM 1139 HG22 VAL M 89 -3.476 -4.677 45.374 1.00 0.00 H ATOM 1140 HG23 VAL M 89 -1.918 -3.834 45.555 1.00 0.00 H ATOM 1141 H VAL M 89 -4.595 -2.075 47.982 1.00 0.00 H ATOM 1142 N LYS M 90 -6.247 -4.551 46.662 1.00 14.12 N ATOM 1143 CA LYS M 90 -7.102 -5.747 46.562 1.00 14.89 C ATOM 1144 C LYS M 90 -8.613 -5.431 46.571 1.00 15.11 C ATOM 1145 O LYS M 90 -9.439 -6.339 46.472 1.00 15.58 O ATOM 1146 CB LYS M 90 -6.789 -6.736 47.694 1.00 15.16 C ATOM 1147 CG LYS M 90 -5.317 -7.025 47.916 1.00 15.50 C ATOM 1148 CD LYS M 90 -5.157 -8.317 48.682 1.00 18.38 C ATOM 1149 CE LYS M 90 -3.719 -8.583 49.065 1.00 19.84 C ATOM 1150 NZ LYS M 90 -3.665 -9.764 49.981 1.00 22.26 N ATOM 1151 HA LYS M 90 -6.870 -6.191 45.594 1.00 0.00 H ATOM 1152 HB2 LYS M 90 -7.195 -6.328 48.619 1.00 0.00 H ATOM 1153 HB3 LYS M 90 -7.286 -7.678 47.465 1.00 0.00 H ATOM 1154 HG2 LYS M 90 -4.816 -7.112 46.952 1.00 0.00 H ATOM 1155 HG3 LYS M 90 -4.870 -6.210 48.485 1.00 0.00 H ATOM 1156 HD2 LYS M 90 -5.758 -8.263 49.590 1.00 0.00 H ATOM 1157 HD3 LYS M 90 -5.512 -9.139 48.061 1.00 0.00 H ATOM 1158 HE2 LYS M 90 -3.309 -7.709 49.571 1.00 0.00 H ATOM 1159 HE3 LYS M 90 -3.135 -8.790 48.168 1.00 0.00 H ATOM 1160 HZ1 LYS M 90 -4.223 -9.564 50.835 1.00 0.00 H ATOM 1161 HZ2 LYS M 90 -4.057 -10.596 49.496 1.00 0.00 H ATOM 1162 HZ3 LYS M 90 -2.677 -9.950 50.247 1.00 0.00 H ATOM 1163 H LYS M 90 -5.921 -4.257 47.605 1.00 0.00 H ATOM 1164 N ASN M 91 -8.967 -4.151 46.710 1.00 15.25 N ATOM 1165 CA ASN M 91 -10.353 -3.676 46.588 1.00 14.59 C ATOM 1166 C ASN M 91 -10.366 -2.497 45.614 1.00 14.75 C ATOM 1167 O ASN M 91 -10.795 -1.396 45.973 1.00 14.93 O ATOM 1168 CB ASN M 91 -10.901 -3.275 47.967 1.00 14.70 C ATOM 1169 CG ASN M 91 -12.396 -2.880 47.953 1.00 14.18 C ATOM 1170 OD1 ASN M 91 -12.900 -2.349 48.940 1.00 14.48 O ATOM 1171 ND2 ASN M 91 -13.091 -3.136 46.855 1.00 11.90 N ATOM 1172 HA ASN M 91 -10.998 -4.467 46.205 1.00 0.00 H ATOM 1173 HB2 ASN M 91 -10.774 -4.118 48.646 1.00 0.00 H ATOM 1174 HB3 ASN M 91 -10.324 -2.426 48.333 1.00 0.00 H ATOM 1175 HD22 ASN M 91 -12.628 -3.587 46.040 1.00 0.00 H ATOM 1176 HD21 ASN M 91 -14.099 -2.886 46.808 1.00 0.00 H ATOM 1177 H ASN M 91 -8.223 -3.454 46.915 1.00 0.00 H ATOM 1178 N PRO M 92 -9.927 -2.731 44.359 1.00 14.66 N ATOM 1179 CA PRO M 92 -9.523 -1.627 43.487 1.00 14.65 C ATOM 1180 C PRO M 92 -10.664 -0.884 42.787 1.00 14.74 C ATOM 1181 O PRO M 92 -10.411 -0.035 41.941 1.00 14.68 O ATOM 1182 CB PRO M 92 -8.606 -2.309 42.467 1.00 14.87 C ATOM 1183 CG PRO M 92 -9.124 -3.727 42.377 1.00 14.76 C ATOM 1184 CD PRO M 92 -9.820 -4.041 43.682 1.00 14.73 C ATOM 1185 HA PRO M 92 -9.054 -0.835 44.072 1.00 0.00 H ATOM 1186 HD3 PRO M 92 -10.808 -4.465 43.502 1.00 0.00 H ATOM 1187 HD2 PRO M 92 -9.230 -4.738 44.278 1.00 0.00 H ATOM 1188 HG3 PRO M 92 -8.295 -4.417 42.222 1.00 0.00 H ATOM 1189 HG2 PRO M 92 -9.828 -3.815 41.549 1.00 0.00 H ATOM 1190 HB2 PRO M 92 -8.671 -1.813 41.499 1.00 0.00 H ATOM 1191 HB3 PRO M 92 -7.572 -2.298 42.811 1.00 0.00 H ATOM 1192 N SER M 93 -11.901 -1.196 43.156 1.00 15.06 N ATOM 1193 CA SER M 93 -13.103 -0.545 42.610 1.00 15.19 C ATOM 1194 C SER M 93 -13.075 1.001 42.529 1.00 14.99 C ATOM 1195 O SER M 93 -13.461 1.553 41.500 1.00 15.08 O ATOM 1196 CB SER M 93 -14.356 -1.051 43.350 1.00 15.29 C ATOM 1197 OG SER M 93 -15.382 -0.082 43.371 1.00 16.39 O ATOM 1198 HA SER M 93 -13.131 -0.844 41.562 1.00 0.00 H ATOM 1199 HB2 SER M 93 -14.084 -1.299 44.376 1.00 0.00 H ATOM 1200 HB3 SER M 93 -14.725 -1.945 42.848 1.00 0.00 H ATOM 1201 HG SER M 93 -15.640 0.144 42.442 1.00 0.00 H ATOM 1202 H SER M 93 -12.027 -1.941 43.870 1.00 0.00 H ATOM 1203 N PRO M 94 -12.630 1.704 43.600 1.00 14.87 N ATOM 1204 CA PRO M 94 -12.522 3.167 43.502 1.00 14.52 C ATOM 1205 C PRO M 94 -11.601 3.640 42.376 1.00 14.22 C ATOM 1206 O PRO M 94 -11.831 4.700 41.775 1.00 13.78 O ATOM 1207 CB PRO M 94 -11.921 3.558 44.854 1.00 14.65 C ATOM 1208 CG PRO M 94 -12.335 2.465 45.773 1.00 14.51 C ATOM 1209 CD PRO M 94 -12.242 1.235 44.948 1.00 14.94 C ATOM 1210 HA PRO M 94 -13.488 3.618 43.278 1.00 0.00 H ATOM 1211 HD3 PRO M 94 -11.226 0.840 44.948 1.00 0.00 H ATOM 1212 HD2 PRO M 94 -12.928 0.469 45.309 1.00 0.00 H ATOM 1213 HG3 PRO M 94 -13.356 2.620 46.122 1.00 0.00 H ATOM 1214 HG2 PRO M 94 -11.664 2.407 46.630 1.00 0.00 H ATOM 1215 HB2 PRO M 94 -10.835 3.618 44.791 1.00 0.00 H ATOM 1216 HB3 PRO M 94 -12.318 4.516 45.190 1.00 0.00 H ATOM 1217 N LEU M 95 -10.564 2.854 42.110 1.00 13.94 N ATOM 1218 CA LEU M 95 -9.616 3.134 41.050 1.00 13.85 C ATOM 1219 C LEU M 95 -10.252 3.011 39.668 1.00 13.77 C ATOM 1220 O LEU M 95 -10.160 3.932 38.852 1.00 13.25 O ATOM 1221 CB LEU M 95 -8.443 2.172 41.185 1.00 14.43 C ATOM 1222 CG LEU M 95 -7.213 2.316 40.308 1.00 15.28 C ATOM 1223 CD1 LEU M 95 -6.468 3.608 40.651 1.00 16.57 C ATOM 1224 CD2 LEU M 95 -6.347 1.110 40.588 1.00 16.67 C ATOM 1225 HA LEU M 95 -9.274 4.164 41.147 1.00 0.00 H ATOM 1226 HB2 LEU M 95 -8.099 2.244 42.217 1.00 0.00 H ATOM 1227 HB3 LEU M 95 -8.838 1.172 41.004 1.00 0.00 H ATOM 1228 HG LEU M 95 -7.480 2.368 39.252 1.00 0.00 H ATOM 1229 HD21 LEU M 95 -6.075 1.096 41.644 1.00 0.00 H ATOM 1230 HD22 LEU M 95 -6.899 0.203 40.342 1.00 0.00 H ATOM 1231 HD23 LEU M 95 -5.444 1.164 39.980 1.00 0.00 H ATOM 1232 HD11 LEU M 95 -7.127 4.461 40.486 1.00 0.00 H ATOM 1233 HD12 LEU M 95 -6.161 3.582 41.696 1.00 0.00 H ATOM 1234 HD13 LEU M 95 -5.588 3.698 40.014 1.00 0.00 H ATOM 1235 H LEU M 95 -10.426 2.000 42.688 1.00 0.00 H ATOM 1236 N TYR M 96 -10.913 1.877 39.421 1.00 13.93 N ATOM 1237 CA TYR M 96 -11.565 1.614 38.139 1.00 14.18 C ATOM 1238 C TYR M 96 -12.709 2.588 37.865 1.00 14.05 C ATOM 1239 O TYR M 96 -12.896 3.010 36.728 1.00 13.58 O ATOM 1240 CB TYR M 96 -12.073 0.170 38.064 1.00 15.15 C ATOM 1241 CG TYR M 96 -11.013 -0.896 38.246 1.00 16.06 C ATOM 1242 CD1 TYR M 96 -11.335 -2.127 38.820 1.00 16.75 C ATOM 1243 CD2 TYR M 96 -9.693 -0.680 37.843 1.00 16.68 C ATOM 1244 CE1 TYR M 96 -10.370 -3.120 38.977 1.00 17.54 C ATOM 1245 CE2 TYR M 96 -8.719 -1.663 38.002 1.00 17.21 C ATOM 1246 CZ TYR M 96 -9.063 -2.875 38.565 1.00 17.64 C ATOM 1247 OH TYR M 96 -8.093 -3.844 38.721 1.00 18.95 O ATOM 1248 HA TYR M 96 -10.810 1.762 37.367 1.00 0.00 H ATOM 1249 HB3 TYR M 96 -12.534 0.025 37.087 1.00 0.00 H ATOM 1250 HB2 TYR M 96 -12.824 0.036 38.842 1.00 0.00 H ATOM 1251 HD2 TYR M 96 -9.420 0.276 37.396 1.00 0.00 H ATOM 1252 HE2 TYR M 96 -7.693 -1.476 37.684 1.00 0.00 H ATOM 1253 HE1 TYR M 96 -10.636 -4.080 39.419 1.00 0.00 H ATOM 1254 HD1 TYR M 96 -12.357 -2.314 39.150 1.00 0.00 H ATOM 1255 HH TYR M 96 -7.719 -4.080 37.835 1.00 0.00 H ATOM 1256 H TYR M 96 -10.966 1.155 40.168 1.00 0.00 H ATOM 1257 N GLU M 97 -13.462 2.931 38.911 1.00 14.01 N ATOM 1258 CA GLU M 97 -14.524 3.945 38.843 1.00 14.83 C ATOM 1259 C GLU M 97 -13.962 5.324 38.476 1.00 13.96 C ATOM 1260 O GLU M 97 -14.474 5.986 37.582 1.00 13.75 O ATOM 1261 CB GLU M 97 -15.291 4.012 40.173 1.00 14.55 C ATOM 1262 CG GLU M 97 -16.127 2.759 40.446 1.00 17.03 C ATOM 1263 CD GLU M 97 -16.494 2.539 41.912 1.00 18.10 C ATOM 1264 OE1 GLU M 97 -17.221 1.546 42.173 1.00 23.80 O ATOM 1265 OE2 GLU M 97 -16.072 3.325 42.800 1.00 22.17 O ATOM 1266 HA GLU M 97 -15.216 3.648 38.054 1.00 0.00 H ATOM 1267 HB2 GLU M 97 -14.572 4.133 40.983 1.00 0.00 H ATOM 1268 HB3 GLU M 97 -15.956 4.875 40.147 1.00 0.00 H ATOM 1269 HG2 GLU M 97 -17.051 2.836 39.873 1.00 0.00 H ATOM 1270 HG3 GLU M 97 -15.561 1.893 40.104 1.00 0.00 H ATOM 1271 H GLU M 97 -13.289 2.457 39.821 1.00 0.00 H ATOM 1272 N MET M 98 -12.909 5.746 39.175 1.00 13.54 N ATOM 1273 CA MET M 98 -12.183 6.965 38.825 1.00 13.12 C ATOM 1274 C MET M 98 -11.786 6.992 37.346 1.00 13.11 C ATOM 1275 O MET M 98 -12.006 7.995 36.673 1.00 12.99 O ATOM 1276 CB MET M 98 -10.946 7.130 39.717 1.00 13.01 C ATOM 1277 CG MET M 98 -10.149 8.416 39.484 1.00 12.10 C ATOM 1278 SD MET M 98 -9.065 8.351 38.059 1.00 11.99 S ATOM 1279 CE MET M 98 -7.774 7.265 38.669 1.00 12.06 C ATOM 1280 HA MET M 98 -12.857 7.805 38.996 1.00 0.00 H ATOM 1281 HB2 MET M 98 -11.274 7.118 40.756 1.00 0.00 H ATOM 1282 HB3 MET M 98 -10.283 6.284 39.537 1.00 0.00 H ATOM 1283 HG2 MET M 98 -9.542 8.609 40.369 1.00 0.00 H ATOM 1284 HG3 MET M 98 -10.853 9.236 39.342 1.00 0.00 H ATOM 1285 HE1 MET M 98 -7.312 7.711 39.550 1.00 0.00 H ATOM 1286 HE2 MET M 98 -8.207 6.300 38.933 1.00 0.00 H ATOM 1287 HE3 MET M 98 -7.021 7.126 37.893 1.00 0.00 H ATOM 1288 H MET M 98 -12.594 5.190 39.996 1.00 0.00 H ATOM 1289 N LEU M 99 -11.210 5.893 36.851 1.00 13.01 N ATOM 1290 CA LEU M 99 -10.809 5.777 35.438 1.00 13.06 C ATOM 1291 C LEU M 99 -11.978 5.837 34.460 1.00 13.47 C ATOM 1292 O LEU M 99 -11.836 6.351 33.349 1.00 13.15 O ATOM 1293 CB LEU M 99 -10.001 4.503 35.192 1.00 12.64 C ATOM 1294 CG LEU M 99 -8.646 4.421 35.900 1.00 13.11 C ATOM 1295 CD1 LEU M 99 -8.009 3.050 35.688 1.00 13.12 C ATOM 1296 CD2 LEU M 99 -7.713 5.546 35.455 1.00 11.27 C ATOM 1297 HA LEU M 99 -10.186 6.651 35.246 1.00 0.00 H ATOM 1298 HB2 LEU M 99 -10.603 3.657 35.524 1.00 0.00 H ATOM 1299 HB3 LEU M 99 -9.823 4.422 34.120 1.00 0.00 H ATOM 1300 HG LEU M 99 -8.817 4.551 36.969 1.00 0.00 H ATOM 1301 HD21 LEU M 99 -7.546 5.474 34.380 1.00 0.00 H ATOM 1302 HD22 LEU M 99 -8.168 6.508 35.690 1.00 0.00 H ATOM 1303 HD23 LEU M 99 -6.761 5.455 35.978 1.00 0.00 H ATOM 1304 HD11 LEU M 99 -8.666 2.279 36.092 1.00 0.00 H ATOM 1305 HD12 LEU M 99 -7.861 2.881 34.621 1.00 0.00 H ATOM 1306 HD13 LEU M 99 -7.047 3.015 36.200 1.00 0.00 H ATOM 1307 H LEU M 99 -11.038 5.089 37.487 1.00 0.00 H ATOM 1308 N LYS M 100 -13.126 5.297 34.862 1.00 14.10 N ATOM 1309 CA LYS M 100 -14.337 5.408 34.039 1.00 15.19 C ATOM 1310 C LYS M 100 -14.740 6.874 33.873 1.00 15.07 C ATOM 1311 O LYS M 100 -15.148 7.286 32.794 1.00 15.34 O ATOM 1312 CB LYS M 100 -15.483 4.585 34.623 1.00 15.07 C ATOM 1313 CG LYS M 100 -15.325 3.111 34.372 1.00 17.44 C ATOM 1314 CD LYS M 100 -16.427 2.299 35.029 1.00 20.90 C ATOM 1315 CE LYS M 100 -16.262 0.830 34.679 1.00 22.12 C ATOM 1316 NZ LYS M 100 -17.018 -0.055 35.605 1.00 24.03 N ATOM 1317 HA LYS M 100 -14.113 5.001 33.053 1.00 0.00 H ATOM 1318 HB2 LYS M 100 -15.521 4.754 35.699 1.00 0.00 H ATOM 1319 HB3 LYS M 100 -16.417 4.918 34.171 1.00 0.00 H ATOM 1320 HG2 LYS M 100 -15.350 2.932 33.297 1.00 0.00 H ATOM 1321 HG3 LYS M 100 -14.364 2.787 34.771 1.00 0.00 H ATOM 1322 HD2 LYS M 100 -16.372 2.422 36.111 1.00 0.00 H ATOM 1323 HD3 LYS M 100 -17.396 2.649 34.674 1.00 0.00 H ATOM 1324 HE2 LYS M 100 -15.204 0.573 34.732 1.00 0.00 H ATOM 1325 HE3 LYS M 100 -16.624 0.668 33.664 1.00 0.00 H ATOM 1326 HZ1 LYS M 100 -16.675 0.087 36.576 1.00 0.00 H ATOM 1327 HZ2 LYS M 100 -18.030 0.178 35.556 1.00 0.00 H ATOM 1328 HZ3 LYS M 100 -16.876 -1.047 35.328 1.00 0.00 H ATOM 1329 H LYS M 100 -13.166 4.791 35.769 1.00 0.00 H ATOM 1330 N ARG M 101 -14.586 7.659 34.935 1.00 15.21 N ATOM 1331 CA ARG M 101 -14.892 9.091 34.885 1.00 15.55 C ATOM 1332 C ARG M 101 -13.818 9.904 34.178 1.00 15.73 C ATOM 1333 O ARG M 101 -14.091 10.999 33.678 1.00 16.09 O ATOM 1334 CB ARG M 101 -15.054 9.659 36.291 1.00 15.43 C ATOM 1335 CG ARG M 101 -16.254 9.173 37.063 1.00 16.14 C ATOM 1336 CD ARG M 101 -16.372 9.973 38.354 1.00 17.61 C ATOM 1337 NE ARG M 101 -16.352 9.074 39.502 1.00 21.02 N ATOM 1338 CZ ARG M 101 -15.286 8.823 40.257 1.00 20.55 C ATOM 1339 NH1 ARG M 101 -14.133 9.428 40.022 1.00 21.05 N ATOM 1340 NH2 ARG M 101 -15.385 7.974 41.264 1.00 21.95 N ATOM 1341 HA ARG M 101 -15.821 9.172 34.321 1.00 0.00 H ATOM 1342 HB2 ARG M 101 -14.162 9.399 36.861 1.00 0.00 H ATOM 1343 HB3 ARG M 101 -15.127 10.743 36.207 1.00 0.00 H ATOM 1344 HG2 ARG M 101 -17.154 9.311 36.464 1.00 0.00 H ATOM 1345 HG3 ARG M 101 -16.134 8.115 37.298 1.00 0.00 H ATOM 1346 HD2 ARG M 101 -17.308 10.531 38.349 1.00 0.00 H ATOM 1347 HD3 ARG M 101 -15.536 10.669 38.425 1.00 0.00 H ATOM 1348 HE ARG M 101 -17.240 8.592 39.750 1.00 0.00 H ATOM 1349 HH12 ARG M 101 -13.307 9.223 40.620 1.00 0.00 H ATOM 1350 HH11 ARG M 101 -14.053 10.109 39.240 1.00 0.00 H ATOM 1351 HH22 ARG M 101 -14.556 7.773 41.858 1.00 0.00 H ATOM 1352 HH21 ARG M 101 -16.292 7.506 41.463 1.00 0.00 H ATOM 1353 H ARG M 101 -14.239 7.246 35.824 1.00 0.00 H ATOM 1354 N ASN M 102 -12.598 9.380 34.137 1.00 15.89 N ATOM 1355 CA ASN M 102 -11.443 10.200 33.759 1.00 15.95 C ATOM 1356 C ASN M 102 -10.725 9.827 32.461 1.00 16.25 C ATOM 1357 O ASN M 102 -9.703 10.430 32.117 1.00 16.15 O ATOM 1358 CB ASN M 102 -10.462 10.280 34.934 1.00 16.01 C ATOM 1359 CG ASN M 102 -11.060 10.993 36.137 1.00 15.08 C ATOM 1360 OD1 ASN M 102 -11.095 12.221 36.157 1.00 14.36 O ATOM 1361 HA ASN M 102 -11.862 11.180 33.530 1.00 0.00 H ATOM 1362 HB2 ASN M 102 -10.184 9.268 35.228 1.00 0.00 H ATOM 1363 HB3 ASN M 102 -9.572 10.821 34.612 1.00 0.00 H ATOM 1364 H ASN M 102 -12.461 8.377 34.376 1.00 0.00 H ATOM 1365 N LEU M 103 -11.268 8.849 31.741 1.00 16.56 N ATOM 1366 CA LEU M 103 -10.699 8.431 30.466 1.00 17.33 C ATOM 1367 C LEU M 103 -11.686 8.622 29.319 1.00 18.16 C ATOM 1368 O LEU M 103 -12.857 8.250 29.431 1.00 18.21 O ATOM 1369 CB LEU M 103 -10.218 6.973 30.523 1.00 16.80 C ATOM 1370 CG LEU M 103 -9.093 6.642 31.513 1.00 16.42 C ATOM 1371 CD1 LEU M 103 -8.865 5.138 31.573 1.00 15.46 C ATOM 1372 CD2 LEU M 103 -7.797 7.385 31.178 1.00 14.45 C ATOM 1373 HA LEU M 103 -9.837 9.070 30.276 1.00 0.00 H ATOM 1374 HB2 LEU M 103 -11.077 6.354 30.784 1.00 0.00 H ATOM 1375 HB3 LEU M 103 -9.867 6.704 29.527 1.00 0.00 H ATOM 1376 HG LEU M 103 -9.408 6.985 32.499 1.00 0.00 H ATOM 1377 HD21 LEU M 103 -7.466 7.103 30.179 1.00 0.00 H ATOM 1378 HD22 LEU M 103 -7.976 8.460 31.213 1.00 0.00 H ATOM 1379 HD23 LEU M 103 -7.029 7.120 31.905 1.00 0.00 H ATOM 1380 HD11 LEU M 103 -9.781 4.646 31.898 1.00 0.00 H ATOM 1381 HD12 LEU M 103 -8.587 4.774 30.584 1.00 0.00 H ATOM 1382 HD13 LEU M 103 -8.064 4.921 32.280 1.00 0.00 H ATOM 1383 H LEU M 103 -12.120 8.371 32.097 1.00 0.00 H ATOM 1384 N VAL M 104 -11.196 9.213 28.231 1.00 19.18 N ATOM 1385 CA VAL M 104 -11.954 9.345 26.990 1.00 20.34 C ATOM 1386 C VAL M 104 -11.430 8.314 25.997 1.00 21.01 C ATOM 1387 O VAL M 104 -10.230 8.275 25.692 1.00 21.34 O ATOM 1388 CB VAL M 104 -11.863 10.775 26.392 1.00 20.56 C ATOM 1389 CG1 VAL M 104 -12.612 10.862 25.051 1.00 20.47 C ATOM 1390 CG2 VAL M 104 -12.415 11.801 27.368 1.00 20.08 C ATOM 1391 HA VAL M 104 -13.008 9.169 27.204 1.00 0.00 H ATOM 1392 HB VAL M 104 -10.811 10.994 26.212 1.00 0.00 H ATOM 1393 HG11 VAL M 104 -12.172 10.159 24.344 1.00 0.00 H ATOM 1394 HG12 VAL M 104 -13.662 10.614 25.206 1.00 0.00 H ATOM 1395 HG13 VAL M 104 -12.531 11.875 24.656 1.00 0.00 H ATOM 1396 HG21 VAL M 104 -13.459 11.573 27.581 1.00 0.00 H ATOM 1397 HG22 VAL M 104 -11.839 11.768 28.293 1.00 0.00 H ATOM 1398 HG23 VAL M 104 -12.341 12.796 26.928 1.00 0.00 H ATOM 1399 H VAL M 104 -10.230 9.598 28.267 1.00 0.00 H ATOM 1400 N ILE M 105 -12.332 7.469 25.507 1.00 21.66 N ATOM 1401 CA ILE M 105 -11.955 6.398 24.590 1.00 22.36 C ATOM 1402 C ILE M 105 -11.674 6.941 23.188 1.00 22.77 C ATOM 1403 O ILE M 105 -12.482 7.684 22.618 1.00 22.85 O ATOM 1404 CB ILE M 105 -13.003 5.249 24.568 1.00 22.27 C ATOM 1405 CG1 ILE M 105 -13.124 4.623 25.966 1.00 22.61 C ATOM 1406 CG2 ILE M 105 -12.630 4.174 23.531 1.00 22.35 C ATOM 1407 CD1 ILE M 105 -14.132 3.473 26.078 1.00 22.62 C ATOM 1408 HA ILE M 105 -11.028 5.964 24.965 1.00 0.00 H ATOM 1409 HB ILE M 105 -13.966 5.671 24.280 1.00 0.00 H ATOM 1410 HG12 ILE M 105 -12.144 4.242 26.252 1.00 0.00 H ATOM 1411 HG13 ILE M 105 -13.425 5.406 26.662 1.00 0.00 H ATOM 1412 HD11 ILE M 105 -15.125 3.835 25.811 1.00 0.00 H ATOM 1413 HD12 ILE M 105 -13.842 2.670 25.400 1.00 0.00 H ATOM 1414 HD13 ILE M 105 -14.143 3.100 27.102 1.00 0.00 H ATOM 1415 HG21 ILE M 105 -12.588 4.626 22.540 1.00 0.00 H ATOM 1416 HG22 ILE M 105 -11.656 3.752 23.781 1.00 0.00 H ATOM 1417 HG23 ILE M 105 -13.382 3.385 23.541 1.00 0.00 H ATOM 1418 H ILE M 105 -13.329 7.574 25.784 1.00 0.00 H ATOM 1419 N LEU M 106 -10.494 6.590 22.674 1.00 23.46 N ATOM 1420 CA LEU M 106 -10.099 6.866 21.294 1.00 23.81 C ATOM 1421 C LEU M 106 -10.106 5.559 20.515 1.00 24.13 C ATOM 1422 O LEU M 106 -10.787 5.433 19.500 1.00 24.88 O ATOM 1423 CB LEU M 106 -8.696 7.475 21.237 1.00 23.76 C ATOM 1424 CG LEU M 106 -8.380 8.747 22.023 1.00 23.08 C ATOM 1425 CD1 LEU M 106 -6.884 8.840 22.231 1.00 22.54 C ATOM 1426 CD2 LEU M 106 -8.914 9.985 21.319 1.00 22.35 C ATOM 1427 HA LEU M 106 -10.802 7.578 20.861 1.00 0.00 H ATOM 1428 HB2 LEU M 106 -8.006 6.708 21.589 1.00 0.00 H ATOM 1429 HB3 LEU M 106 -8.490 7.694 20.189 1.00 0.00 H ATOM 1430 HG LEU M 106 -8.877 8.697 22.992 1.00 0.00 H ATOM 1431 HD21 LEU M 106 -8.457 10.066 20.333 1.00 0.00 H ATOM 1432 HD22 LEU M 106 -9.996 9.904 21.214 1.00 0.00 H ATOM 1433 HD23 LEU M 106 -8.670 10.870 21.907 1.00 0.00 H ATOM 1434 HD11 LEU M 106 -6.541 7.968 22.789 1.00 0.00 H ATOM 1435 HD12 LEU M 106 -6.385 8.873 21.262 1.00 0.00 H ATOM 1436 HD13 LEU M 106 -6.652 9.746 22.791 1.00 0.00 H ATOM 1437 H LEU M 106 -9.818 6.093 23.289 1.00 0.00 H TER 1438 LEU M 106 HETATM 1439 O HOH 1 10.443 7.921 46.247 1.00 12.15 O HETATM 1440 O HOH 2 8.059 6.881 35.608 1.00 21.16 O HETATM 1441 O HOH 3 1.426 6.047 25.886 1.00 8.26 O HETATM 1442 O HOH 4 -12.948 -3.565 44.463 1.00 10.92 O HETATM 1443 O HOH 5 -13.389 6.548 42.745 1.00 7.32 O HETATM 1444 O HOH 6 -13.055 11.645 39.420 1.00 15.39 O HETATM 1445 O HOH 7 -7.108 14.350 48.392 1.00 22.56 O HETATM 1446 O HOH 8 1.792 6.505 53.579 1.00 20.96 O HETATM 1447 O HOH 9 5.178 5.107 52.808 1.00 19.18 O HETATM 1448 O HOH 10 -4.994 18.035 47.735 1.00 31.61 O HETATM 1449 O HOH 11 -10.483 0.018 48.325 1.00 16.96 O HETATM 1450 O HOH 12 -6.699 19.630 36.018 1.00 31.17 O HETATM 1451 O HOH 13 0.366 -1.688 33.759 1.00 6.17 O HETATM 1452 O HOH 14 3.974 15.548 27.979 1.00 14.07 O HETATM 1453 O HOH 15 4.097 1.015 38.073 1.00 5.84 O HETATM 1454 O HOH 16 -0.154 -1.236 26.490 1.00 23.52 O HETATM 1455 O HOH 17 9.710 5.556 46.251 1.00 12.74 O HETATM 1456 O HOH 18 -7.828 14.661 51.492 1.00 41.61 O HETATM 1457 O HOH 19 -6.634 16.253 29.214 1.00 26.67 O HETATM 1458 O HOH 20 -4.778 16.397 39.456 1.00 15.55 O HETATM 1459 O HOH 21 -10.642 17.429 31.561 1.00 32.87 O HETATM 1460 O HOH 22 -0.451 4.085 23.441 1.00 18.28 O HETATM 1461 O HOH 23 -6.605 -3.112 29.159 1.00 54.60 O HETATM 1462 O HOH 24 -5.781 7.326 54.966 1.00 36.54 O HETATM 1463 O HOH 25 -4.517 -2.045 28.096 1.00 19.33 O HETATM 1464 O HOH 26 -2.378 17.370 40.180 1.00 28.15 O HETATM 1465 O HOH 27 0.065 9.553 52.205 1.00 49.89 O HETATM 1466 O HOH 28 -6.552 15.756 41.263 1.00 18.75 O HETATM 1467 O HOH 29 -1.918 8.344 56.379 1.00 31.98 O HETATM 1468 O HOH 30 -14.308 -2.122 33.422 1.00 46.08 O HETATM 1469 O HOH 31 -3.519 18.357 32.753 1.00 20.70 O HETATM 1470 O HOH 32 -14.825 9.713 31.025 1.00 33.59 O HETATM 1471 O HOH 33 2.148 17.292 35.879 1.00 28.09 O HETATM 1472 O HOH 34 4.712 17.634 35.835 1.00 26.90 O HETATM 1473 O HOH 35 8.091 4.707 33.904 1.00 28.02 O HETATM 1474 O HOH 36 -0.279 15.348 41.573 1.00 31.06 O HETATM 1475 O HOH 37 -10.826 -1.041 50.839 1.00 26.31 O HETATM 1476 O HOH 38 -15.340 -1.192 39.944 1.00 36.30 O HETATM 1477 O HOH 39 6.296 8.841 28.409 1.00 30.50 O HETATM 1478 O HOH 40 4.022 0.440 26.050 1.00 31.76 O HETATM 1479 O HOH 41 -1.760 11.241 51.201 1.00 23.79 O HETATM 1480 O HOH 42 -1.617 -3.263 25.560 1.00 48.12 O HETATM 1481 O HOH 43 -10.594 17.773 46.574 1.00 37.69 O HETATM 1482 O HOH 44 8.008 12.125 45.114 1.00 28.65 O HETATM 1483 O HOH 45 3.090 -0.438 30.337 1.00 24.38 O HETATM 1484 O HOH 46 2.441 -1.121 27.586 1.00 33.46 O HETATM 1485 O HOH 47 -0.576 17.991 32.651 1.00 49.91 O HETATM 1486 O HOH 48 -12.138 14.655 36.377 1.00 34.97 O HETATM 1487 O HOH 49 0.283 -6.263 52.704 1.00 16.78 O HETATM 1488 O HOH 50 10.333 8.749 36.074 1.00 52.15 O HETATM 1489 O HOH 51 6.490 12.160 41.160 1.00 62.11 O HETATM 1490 O HOH 52 -9.832 15.732 27.291 1.00 34.82 O HETATM 1491 O HOH 53 3.910 9.948 51.247 1.00 41.99 O HETATM 1492 O HOH 54 -9.384 17.165 40.668 1.00 23.36 O HETATM 1493 O HOH 55 1.283 13.723 48.894 1.00 28.69 O HETATM 1494 O HOH 56 7.837 5.569 52.624 1.00 25.53 O HETATM 1495 O HOH 57 -17.716 6.042 37.618 1.00 44.86 O HETATM 1496 O HOH 58 -11.287 14.644 25.162 1.00 29.65 O HETATM 1497 O HOH 59 -14.901 13.682 36.884 1.00 36.68 O HETATM 1498 O HOH 60 -12.054 16.803 34.227 1.00 32.07 O HETATM 1499 O HOH 61 2.626 5.595 28.126 1.00 33.51 O HETATM 1500 O HOH 62 -5.543 19.032 38.903 1.00 31.77 O HETATM 1501 O HOH 63 -10.764 1.154 20.964 1.00 76.63 O HETATM 1502 O HOH 64 1.666 16.220 42.786 1.00 23.43 O HETATM 1503 O HOH 65 -7.642 -6.770 42.852 1.00 51.84 O HETATM 1504 O HOH 66 -4.123 18.682 29.993 1.00 39.65 O HETATM 1505 O HOH 67 6.820 14.102 46.671 1.00 37.16 O HETATM 1506 O HOH 68 -14.425 -1.869 36.311 1.00 45.91 O HETATM 1507 O HOH 69 2.565 4.704 56.418 1.00 35.50 O HETATM 1508 O HOH 70 7.606 14.449 39.071 1.00 34.76 O HETATM 1509 O HOH 71 5.243 2.794 28.986 1.00 40.86 O HETATM 1510 O HOH 72 -15.298 0.073 26.823 1.00 48.97 O HETATM 1511 O HOH 73 6.291 14.107 32.362 1.00 20.59 O HETATM 1512 O HOH 74 3.952 16.893 42.299 1.00 21.62 O HETATM 1513 O HOH 75 -6.237 -8.326 52.372 1.00 35.48 O HETATM 1514 O HOH 76 8.172 1.960 31.159 1.00 51.36 O HETATM 1515 O HOH 77 -5.517 -6.907 26.190 1.00 46.73 O HETATM 1516 O HOH 78 9.712 11.449 31.887 1.00 40.84 O HETATM 1517 O HOH 79 -2.717 -8.558 53.158 1.00 41.82 O HETATM 1518 O HOH 80 8.800 11.993 36.931 1.00 42.43 O HETATM 1519 O HOH 81 9.382 8.233 31.538 1.00 38.23 O HETATM 1520 O HOH 82 -13.237 13.840 41.492 1.00 33.97 O HETATM 1521 O HOH 83 -17.840 3.176 38.414 1.00 24.35 O HETATM 1522 O HOH 84 -8.898 2.830 19.895 1.00 39.84 O HETATM 1523 O HOH 85 8.249 14.562 35.888 1.00 45.18 O HETATM 1524 O HOH 86 5.204 12.199 48.753 1.00 30.78 O HETATM 1525 O HOH 87 -6.308 -0.402 26.855 1.00 28.05 O HETATM 1526 O HOH 88 10.448 16.366 37.898 1.00 32.83 O HETATM 1527 O HOH 89 -17.965 0.654 31.841 1.00 56.13 O HETATM 1528 O HOH 90 -12.190 -2.872 31.501 1.00 41.35 O HETATM 1529 O HOH 91 0.096 -6.619 55.165 1.00 29.21 O HETATM 1530 O HOH 92 -14.252 5.595 29.957 1.00 28.56 O HETATM 1531 O HOH 93 -12.326 16.020 29.670 1.00 33.28 O HETATM 1532 O HOH 94 -4.020 -0.871 58.200 1.00 63.23 O HETATM 1533 O HOH 95 -18.337 13.563 30.414 1.00 51.24 O HETATM 1534 O HOH 96 -3.580 19.067 41.877 1.00 40.45 O HETATM 1535 O HOH 97 5.338 14.651 43.292 1.00 44.48 O HETATM 1536 O HOH 98 -9.900 13.395 28.154 1.00 54.65 O HETATM 1537 O HOH 99 -12.058 7.672 19.101 1.00 45.17 O HETATM 1538 O HOH 100 9.359 13.448 25.040 1.00 27.95 O HETATM 1539 O HOH 101 -10.673 -1.911 22.544 1.00 86.96 O HETATM 1540 O HOH 102 -8.331 19.291 39.330 1.00 38.67 O HETATM 1541 O HOH 103 -10.711 21.268 37.992 1.00 48.65 O HETATM 1542 O HOH 104 0.717 -1.390 36.298 1.00 6.59 O HETATM 1543 O HOH 105 -0.851 -3.175 37.540 1.00 27.85 O HETATM 1544 O HOH 106 6.564 -12.445 50.656 1.00 64.97 O HETATM 1545 O HOH 107 4.206 -9.404 41.615 1.00 24.74 O HETATM 1546 O HOH 108 -3.184 -7.361 34.883 1.00 35.81 O HETATM 1547 O HOH 109 3.321 -1.808 36.831 1.00 25.78 O HETATM 1548 O HOH 110 8.102 -5.703 42.187 1.00 23.38 O HETATM 1549 O HOH 111 4.170 -2.534 40.186 1.00 40.97 O HETATM 1550 O HOH 112 -2.750 -3.192 33.896 1.00 27.14 O HETATM 1551 O HOH 113 2.779 -10.050 52.525 1.00 58.68 O HETATM 1552 O HOH 114 -2.908 -9.318 45.191 1.00 49.72 O HETATM 1553 O HOH 115 -4.971 -7.227 43.425 1.00 44.52 O HETATM 1554 O HOH 116 -3.182 -3.554 36.402 1.00 26.15 O HETATM 1555 O HOH 117 8.696 -4.691 36.670 1.00 54.35 O HETATM 1556 O HOH 118 6.758 -4.659 52.785 1.00 36.54 O HETATM 1557 O HOH 119 4.414 -11.432 44.252 1.00 37.31 O HETATM 1558 O HOH 120 1.194 -9.760 38.015 1.00 99.20 O HETATM 1559 O HOH 121 -6.213 -3.568 36.979 1.00 32.10 O HETATM 1560 O HOH 122 -1.431 -8.213 33.373 1.00 42.03 O HETATM 1561 O HOH 123 2.782 -5.291 53.104 1.00 14.68 O HETATM 1562 N GLU A 124 3.641 -8.425 49.545 1.00 0.24 N HETATM 1563 CA GLU A 124 4.384 -7.799 50.678 1.00 0.07 C HETATM 1564 CB GLU A 124 5.584 -8.668 51.072 1.00 0.02 C HETATM 1565 CG GLU A 124 6.438 -8.122 52.220 1.00 0.01 C HETATM 1566 CD GLU A 124 7.123 -9.227 53.019 1.00 0.04 C HETATM 1567 OE2 GLU A 124 8.253 -9.000 53.512 1.00 -0.57 O HETATM 1568 OE1 GLU A 124 6.524 -10.320 53.162 1.00 -0.57 O HETATM 1569 H7 GLU A 124 5.790 -7.547 52.898 1.00 0.04 H HETATM 1570 H8 GLU A 124 7.210 -7.460 51.801 1.00 0.04 H HETATM 1571 H5 GLU A 124 6.231 -8.775 50.189 1.00 0.04 H HETATM 1572 H6 GLU A 124 5.205 -9.656 51.371 1.00 0.04 H HETATM 1573 C GLU A 124 4.819 -6.367 50.358 1.00 0.23 C HETATM 1574 O GLU A 124 4.536 -5.445 51.119 1.00 -0.39 O HETATM 1575 N GLU A 124 5.504 -6.195 49.236 1.00 -0.26 N HETATM 1576 CA GLU A 124 5.936 -4.880 48.745 1.00 0.16 C HETATM 1577 CB GLU A 124 7.282 -5.043 47.985 1.00 0.09 C HETATM 1578 CG2 GLU A 124 7.287 -4.324 46.669 1.00 -0.03 C HETATM 1579 H13 GLU A 124 8.258 -4.471 46.175 1.00 0.03 H HETATM 1580 H14 GLU A 124 7.120 -3.250 46.837 1.00 0.03 H HETATM 1581 H15 GLU A 124 6.486 -4.724 46.030 1.00 0.03 H HETATM 1582 OG1 GLU A 124 8.370 -4.567 48.798 1.00 -0.39 O HETATM 1583 H12 GLU A 124 8.365 -5.024 49.631 1.00 0.21 H HETATM 1584 H11 GLU A 124 7.434 -6.115 47.789 1.00 0.06 H HETATM 1585 C GLU A 124 4.826 -4.271 47.861 1.00 0.21 C HETATM 1586 O GLU A 124 4.130 -5.011 47.164 1.00 -0.39 O HETATM 1587 N GLU A 124 4.643 -2.946 47.901 1.00 -0.26 N HETATM 1588 CA GLU A 124 3.578 -2.310 47.110 1.00 0.14 C HETATM 1589 CB GLU A 124 3.534 -0.783 47.282 1.00 0.02 C HETATM 1590 CG GLU A 124 2.737 -0.088 46.198 1.00 -0.04 C HETATM 1591 CD1 GLU A 124 1.348 0.039 46.306 1.00 -0.06 C HETATM 1592 CE1 GLU A 124 0.603 0.649 45.288 1.00 -0.07 C HETATM 1593 CZ GLU A 124 1.248 1.125 44.154 1.00 -0.07 C HETATM 1594 CE2 GLU A 124 2.639 0.991 44.028 1.00 -0.07 C HETATM 1595 CD2 GLU A 124 3.366 0.384 45.043 1.00 -0.06 C HETATM 1596 H21 GLU A 124 4.439 0.274 44.938 1.00 0.06 H HETATM 1597 H23 GLU A 124 3.144 1.360 43.142 1.00 0.06 H HETATM 1598 H24 GLU A 124 0.676 1.601 43.365 1.00 0.06 H HETATM 1599 H22 GLU A 124 -0.472 0.749 45.385 1.00 0.06 H HETATM 1600 H20 GLU A 124 0.842 -0.339 47.187 1.00 0.06 H HETATM 1601 H18 GLU A 124 4.564 -0.398 47.261 1.00 0.05 H HETATM 1602 H19 GLU A 124 3.076 -0.553 48.255 1.00 0.05 H HETATM 1603 C GLU A 124 3.696 -2.643 45.617 1.00 0.21 C HETATM 1604 O GLU A 124 2.690 -2.862 44.931 1.00 -0.39 O HETATM 1605 N GLU A 124 4.933 -2.637 45.132 1.00 -0.26 N HETATM 1606 CA GLU A 124 5.254 -2.915 43.743 1.00 0.15 C HETATM 1607 CB GLU A 124 6.733 -2.585 43.500 1.00 0.08 C HETATM 1608 OG GLU A 124 7.195 -3.083 42.275 1.00 -0.39 O HETATM 1609 H29 GLU A 124 7.098 -4.028 42.262 1.00 0.21 H HETATM 1610 H27 GLU A 124 7.332 -3.027 44.310 1.00 0.06 H HETATM 1611 H28 GLU A 124 6.857 -1.492 43.507 1.00 0.06 H HETATM 1612 C GLU A 124 4.915 -4.365 43.349 1.00 0.21 C HETATM 1613 O GLU A 124 4.455 -4.605 42.238 1.00 -0.39 O HETATM 1614 N GLU A 124 5.139 -5.317 44.257 1.00 -0.26 N HETATM 1615 CA GLU A 124 4.718 -6.708 44.053 1.00 0.14 C HETATM 1616 CB GLU A 124 5.132 -7.607 45.229 1.00 0.04 C HETATM 1617 CG GLU A 124 6.645 -7.805 45.342 1.00 0.04 C HETATM 1618 OD1 GLU A 124 7.381 -7.615 44.347 1.00 -0.57 O HETATM 1619 OD2 GLU A 124 7.097 -8.162 46.456 1.00 -0.57 O HETATM 1620 H32 GLU A 124 4.661 -8.592 45.097 1.00 0.05 H HETATM 1621 H33 GLU A 124 4.770 -7.149 46.161 1.00 0.05 H HETATM 1622 C GLU A 124 3.197 -6.756 43.907 1.00 0.21 C HETATM 1623 O GLU A 124 2.679 -7.281 42.923 1.00 -0.39 O HETATM 1624 N GLU A 124 2.507 -6.185 44.894 1.00 -0.26 N HETATM 1625 CA GLU A 124 1.043 -6.113 44.937 1.00 0.13 C HETATM 1626 CB GLU A 124 0.590 -5.442 46.242 1.00 -0.01 C HETATM 1627 CG GLU A 124 0.974 -6.237 47.499 1.00 -0.04 C HETATM 1628 CD1 GLU A 124 1.058 -5.354 48.722 1.00 -0.06 C HETATM 1629 H39 GLU A 124 1.335 -5.963 49.595 1.00 0.02 H HETATM 1630 H40 GLU A 124 0.081 -4.880 48.900 1.00 0.02 H HETATM 1631 H41 GLU A 124 1.819 -4.576 48.561 1.00 0.02 H HETATM 1632 CD2 GLU A 124 0.008 -7.397 47.735 1.00 -0.06 C HETATM 1633 H42 GLU A 124 -0.037 -8.025 46.833 1.00 0.02 H HETATM 1634 H43 GLU A 124 -0.994 -7.001 47.956 1.00 0.02 H HETATM 1635 H44 GLU A 124 0.360 -8.000 48.585 1.00 0.02 H HETATM 1636 H38 GLU A 124 1.974 -6.663 47.328 1.00 0.03 H HETATM 1637 H36 GLU A 124 -0.504 -5.335 46.218 1.00 0.03 H HETATM 1638 H37 GLU A 124 1.055 -4.447 46.303 1.00 0.03 H HETATM 1639 C GLU A 124 0.402 -5.425 43.726 1.00 0.20 C HETATM 1640 O GLU A 124 -0.542 -5.960 43.139 1.00 -0.39 O HETATM 1641 N GLU A 124 0.922 -4.255 43.355 1.00 -0.26 N HETATM 1642 CA GLU A 124 0.415 -3.498 42.211 1.00 0.14 C HETATM 1643 CB GLU A 124 1.192 -2.182 42.041 1.00 0.00 C HETATM 1644 CG GLU A 124 0.620 -1.289 40.984 1.00 -0.04 C HETATM 1645 CD1 GLU A 124 1.065 -1.142 39.698 1.00 0.02 C HETATM 1646 NE1 GLU A 124 0.278 -0.236 39.026 1.00 -0.29 N HETATM 1647 CE2 GLU A 124 -0.705 0.212 39.870 1.00 0.06 C HETATM 1648 CD2 GLU A 124 -0.521 -0.433 41.115 1.00 -0.02 C HETATM 1649 CE3 GLU A 124 -1.403 -0.141 42.165 1.00 -0.07 C HETATM 1650 CZ3 GLU A 124 -2.436 0.784 41.938 1.00 -0.08 C HETATM 1651 CH2 GLU A 124 -2.590 1.404 40.690 1.00 -0.08 C HETATM 1652 CZ2 GLU A 124 -1.739 1.137 39.647 1.00 -0.04 C HETATM 1653 H52 GLU A 124 -1.860 1.622 38.685 1.00 0.05 H HETATM 1654 H54 GLU A 124 -3.400 2.110 40.546 1.00 0.05 H HETATM 1655 H53 GLU A 124 -3.125 1.022 42.740 1.00 0.05 H HETATM 1656 H51 GLU A 124 -1.290 -0.619 43.132 1.00 0.05 H HETATM 1657 H50 GLU A 124 0.406 0.058 38.047 1.00 0.22 H HETATM 1658 H49 GLU A 124 1.918 -1.666 39.269 1.00 0.08 H HETATM 1659 H47 GLU A 124 2.231 -2.422 41.770 1.00 0.04 H HETATM 1660 H48 GLU A 124 1.178 -1.642 42.999 1.00 0.04 H HETATM 1661 C GLU A 124 0.448 -4.306 40.909 1.00 0.21 C HETATM 1662 O GLU A 124 -0.500 -4.252 40.118 1.00 -0.39 O HETATM 1663 N GLU A 124 1.541 -5.042 40.694 1.00 -0.26 N HETATM 1664 CA GLU A 124 1.717 -5.884 39.506 1.00 0.13 C HETATM 1665 CB GLU A 124 3.047 -6.641 39.568 1.00 -0.01 C HETATM 1666 CG GLU A 124 4.274 -5.803 39.304 1.00 -0.04 C HETATM 1667 CD GLU A 124 5.526 -6.622 39.573 1.00 -0.01 C HETATM 1668 CE GLU A 124 6.796 -5.832 39.271 1.00 -0.04 C HETATM 1669 NZ GLU A 124 8.007 -6.653 39.574 1.00 0.22 N HETATM 1670 H65 GLU A 124 8.836 -6.117 39.369 1.00 0.20 H HETATM 1671 H66 GLU A 124 7.998 -7.487 39.008 1.00 0.20 H HETATM 1672 H67 GLU A 124 8.004 -6.909 40.549 1.00 0.20 H HETATM 1673 H63 GLU A 124 6.812 -4.922 39.889 1.00 0.08 H HETATM 1674 H64 GLU A 124 6.805 -5.553 38.207 1.00 0.08 H HETATM 1675 H61 GLU A 124 5.507 -7.521 38.939 1.00 0.03 H HETATM 1676 H62 GLU A 124 5.536 -6.920 40.632 1.00 0.03 H HETATM 1677 H59 GLU A 124 4.264 -4.923 39.965 1.00 0.03 H HETATM 1678 H60 GLU A 124 4.272 -5.473 38.255 1.00 0.03 H HETATM 1679 H57 GLU A 124 3.016 -7.446 38.819 1.00 0.03 H HETATM 1680 H58 GLU A 124 3.143 -7.079 40.572 1.00 0.03 H HETATM 1681 C GLU A 124 0.590 -6.899 39.359 1.00 0.20 C HETATM 1682 O GLU A 124 0.202 -7.245 38.241 1.00 -0.39 O HETATM 1683 N GLU A 124 0.081 -7.371 40.497 1.00 -0.26 N HETATM 1684 CA GLU A 124 -0.987 -8.367 40.537 1.00 0.13 C HETATM 1685 CB GLU A 124 -0.826 -9.287 41.760 1.00 -0.01 C HETATM 1686 CG GLU A 124 0.418 -10.171 41.923 1.00 -0.04 C HETATM 1687 CD1 GLU A 124 0.475 -10.738 43.340 1.00 -0.06 C HETATM 1688 H73 GLU A 124 1.369 -11.370 43.447 1.00 0.02 H HETATM 1689 H74 GLU A 124 -0.425 -11.342 43.530 1.00 0.02 H HETATM 1690 H75 GLU A 124 0.522 -9.911 44.064 1.00 0.02 H HETATM 1691 CD2 GLU A 124 0.445 -11.301 40.899 1.00 -0.06 C HETATM 1692 H76 GLU A 124 0.403 -10.878 39.885 1.00 0.02 H HETATM 1693 H77 GLU A 124 -0.421 -11.960 41.057 1.00 0.02 H HETATM 1694 H78 GLU A 124 1.373 -11.880 41.017 1.00 0.02 H HETATM 1695 H72 GLU A 124 1.308 -9.544 41.763 1.00 0.03 H HETATM 1696 H70 GLU A 124 -1.693 -9.964 41.759 1.00 0.03 H HETATM 1697 H71 GLU A 124 -0.868 -8.639 42.648 1.00 0.03 H HETATM 1698 C GLU A 124 -2.375 -7.717 40.551 1.00 0.20 C HETATM 1699 O GLU A 124 -3.275 -8.190 41.250 1.00 -0.39 O HETATM 1700 N GLU A 124 -2.540 -6.630 39.794 1.00 -0.26 N HETATM 1701 CA GLU A 124 -3.856 -6.015 39.606 1.00 0.13 C HETATM 1702 CB GLU A 124 -3.768 -4.487 39.493 1.00 -0.01 C HETATM 1703 CG GLU A 124 -4.015 -3.641 40.747 1.00 -0.04 C HETATM 1704 CD1 GLU A 124 -3.801 -2.190 40.425 1.00 -0.06 C HETATM 1705 H84 GLU A 124 -3.979 -1.584 41.326 1.00 0.02 H HETATM 1706 H85 GLU A 124 -4.500 -1.883 39.633 1.00 0.02 H HETATM 1707 H86 GLU A 124 -2.767 -2.039 40.080 1.00 0.02 H HETATM 1708 CD2 GLU A 124 -5.408 -3.829 41.301 1.00 -0.06 C HETATM 1709 H87 GLU A 124 -5.568 -4.891 41.538 1.00 0.02 H HETATM 1710 H88 GLU A 124 -6.147 -3.505 40.553 1.00 0.02 H HETATM 1711 H89 GLU A 124 -5.523 -3.228 42.215 1.00 0.02 H HETATM 1712 H83 GLU A 124 -3.292 -3.946 41.517 1.00 0.03 H HETATM 1713 H81 GLU A 124 -4.508 -4.175 38.741 1.00 0.03 H HETATM 1714 H82 GLU A 124 -2.756 -4.247 39.134 1.00 0.03 H HETATM 1715 C GLU A 124 -4.538 -6.600 38.370 1.00 0.21 C HETATM 1716 O GLU A 124 -3.959 -6.586 37.280 1.00 -0.39 O HETATM 1717 N GLU A 124 -5.773 -7.113 38.539 1.00 -0.25 N HETATM 1718 CA GLU A 124 -6.516 -7.784 37.473 1.00 0.14 C HETATM 1719 C GLU A 124 -6.663 -6.933 36.216 1.00 0.26 C HETATM 1720 O GLU A 124 -6.828 -5.717 36.314 1.00 -0.37 O HETATM 1721 O1 GLU A 124 -6.613 -7.504 35.016 1.00 -0.29 O HETATM 1722 H97 GLU A 124 -5.892 -7.133 34.520 1.00 0.25 H HETATM 1723 CB GLU A 124 -7.892 -8.047 38.104 1.00 -0.01 C HETATM 1724 CG GLU A 124 -7.948 -7.196 39.338 1.00 -0.03 C HETATM 1725 CD GLU A 124 -6.537 -7.081 39.799 1.00 0.04 C HETATM 1726 H95 GLU A 124 -6.373 -6.136 40.337 1.00 0.05 H HETATM 1727 H96 GLU A 124 -6.263 -7.925 40.449 1.00 0.05 H HETATM 1728 H93 GLU A 124 -8.359 -6.203 39.103 1.00 0.03 H HETATM 1729 H94 GLU A 124 -8.568 -7.676 40.110 1.00 0.03 H HETATM 1730 H91 GLU A 124 -7.995 -9.110 38.367 1.00 0.03 H HETATM 1731 H92 GLU A 124 -8.694 -7.763 37.406 1.00 0.03 H HETATM 1732 H90 GLU A 124 -6.023 -8.730 37.205 1.00 0.08 H HETATM 1733 H80 GLU A 124 -4.471 -6.255 40.486 1.00 0.08 H HETATM 1734 H79 GLU A 124 -1.744 -6.225 39.343 1.00 0.19 H HETATM 1735 H69 GLU A 124 -0.909 -8.983 39.629 1.00 0.08 H HETATM 1736 H68 GLU A 124 0.447 -7.028 41.362 1.00 0.19 H HETATM 1737 H56 GLU A 124 1.720 -5.232 38.620 1.00 0.08 H HETATM 1738 H55 GLU A 124 2.273 -5.018 41.374 1.00 0.19 H HETATM 1739 H46 GLU A 124 -0.635 -3.247 42.420 1.00 0.08 H HETATM 1740 H45 GLU A 124 1.688 -3.881 43.879 1.00 0.19 H HETATM 1741 H35 GLU A 124 0.672 -7.149 44.947 1.00 0.08 H HETATM 1742 H34 GLU A 124 3.019 -5.781 45.652 1.00 0.19 H HETATM 1743 H31 GLU A 124 5.185 -7.088 43.133 1.00 0.08 H HETATM 1744 H30 GLU A 124 5.610 -5.074 45.105 1.00 0.19 H HETATM 1745 H26 GLU A 124 4.646 -2.250 43.112 1.00 0.08 H HETATM 1746 H25 GLU A 124 5.685 -2.430 45.758 1.00 0.19 H HETATM 1747 H17 GLU A 124 2.621 -2.714 47.471 1.00 0.08 H HETATM 1748 H16 GLU A 124 5.237 -2.382 48.475 1.00 0.19 H HETATM 1749 H10 GLU A 124 6.100 -4.212 49.603 1.00 0.08 H HETATM 1750 H9 GLU A 124 5.739 -7.003 48.696 1.00 0.19 H HETATM 1751 H4 GLU A 124 3.703 -7.753 51.540 1.00 0.11 H HETATM 1752 H1 GLU A 124 3.374 -9.364 49.796 1.00 0.20 H HETATM 1753 H2 GLU A 124 4.232 -8.451 48.729 1.00 0.20 H HETATM 1754 H3 GLU A 124 2.815 -7.883 49.344 1.00 0.20 H CONECT 1562 1563 1752 1753 1754 CONECT 1563 1562 1564 1573 1751 CONECT 1564 1563 1565 1571 1572 CONECT 1565 1564 1566 1569 1570 CONECT 1566 1565 1567 1568 CONECT 1567 1566 CONECT 1568 1566 CONECT 1569 1565 CONECT 1570 1565 CONECT 1571 1564 CONECT 1572 1564 CONECT 1573 1563 1574 1575 CONECT 1574 1573 CONECT 1575 1573 1576 1750 CONECT 1576 1575 1577 1585 1749 CONECT 1577 1576 1578 1582 1584 CONECT 1578 1577 1579 1580 1581 CONECT 1579 1578 CONECT 1580 1578 CONECT 1581 1578 CONECT 1582 1577 1583 CONECT 1583 1582 CONECT 1584 1577 CONECT 1585 1576 1586 1587 CONECT 1586 1585 CONECT 1587 1585 1588 1748 CONECT 1588 1587 1589 1603 1747 CONECT 1589 1588 1590 1601 1602 CONECT 1590 1589 1591 1595 CONECT 1591 1590 1592 1600 CONECT 1592 1591 1593 1599 CONECT 1593 1592 1594 1598 CONECT 1594 1593 1595 1597 CONECT 1595 1590 1594 1596 CONECT 1596 1595 CONECT 1597 1594 CONECT 1598 1593 CONECT 1599 1592 CONECT 1600 1591 CONECT 1601 1589 CONECT 1602 1589 CONECT 1603 1588 1604 1605 CONECT 1604 1603 CONECT 1605 1603 1606 1746 CONECT 1606 1605 1607 1612 1745 CONECT 1607 1606 1608 1610 1611 CONECT 1608 1607 1609 CONECT 1609 1608 CONECT 1610 1607 CONECT 1611 1607 CONECT 1612 1606 1613 1614 CONECT 1613 1612 CONECT 1614 1612 1615 1744 CONECT 1615 1614 1616 1622 1743 CONECT 1616 1615 1617 1620 1621 CONECT 1617 1616 1618 1619 CONECT 1618 1617 CONECT 1619 1617 CONECT 1620 1616 CONECT 1621 1616 CONECT 1622 1615 1623 1624 CONECT 1623 1622 CONECT 1624 1622 1625 1742 CONECT 1625 1624 1626 1639 1741 CONECT 1626 1625 1627 1637 1638 CONECT 1627 1626 1628 1632 1636 CONECT 1628 1627 1629 1630 1631 CONECT 1629 1628 CONECT 1630 1628 CONECT 1631 1628 CONECT 1632 1627 1633 1634 1635 CONECT 1633 1632 CONECT 1634 1632 CONECT 1635 1632 CONECT 1636 1627 CONECT 1637 1626 CONECT 1638 1626 CONECT 1639 1625 1640 1641 CONECT 1640 1639 CONECT 1641 1639 1642 1740 CONECT 1642 1641 1643 1661 1739 CONECT 1643 1642 1644 1659 1660 CONECT 1644 1643 1645 1648 CONECT 1645 1644 1646 1658 CONECT 1646 1645 1647 1657 CONECT 1647 1646 1648 1652 CONECT 1648 1644 1647 1649 CONECT 1649 1648 1650 1656 CONECT 1650 1649 1651 1655 CONECT 1651 1650 1652 1654 CONECT 1652 1647 1651 1653 CONECT 1653 1652 CONECT 1654 1651 CONECT 1655 1650 CONECT 1656 1649 CONECT 1657 1646 CONECT 1658 1645 CONECT 1659 1643 CONECT 1660 1643 CONECT 1661 1642 1662 1663 CONECT 1662 1661 CONECT 1663 1661 1664 1738 CONECT 1664 1663 1665 1681 1737 CONECT 1665 1664 1666 1679 1680 CONECT 1666 1665 1667 1677 1678 CONECT 1667 1666 1668 1675 1676 CONECT 1668 1667 1669 1673 1674 CONECT 1669 1668 1670 1671 1672 CONECT 1670 1669 CONECT 1671 1669 CONECT 1672 1669 CONECT 1673 1668 CONECT 1674 1668 CONECT 1675 1667 CONECT 1676 1667 CONECT 1677 1666 CONECT 1678 1666 CONECT 1679 1665 CONECT 1680 1665 CONECT 1681 1664 1682 1683 CONECT 1682 1681 CONECT 1683 1681 1684 1736 CONECT 1684 1683 1685 1698 1735 CONECT 1685 1684 1686 1696 1697 CONECT 1686 1685 1687 1691 1695 CONECT 1687 1686 1688 1689 1690 CONECT 1688 1687 CONECT 1689 1687 CONECT 1690 1687 CONECT 1691 1686 1692 1693 1694 CONECT 1692 1691 CONECT 1693 1691 CONECT 1694 1691 CONECT 1695 1686 CONECT 1696 1685 CONECT 1697 1685 CONECT 1698 1684 1699 1700 CONECT 1699 1698 CONECT 1700 1698 1701 1734 CONECT 1701 1700 1702 1715 1733 CONECT 1702 1701 1703 1713 1714 CONECT 1703 1702 1704 1708 1712 CONECT 1704 1703 1705 1706 1707 CONECT 1705 1704 CONECT 1706 1704 CONECT 1707 1704 CONECT 1708 1703 1709 1710 1711 CONECT 1709 1708 CONECT 1710 1708 CONECT 1711 1708 CONECT 1712 1703 CONECT 1713 1702 CONECT 1714 1702 CONECT 1715 1701 1716 1717 CONECT 1716 1715 CONECT 1717 1715 1718 1725 CONECT 1718 1717 1719 1723 1732 CONECT 1719 1718 1720 1721 CONECT 1720 1719 CONECT 1721 1719 1722 CONECT 1722 1721 CONECT 1723 1718 1724 1730 1731 CONECT 1724 1723 1725 1728 1729 CONECT 1725 1717 1724 1726 1727 CONECT 1726 1725 CONECT 1727 1725 CONECT 1728 1724 CONECT 1729 1724 CONECT 1730 1723 CONECT 1731 1723 CONECT 1732 1718 CONECT 1733 1701 CONECT 1734 1700 CONECT 1735 1684 CONECT 1736 1683 CONECT 1737 1664 CONECT 1738 1663 CONECT 1739 1642 CONECT 1740 1641 CONECT 1741 1625 CONECT 1742 1624 CONECT 1743 1615 CONECT 1744 1614 CONECT 1745 1606 CONECT 1746 1605 CONECT 1747 1588 CONECT 1748 1587 CONECT 1749 1576 CONECT 1750 1575 CONECT 1751 1563 CONECT 1752 1562 CONECT 1753 1562 CONECT 1754 1562 MASTER 0 0 0 0 0 0 0 0 1753 1 193 7 END
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Protein Sequence Similarity
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Ligand Name
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15-mer
3cfs
RCSB PDB
PDBbind
15-mer
3dab
RCSB PDB
PDBbind
15-mer
3fdt
RCSB PDB
PDBbind
15-mer
3ghe
RCSB PDB
PDBbind
15-mer
3gv6
RCSB PDB
PDBbind
15-mer
3h1z
RCSB PDB
PDBbind
15-mer
3h91
RCSB PDB
PDBbind
15-mer
3hqh
RCSB PDB
PDBbind
15-mer
3jpx
RCSB PDB
PDBbind
15-mer
3l3q
RCSB PDB
PDBbind
15-mer
3l6f
RCSB PDB
PDBbind
15-mer
3m17
RCSB PDB
PDBbind
15-mer
3o6l
RCSB PDB
PDBbind
15-mer
3ql9
RCSB PDB
PDBbind
15-mer
3qlc
RCSB PDB
PDBbind
15-mer
3qo2
RCSB PDB
PDBbind
15-mer
3qxd
RCSB PDB
PDBbind
15-mer
3r93
RCSB PDB
PDBbind
15-mer
3uig
RCSB PDB
PDBbind
15-mer
3uih
RCSB PDB
PDBbind
15-mer
3uij
RCSB PDB
PDBbind
15-mer
3wp0
RCSB PDB
PDBbind
15-mer
3wsy
RCSB PDB
PDBbind
15-mer
4b4n
RCSB PDB
PDBbind
15-mer
4bxu
RCSB PDB
PDBbind
15-mer
4cy1
RCSB PDB
PDBbind
15-mer
4dma
RCSB PDB
PDBbind
15-mer
4dx9
RCSB PDB
PDBbind
15-mer
4ezo
RCSB PDB
PDBbind
15-mer
4ft2
RCSB PDB
PDBbind
15-mer
4gnf
RCSB PDB
PDBbind
15-mer
4gng
RCSB PDB
PDBbind
15-mer
4hfz
RCSB PDB
PDBbind
15-mer
4iur
RCSB PDB
PDBbind
15-mer
4iut
RCSB PDB
PDBbind
15-mer
4iuu
RCSB PDB
PDBbind
15-mer
4iuv
RCSB PDB
PDBbind
15-mer
4j8s
RCSB PDB
PDBbind
15-mer
4k0u
RCSB PDB
PDBbind
15-mer
4n3w
RCSB PDB
PDBbind
15-mer
4n5t
RCSB PDB
PDBbind
15-mer
4nb3
RCSB PDB
PDBbind
15-mer
4nmx
RCSB PDB
PDBbind
15-mer
4nw2
RCSB PDB
PDBbind
15-mer
4o36
RCSB PDB
PDBbind
15-mer
4o37
RCSB PDB
PDBbind
15-mer
4o3u
RCSB PDB
PDBbind
15-mer
4o42
RCSB PDB
PDBbind
15-mer
4o45
RCSB PDB
PDBbind
15-mer
4os1
RCSB PDB
PDBbind
15-mer
4os4
RCSB PDB
PDBbind
15-mer
4os5
RCSB PDB
PDBbind
15-mer
4os7
RCSB PDB
PDBbind
15-mer
4psx
RCSB PDB
PDBbind
15-mer
4r1e
RCSB PDB
PDBbind
15-mer
4r3s
RCSB PDB
PDBbind
15-mer
4rrv
RCSB PDB
PDBbind
15-mer
4u0a
RCSB PDB
PDBbind
15-mer
4u0b
RCSB PDB
PDBbind
15-mer
4u6x
RCSB PDB
PDBbind
15-mer
4u6y
RCSB PDB
PDBbind
15-mer
4xyn
RCSB PDB
PDBbind
15-mer
5cfa
RCSB PDB
PDBbind
15-mer
5cin
RCSB PDB
PDBbind
15-mer
5cqx
RCSB PDB
PDBbind
15-mer
5dif
RCSB PDB
PDBbind
15-mer
5epp
RCSB PDB
PDBbind
15-mer
5etf
RCSB PDB
PDBbind
15-mer
5fb0
RCSB PDB
PDBbind
15-mer
5fb1
RCSB PDB
PDBbind
15-mer
5h5q
RCSB PDB
PDBbind
15-mer
5h5r
RCSB PDB
PDBbind
15-mer
5ix1
RCSB PDB
PDBbind
15-mer
5izu
RCSB PDB
PDBbind
15-mer
5j19
RCSB PDB
PDBbind
15-mer
5j9k
RCSB PDB
PDBbind
15-mer
5jlz
RCSB PDB
PDBbind
15-mer
5ksu
RCSB PDB
PDBbind
15-mer
5ksv
RCSB PDB
PDBbind
15-mer
5kzp
RCSB PDB
PDBbind
15-mer
5lax
RCSB PDB
PDBbind
15-mer
5mlo
RCSB PDB
PDBbind
15-mer
5o45
RCSB PDB
PDBbind
15-mer
5svz
RCSB PDB
PDBbind
15-mer
5t1i
RCSB PDB
PDBbind
15-mer
5twg
RCSB PDB
PDBbind
15-mer
5u66
RCSB PDB
PDBbind
15-mer
5ul6
RCSB PDB
PDBbind
15-mer
5uwj
RCSB PDB
PDBbind
15-mer
5v4b
RCSB PDB
PDBbind
15-mer
5vb9
RCSB PDB
PDBbind
15-mer
5vzy
RCSB PDB
PDBbind
15-mer
5wir
RCSB PDB
PDBbind
15-mer
5ypo
RCSB PDB
PDBbind
15-mer
5znp
RCSB PDB
PDBbind
15-mer
5zuj
RCSB PDB
PDBbind
15-mer
6atv
RCSB PDB
PDBbind
15-mer
6b5m
RCSB PDB
PDBbind
15-mer
6b5o
RCSB PDB
PDBbind
15-mer
6b5r
RCSB PDB
PDBbind
15-mer
6b5t
RCSB PDB
PDBbind
15-mer
6biz
RCSB PDB
PDBbind
15-mer
6f0y
RCSB PDB
PDBbind
15-mer
6rmm
RCSB PDB
PDBbind
15-mer
6rml
RCSB PDB
PDBbind
15-mer
6q9t
RCSB PDB
PDBbind
15-mer
6hol
RCSB PDB
PDBbind
15-mer
6e5x
RCSB PDB
PDBbind
15-mer
6bnt
RCSB PDB
PDBbind
15-mer
5zk9
RCSB PDB
PDBbind
15-mer
5zjz
RCSB PDB
PDBbind
15-mer
5vtb
RCSB PDB
PDBbind
15-mer
6a5e
RCSB PDB
PDBbind
15-mer
Entry Information
PDB ID
2z5t
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
human-mimic Mdm4 protein
Ligand Name
15-mer
EC.Number
E.C.-.-.-.-
Resolution
2.3(Å)
Affinity (Kd/Ki/IC50)
Kd=2.40uM
Release Year
2007
Protein/NA Sequence
Check fasta file
Primary Reference
(2007) Cell Cycle Vol. 6: pp. 2386-2392
Ligand Properties
Formula
C
6
5
H
9
9
N
1
3
O
1
8
Molecular Weight
1350.560
Exact Mass
1349.720
No. of atoms
195
No. of bonds
198
Polar Surface Area
505.64
LOGP Value
-0.64 (
Computed with XLOGP3
)
0.72 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 15
No. of Hydrogen Bond Acceptors: 18
No. of Rotatable Bonds: 52
No. of Nitrogen and Oxygen Atoms: 31
No. of Rings: 4
Canonical SMILES
[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)CC(C)C)CC(C)C)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](CCC(=O)O)[NH3+])Cc1ccccc1)CO)CC(=O)O)CC(C)C
InChI String
InChI=1S/C65H97N13O18/c1-34(2)26-44(71-61(91)48(31-53(83)84)73-62(92)50(33-79)76-59(89)46(29-38-16-9-8-10-17-38)74-63(93)54(37(7)80)77-55(85)41(67)22-23-52(81)82)57(87)72-47(30-39-32-68-42-19-12-11-18-40(39)42)60(90)69-43(20-13-14-24-66)56(86)70-45(27-35(3)4)58(88)75-49(28-36(5)6)64(94)78-25-15-21-51(78)65(95)96/h8-12,16-19,32,34-37,41,43-51,54,68,79-80H,13-15,20-31,33,66-67H2,1-7H3,(H,69,90)(H,70,86)(H,71,91)(H,72,87)(H,73,92)(H,74,93)(H,75,88)(H,76,89)(H,77,85)(H,81,82)(H,83,84)(H,95,96)/p+2/t37-,41+,43+,44+,45+,46+,47+,48+,49+,50+,51+,54+/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q7ZUW7
P04637
Entrez Gene ID
NCBI Entrez Gene ID:
7157
ASD
Information of known allosteric effects of PDB entries
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