Browse entries in the PDBbind-CN Database
HEADER 6NK1_COMPLEX COMPND 6NK1_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 181 GLY GLU VAL VAL LEU LEU ASP PHE ALA ALA ALA GLY GLY SEQRES 2 A 181 GLU LEU GLY TRP LEU THR HIS PRO TYR GLY LYS GLY TRP SEQRES 3 A 181 ASP LEU MET GLN ASN ILE MET ASN ASP MET PRO ILE TYR SEQRES 4 A 181 MET TYR SER VAL CYS ASN VAL MET SER GLY ASP GLN ASP SEQRES 5 A 181 ASN TRP LEU ARG THR ASN TRP VAL TYR ARG GLY GLU ALA SEQRES 6 A 181 GLU ARG ILE PHE ILE GLU LEU LYS PHE THR VAL ARG ASP SEQRES 7 A 181 CYS ASN SER PHE PRO GLY GLY ALA SER SER CYS LYS GLU SEQRES 8 A 181 THR PHE ASN LEU TYR TYR ALA GLU SER ASP LEU ASP TYR SEQRES 9 A 181 GLY THR ASN PHE GLN LYS ARG LEU PHE THR LYS ILE ASP SEQRES 10 A 181 THR ILE ALA PRO ASP GLU ILE THR VAL SER SER ASP PHE SEQRES 11 A 181 GLU ALA ARG HIS VAL LYS LEU ASN VAL GLU GLU ARG SER SEQRES 12 A 181 VAL GLY PRO LEU THR ARG LYS GLY PHE TYR LEU ALA PHE SEQRES 13 A 181 GLN ASP ILE GLY ALA CYS VAL ALA LEU LEU SER VAL ARG SEQRES 14 A 181 VAL TYR TYR LYS LYS ALA HIS HIS HIS HIS HIS HIS HET BAL A 389 235 SSBOND 1 CYS A 105 CYS A 115 SSBOND 2 CYS A 70 CYS A 188 ATOM 1 N GLY A 27 -28.513 -33.202 -3.012 1.00 46.18 N ATOM 2 CA GLY A 27 -27.288 -33.185 -3.793 1.00 41.41 C ATOM 3 C GLY A 27 -26.008 -33.236 -2.978 1.00 35.80 C ATOM 4 O GLY A 27 -25.145 -32.378 -3.112 1.00 38.09 O ATOM 5 HN3 GLY A 27 -28.530 -32.378 -2.377 1.00 0.00 H ATOM 6 HN2 GLY A 27 -28.552 -34.076 -2.449 1.00 0.00 H ATOM 7 HN1 GLY A 27 -29.332 -33.164 -3.652 1.00 0.00 H ATOM 8 N GLU A 28 -25.921 -34.205 -2.076 1.00 28.96 N ATOM 9 CA GLU A 28 -24.705 -34.531 -1.343 1.00 25.38 C ATOM 10 C GLU A 28 -24.292 -35.948 -1.729 1.00 26.27 C ATOM 11 O GLU A 28 -25.148 -36.811 -1.955 1.00 32.40 O ATOM 12 CB GLU A 28 -24.876 -34.411 0.193 1.00 24.86 C ATOM 13 CG GLU A 28 -25.163 -32.980 0.682 1.00 30.11 C ATOM 14 CD GLU A 28 -25.278 -32.848 2.205 1.00 30.19 C ATOM 15 OE1 GLU A 28 -25.343 -33.866 2.913 1.00 29.34 O ATOM 16 OE2 GLU A 28 -25.316 -31.697 2.702 1.00 31.74 O ATOM 17 H GLU A 28 -26.774 -34.767 -1.880 1.00 0.00 H ATOM 18 N VAL A 29 -22.988 -36.179 -1.828 1.00 20.82 N ATOM 19 CA VAL A 29 -22.420 -37.506 -2.053 1.00 19.76 C ATOM 20 C VAL A 29 -21.605 -37.837 -0.820 1.00 17.22 C ATOM 21 O VAL A 29 -20.674 -37.097 -0.466 1.00 16.15 O ATOM 22 CB VAL A 29 -21.552 -37.545 -3.317 1.00 20.37 C ATOM 23 CG1 VAL A 29 -20.923 -38.934 -3.494 1.00 21.55 C ATOM 24 CG2 VAL A 29 -22.387 -37.141 -4.527 1.00 23.32 C ATOM 25 H VAL A 29 -22.337 -35.373 -1.741 1.00 0.00 H ATOM 26 N VAL A 30 -21.990 -38.888 -0.120 1.00 16.92 N ATOM 27 CA VAL A 30 -21.411 -39.188 1.177 1.00 15.78 C ATOM 28 C VAL A 30 -20.206 -40.102 0.984 1.00 15.63 C ATOM 29 O VAL A 30 -20.284 -41.130 0.302 1.00 18.70 O ATOM 30 CB VAL A 30 -22.457 -39.813 2.119 1.00 17.39 C ATOM 31 CG1 VAL A 30 -21.790 -40.249 3.412 1.00 18.03 C ATOM 32 CG2 VAL A 30 -23.579 -38.796 2.420 1.00 18.33 C ATOM 33 H VAL A 30 -22.724 -39.515 -0.506 1.00 0.00 H ATOM 34 N LEU A 31 -19.087 -39.707 1.581 1.00 14.15 N ATOM 35 CA LEU A 31 -17.848 -40.466 1.500 1.00 13.70 C ATOM 36 C LEU A 31 -17.589 -41.311 2.739 1.00 13.20 C ATOM 37 O LEU A 31 -16.889 -42.333 2.641 1.00 14.70 O ATOM 38 CB LEU A 31 -16.643 -39.542 1.301 1.00 14.66 C ATOM 39 CG LEU A 31 -16.608 -38.671 0.046 1.00 19.20 C ATOM 40 CD1 LEU A 31 -15.386 -37.744 0.133 1.00 19.13 C ATOM 41 CD2 LEU A 31 -16.560 -39.488 -1.218 1.00 21.55 C ATOM 42 H LEU A 31 -19.097 -38.822 2.127 1.00 0.00 H ATOM 43 N LEU A 32 -18.138 -40.919 3.892 1.00 14.22 N ATOM 44 CA LEU A 32 -17.938 -41.594 5.163 1.00 13.60 C ATOM 45 C LEU A 32 -19.126 -41.263 6.050 1.00 13.19 C ATOM 46 O LEU A 32 -19.555 -40.110 6.101 1.00 13.60 O ATOM 47 CB LEU A 32 -16.629 -41.144 5.821 1.00 13.78 C ATOM 48 CG LEU A 32 -16.357 -41.700 7.212 1.00 16.28 C ATOM 49 CD1 LEU A 32 -16.174 -43.181 7.180 1.00 18.19 C ATOM 50 CD2 LEU A 32 -15.140 -41.014 7.801 1.00 17.55 C ATOM 51 H LEU A 32 -18.748 -40.077 3.879 1.00 0.00 H ATOM 52 N ASP A 33 -19.662 -42.275 6.765 1.00 13.36 N ATOM 53 CA ASP A 33 -20.756 -42.042 7.707 1.00 14.01 C ATOM 54 C ASP A 33 -20.636 -43.036 8.863 1.00 14.06 C ATOM 55 O ASP A 33 -21.135 -44.164 8.784 1.00 16.29 O ATOM 56 CB ASP A 33 -22.111 -42.157 7.004 1.00 15.78 C ATOM 57 CG ASP A 33 -23.283 -41.704 7.859 1.00 21.00 C ATOM 58 OD1 ASP A 33 -23.140 -41.626 9.085 1.00 21.96 O ATOM 59 OD2 ASP A 33 -24.382 -41.472 7.297 1.00 24.03 O ATOM 60 H ASP A 33 -19.290 -43.239 6.644 1.00 0.00 H ATOM 61 N PHE A 34 -20.038 -42.595 9.962 1.00 12.86 N ATOM 62 CA PHE A 34 -19.761 -43.473 11.095 1.00 13.43 C ATOM 63 C PHE A 34 -21.035 -44.063 11.701 1.00 15.67 C ATOM 64 O PHE A 34 -21.108 -45.274 11.969 1.00 17.21 O ATOM 65 CB PHE A 34 -18.977 -42.703 12.171 1.00 12.72 C ATOM 66 CG PHE A 34 -18.951 -43.399 13.502 1.00 12.69 C ATOM 67 CD1 PHE A 34 -18.077 -44.417 13.762 1.00 13.47 C ATOM 68 CD2 PHE A 34 -19.834 -43.045 14.497 1.00 13.70 C ATOM 69 CE1 PHE A 34 -18.092 -45.079 15.003 1.00 14.86 C ATOM 70 CE2 PHE A 34 -19.860 -43.698 15.728 1.00 15.99 C ATOM 71 CZ PHE A 34 -18.968 -44.723 15.971 1.00 15.69 C ATOM 72 H PHE A 34 -19.758 -41.595 10.018 1.00 0.00 H ATOM 73 N ALA A 35 -22.028 -43.225 11.973 1.00 15.55 N ATOM 74 CA ALA A 35 -23.228 -43.684 12.663 1.00 17.52 C ATOM 75 C ALA A 35 -23.978 -44.696 11.815 1.00 20.18 C ATOM 76 O ALA A 35 -24.586 -45.625 12.355 1.00 24.81 O ATOM 77 CB ALA A 35 -24.118 -42.499 13.016 1.00 18.52 C ATOM 78 H ALA A 35 -21.949 -42.227 11.690 1.00 0.00 H ATOM 79 N ALA A 36 -23.900 -44.569 10.496 1.00 18.02 N ATOM 80 CA ALA A 36 -24.592 -45.508 9.619 1.00 19.33 C ATOM 81 C ALA A 36 -23.944 -46.882 9.625 1.00 19.17 C ATOM 82 O ALA A 36 -24.567 -47.851 9.180 1.00 20.39 O ATOM 83 CB ALA A 36 -24.617 -44.942 8.202 1.00 21.32 C ATOM 84 H ALA A 36 -23.341 -43.794 10.084 1.00 0.00 H ATOM 85 N ALA A 37 -22.714 -46.979 10.094 1.00 19.16 N ATOM 86 CA ALA A 37 -21.905 -48.187 9.992 1.00 21.78 C ATOM 87 C ALA A 37 -22.053 -49.125 11.172 1.00 22.58 C ATOM 88 O ALA A 37 -21.349 -50.150 11.215 1.00 23.80 O ATOM 89 CB ALA A 37 -20.431 -47.818 9.803 1.00 23.42 C ATOM 90 H ALA A 37 -22.299 -46.148 10.562 1.00 0.00 H ATOM 91 N GLY A 38 -22.879 -48.788 12.162 1.00 22.00 N ATOM 92 CA GLY A 38 -23.237 -49.725 13.206 1.00 22.89 C ATOM 93 C GLY A 38 -22.100 -50.354 13.984 1.00 22.34 C ATOM 94 O GLY A 38 -22.196 -51.527 14.347 1.00 24.05 O ATOM 95 H GLY A 38 -23.277 -47.827 12.185 1.00 0.00 H ATOM 96 N GLY A 39 -21.019 -49.591 14.258 1.00 20.01 N ATOM 97 CA GLY A 39 -19.965 -50.096 15.123 1.00 21.78 C ATOM 98 C GLY A 39 -18.907 -50.952 14.452 1.00 21.13 C ATOM 99 O GLY A 39 -18.156 -51.639 15.155 1.00 23.18 O ATOM 100 H GLY A 39 -20.941 -48.638 13.848 1.00 0.00 H ATOM 101 N GLU A 40 -18.922 -51.039 13.129 1.00 16.95 N ATOM 102 CA GLU A 40 -18.131 -52.045 12.417 1.00 15.61 C ATOM 103 C GLU A 40 -16.843 -51.527 11.785 1.00 14.79 C ATOM 104 O GLU A 40 -16.143 -52.330 11.140 1.00 15.89 O ATOM 105 CB GLU A 40 -18.992 -52.683 11.315 1.00 16.98 C ATOM 106 CG GLU A 40 -20.264 -53.362 11.778 1.00 20.56 C ATOM 107 CD GLU A 40 -20.034 -54.669 12.534 1.00 24.05 C ATOM 108 OE1 GLU A 40 -18.911 -55.206 12.457 1.00 25.21 O ATOM 109 OE2 GLU A 40 -20.990 -55.213 13.160 1.00 26.85 O ATOM 110 H GLU A 40 -19.510 -50.377 12.584 1.00 0.00 H ATOM 111 N LEU A 41 -16.499 -50.254 11.927 1.00 13.49 N ATOM 112 CA LEU A 41 -15.417 -49.668 11.137 1.00 12.93 C ATOM 113 C LEU A 41 -14.029 -49.852 11.743 1.00 13.03 C ATOM 114 O LEU A 41 -13.032 -49.671 11.016 1.00 13.39 O ATOM 115 CB LEU A 41 -15.662 -48.168 10.912 1.00 12.94 C ATOM 116 CG LEU A 41 -16.965 -47.840 10.170 1.00 15.09 C ATOM 117 CD1 LEU A 41 -17.136 -46.331 9.926 1.00 15.23 C ATOM 118 CD2 LEU A 41 -17.076 -48.613 8.862 1.00 16.40 C ATOM 119 H LEU A 41 -17.008 -49.661 12.613 1.00 0.00 H ATOM 120 N GLY A 42 -13.918 -50.172 13.035 1.00 12.82 N ATOM 121 CA GLY A 42 -12.629 -50.525 13.604 1.00 13.39 C ATOM 122 C GLY A 42 -11.551 -49.474 13.458 1.00 12.69 C ATOM 123 O GLY A 42 -10.423 -49.781 13.075 1.00 13.13 O ATOM 124 H GLY A 42 -14.764 -50.168 13.640 1.00 0.00 H ATOM 125 N TRP A 43 -11.874 -48.233 13.805 1.00 11.95 N ATOM 126 CA TRP A 43 -10.898 -47.184 13.635 1.00 11.55 C ATOM 127 C TRP A 43 -9.716 -47.346 14.586 1.00 12.97 C ATOM 128 O TRP A 43 -9.826 -47.840 15.710 1.00 14.22 O ATOM 129 CB TRP A 43 -11.546 -45.821 13.865 1.00 10.86 C ATOM 130 CG TRP A 43 -12.506 -45.402 12.798 1.00 9.74 C ATOM 131 CD1 TRP A 43 -12.714 -45.993 11.591 1.00 9.94 C ATOM 132 CD2 TRP A 43 -13.335 -44.219 12.814 1.00 9.72 C ATOM 133 NE1 TRP A 43 -13.641 -45.279 10.851 1.00 11.01 N ATOM 134 CE2 TRP A 43 -14.046 -44.196 11.585 1.00 10.54 C ATOM 135 CE3 TRP A 43 -13.560 -43.207 13.746 1.00 10.24 C ATOM 136 CZ2 TRP A 43 -14.960 -43.183 11.274 1.00 10.93 C ATOM 137 CZ3 TRP A 43 -14.481 -42.183 13.423 1.00 10.44 C ATOM 138 CH2 TRP A 43 -15.168 -42.201 12.214 1.00 11.53 C ATOM 139 HE1 TRP A 43 -13.974 -45.524 9.897 1.00 0.00 H ATOM 140 H TRP A 43 -12.815 -48.021 14.193 1.00 0.00 H ATOM 141 N LEU A 44 -8.577 -46.873 14.109 1.00 12.88 N ATOM 142 CA LEU A 44 -7.307 -46.973 14.813 1.00 13.95 C ATOM 143 C LEU A 44 -7.292 -45.998 15.980 1.00 12.00 C ATOM 144 O LEU A 44 -7.783 -44.870 15.889 1.00 11.73 O ATOM 145 CB LEU A 44 -6.163 -46.651 13.836 1.00 14.91 C ATOM 146 CG LEU A 44 -4.719 -46.683 14.323 1.00 16.48 C ATOM 147 CD1 LEU A 44 -3.739 -46.983 13.196 1.00 17.03 C ATOM 148 CD2 LEU A 44 -4.362 -45.322 14.944 1.00 17.27 C ATOM 149 H LEU A 44 -8.589 -46.404 13.181 1.00 0.00 H ATOM 150 N THR A 45 -6.727 -46.462 17.092 1.00 13.17 N ATOM 151 CA THR A 45 -6.577 -45.644 18.290 1.00 13.41 C ATOM 152 C THR A 45 -5.125 -45.731 18.722 1.00 15.90 C ATOM 153 O THR A 45 -4.492 -46.793 18.634 1.00 18.96 O ATOM 154 CB THR A 45 -7.502 -46.076 19.406 1.00 15.18 C ATOM 155 OG1 THR A 45 -7.258 -47.437 19.765 1.00 16.62 O ATOM 156 CG2 THR A 45 -8.944 -45.903 18.978 1.00 15.28 C ATOM 157 HG1 THR A 45 -7.872 -47.700 20.496 1.00 0.00 H ATOM 158 H THR A 45 -6.380 -47.442 17.107 1.00 0.00 H ATOM 159 N HIS A 46 -4.587 -44.577 19.114 1.00 15.81 N ATOM 160 CA HIS A 46 -3.231 -44.432 19.535 1.00 17.67 C ATOM 161 C HIS A 46 -3.233 -43.492 20.736 1.00 20.60 C ATOM 162 O HIS A 46 -3.762 -42.381 20.637 1.00 20.43 O ATOM 163 CB HIS A 46 -2.410 -43.866 18.367 1.00 20.05 C ATOM 164 CG HIS A 46 -0.995 -43.519 18.697 1.00 29.15 C ATOM 165 ND1 HIS A 46 0.072 -44.281 18.273 1.00 31.31 N ATOM 166 CD2 HIS A 46 -0.462 -42.452 19.341 1.00 30.61 C ATOM 167 CE1 HIS A 46 1.200 -43.724 18.684 1.00 35.42 C ATOM 168 NE2 HIS A 46 0.903 -42.610 19.331 1.00 33.50 N ATOM 169 H HIS A 46 -5.192 -43.731 19.113 1.00 0.00 H ATOM 170 N PRO A 47 -2.617 -43.865 21.852 1.00 25.69 N ATOM 171 CA PRO A 47 -1.772 -45.050 22.034 1.00 31.98 C ATOM 172 C PRO A 47 -2.607 -46.294 22.262 1.00 40.07 C ATOM 173 O PRO A 47 -3.800 -46.202 22.520 1.00 34.68 O ATOM 174 CB PRO A 47 -0.933 -44.710 23.279 1.00 36.82 C ATOM 175 CG PRO A 47 -1.519 -43.459 23.865 1.00 34.98 C ATOM 176 CD PRO A 47 -2.763 -43.101 23.104 1.00 28.31 C ATOM 177 N TYR A 48 -1.967 -47.453 22.158 1.00 55.35 N ATOM 178 CA TYR A 48 -2.615 -48.726 22.446 1.00 67.41 C ATOM 179 C TYR A 48 -3.156 -48.741 23.873 1.00 69.51 C ATOM 180 O TYR A 48 -2.381 -48.696 24.833 1.00 69.46 O ATOM 181 CB TYR A 48 -1.604 -49.853 22.198 1.00 76.14 C ATOM 182 CG TYR A 48 -2.007 -51.224 22.683 1.00 79.49 C ATOM 183 CD1 TYR A 48 -2.869 -52.022 21.944 1.00 79.67 C ATOM 184 CD2 TYR A 48 -1.496 -51.733 23.870 1.00 81.92 C ATOM 185 CE1 TYR A 48 -3.228 -53.281 22.384 1.00 82.09 C ATOM 186 CE2 TYR A 48 -1.848 -52.987 24.318 1.00 84.29 C ATOM 187 CZ TYR A 48 -2.714 -53.759 23.572 1.00 85.26 C ATOM 188 OH TYR A 48 -3.068 -55.013 24.014 1.00 89.39 O ATOM 189 HH TYR A 48 -3.691 -55.427 23.365 1.00 0.00 H ATOM 190 H TYR A 48 -0.970 -47.452 21.861 1.00 0.00 H ATOM 191 N GLY A 49 -4.485 -48.749 24.024 1.00 70.15 N ATOM 192 CA GLY A 49 -5.109 -48.984 25.316 1.00 73.00 C ATOM 193 C GLY A 49 -5.770 -47.820 26.039 1.00 73.60 C ATOM 194 O GLY A 49 -6.907 -47.947 26.506 1.00 72.23 O ATOM 195 H GLY A 49 -5.089 -48.582 23.194 1.00 0.00 H ATOM 196 N LYS A 50 -5.082 -46.681 26.139 1.00 76.39 N ATOM 197 CA LYS A 50 -5.406 -45.691 27.163 1.00 75.74 C ATOM 198 C LYS A 50 -6.628 -44.834 26.843 1.00 58.28 C ATOM 199 O LYS A 50 -7.350 -44.430 27.764 1.00 64.34 O ATOM 200 CB LYS A 50 -4.205 -44.765 27.377 1.00 85.77 C ATOM 201 CG LYS A 50 -2.967 -45.459 27.914 1.00 92.83 C ATOM 202 CD LYS A 50 -1.794 -44.494 28.038 1.00 95.82 C ATOM 203 CE LYS A 50 -0.594 -45.167 28.687 1.00100.32 C ATOM 204 NZ LYS A 50 0.574 -44.249 28.785 1.00102.78 N ATOM 205 HZ1 LYS A 50 0.851 -43.939 27.832 1.00 0.00 H ATOM 206 HZ2 LYS A 50 0.315 -43.421 29.359 1.00 0.00 H ATOM 207 HZ3 LYS A 50 1.369 -44.748 29.233 1.00 0.00 H ATOM 208 H LYS A 50 -4.302 -46.495 25.477 1.00 0.00 H ATOM 209 N GLY A 51 -6.884 -44.559 25.569 1.00 34.85 N ATOM 210 CA GLY A 51 -7.600 -43.357 25.181 1.00 21.01 C ATOM 211 C GLY A 51 -8.993 -43.549 24.623 1.00 16.11 C ATOM 212 O GLY A 51 -9.892 -43.995 25.341 1.00 17.28 O ATOM 213 H GLY A 51 -6.564 -45.220 24.832 1.00 0.00 H ATOM 214 N TRP A 52 -9.189 -43.199 23.352 1.00 14.48 N ATOM 215 CA TRP A 52 -10.481 -43.370 22.707 1.00 14.20 C ATOM 216 C TRP A 52 -10.868 -44.848 22.707 1.00 15.03 C ATOM 217 O TRP A 52 -10.033 -45.736 22.494 1.00 16.21 O ATOM 218 CB TRP A 52 -10.430 -42.866 21.272 1.00 13.69 C ATOM 219 CG TRP A 52 -10.188 -41.397 21.067 1.00 13.51 C ATOM 220 CD1 TRP A 52 -8.988 -40.784 20.829 1.00 14.33 C ATOM 221 CD2 TRP A 52 -11.185 -40.356 21.006 1.00 13.25 C ATOM 222 NE1 TRP A 52 -9.179 -39.430 20.639 1.00 14.14 N ATOM 223 CE2 TRP A 52 -10.517 -39.146 20.738 1.00 14.15 C ATOM 224 CE3 TRP A 52 -12.570 -40.337 21.164 1.00 12.64 C ATOM 225 CZ2 TRP A 52 -11.186 -37.921 20.621 1.00 14.87 C ATOM 226 CZ3 TRP A 52 -13.242 -39.125 21.045 1.00 13.76 C ATOM 227 CH2 TRP A 52 -12.551 -37.931 20.779 1.00 14.75 C ATOM 228 HE1 TRP A 52 -8.428 -38.736 20.451 1.00 0.00 H ATOM 229 H TRP A 52 -8.400 -42.794 22.809 1.00 0.00 H ATOM 230 N ASP A 53 -12.147 -45.111 22.960 1.00 15.02 N ATOM 231 CA ASP A 53 -12.659 -46.472 23.050 1.00 15.85 C ATOM 232 C ASP A 53 -14.009 -46.527 22.357 1.00 15.24 C ATOM 233 O ASP A 53 -14.853 -45.647 22.557 1.00 14.74 O ATOM 234 CB ASP A 53 -12.809 -46.884 24.522 1.00 18.97 C ATOM 235 CG ASP A 53 -12.830 -48.383 24.727 1.00 23.73 C ATOM 236 OD1 ASP A 53 -12.547 -49.127 23.756 1.00 24.60 O ATOM 237 OD2 ASP A 53 -13.114 -48.829 25.874 1.00 28.62 O ATOM 238 H ASP A 53 -12.805 -44.317 23.098 1.00 0.00 H ATOM 239 N LEU A 54 -14.232 -47.566 21.572 1.00 14.77 N ATOM 240 CA LEU A 54 -15.548 -47.772 20.976 1.00 14.09 C ATOM 241 C LEU A 54 -16.500 -48.262 22.052 1.00 14.75 C ATOM 242 O LEU A 54 -16.206 -49.235 22.746 1.00 15.90 O ATOM 243 CB LEU A 54 -15.476 -48.774 19.831 1.00 14.68 C ATOM 244 CG LEU A 54 -16.773 -49.038 19.055 1.00 15.46 C ATOM 245 CD1 LEU A 54 -17.336 -47.796 18.347 1.00 14.02 C ATOM 246 CD2 LEU A 54 -16.497 -50.164 18.060 1.00 17.32 C ATOM 247 H LEU A 54 -13.465 -48.241 21.378 1.00 0.00 H ATOM 248 N MET A 55 -17.633 -47.572 22.210 1.00 14.67 N ATOM 249 CA MET A 55 -18.628 -47.882 23.212 1.00 15.91 C ATOM 250 C MET A 55 -19.999 -48.030 22.563 1.00 15.85 C ATOM 251 O MET A 55 -20.255 -47.521 21.464 1.00 15.60 O ATOM 252 CB MET A 55 -18.721 -46.794 24.285 1.00 18.29 C ATOM 253 CG MET A 55 -17.412 -46.197 24.669 1.00 21.11 C ATOM 254 SD MET A 55 -16.569 -47.207 25.864 1.00 24.04 S ATOM 255 CE MET A 55 -17.618 -47.010 27.321 1.00 26.11 C ATOM 256 H MET A 55 -17.809 -46.766 21.576 1.00 0.00 H ATOM 257 N GLN A 56 -20.874 -48.722 23.278 1.00 17.77 N ATOM 258 CA GLN A 56 -22.263 -48.924 22.898 1.00 20.86 C ATOM 259 C GLN A 56 -23.181 -48.482 24.040 1.00 20.90 C ATOM 260 O GLN A 56 -22.890 -48.701 25.218 1.00 21.79 O ATOM 261 CB GLN A 56 -22.483 -50.403 22.560 1.00 24.48 C ATOM 262 CG GLN A 56 -23.869 -50.804 22.070 1.00 26.34 C ATOM 263 CD GLN A 56 -24.029 -52.317 22.007 1.00 29.04 C ATOM 264 OE1 GLN A 56 -24.312 -52.887 20.946 1.00 32.38 O ATOM 265 NE2 GLN A 56 -23.864 -52.977 23.148 1.00 27.92 N ATOM 266 HE22 GLN A 56 -23.626 -52.460 24.018 1.00 0.00 H ATOM 267 HE21 GLN A 56 -23.972 -54.011 23.171 1.00 0.00 H ATOM 268 H GLN A 56 -20.546 -49.148 24.168 1.00 0.00 H ATOM 269 N ASN A 57 -24.306 -47.896 23.667 1.00 20.27 N ATOM 270 CA ASN A 57 -25.422 -47.631 24.574 1.00 22.08 C ATOM 271 C ASN A 57 -26.648 -48.353 24.030 1.00 23.83 C ATOM 272 O ASN A 57 -26.968 -48.216 22.839 1.00 23.19 O ATOM 273 CB ASN A 57 -25.666 -46.118 24.709 1.00 22.31 C ATOM 274 CG ASN A 57 -26.950 -45.789 25.431 1.00 25.67 C ATOM 275 OD1 ASN A 57 -28.026 -46.223 25.026 1.00 27.26 O ATOM 276 ND2 ASN A 57 -26.846 -45.040 26.538 1.00 27.19 N ATOM 277 HD22 ASN A 57 -25.915 -44.693 26.845 1.00 0.00 H ATOM 278 HD21 ASN A 57 -27.696 -44.806 27.089 1.00 0.00 H ATOM 279 H ASN A 57 -24.403 -47.607 22.673 1.00 0.00 H ATOM 280 N ILE A 58 -27.323 -49.124 24.893 1.00 26.90 N ATOM 281 CA ILE A 58 -28.455 -49.941 24.445 1.00 27.68 C ATOM 282 C ILE A 58 -29.736 -49.597 25.193 1.00 30.67 C ATOM 283 O ILE A 58 -30.602 -50.456 25.388 1.00 33.32 O ATOM 284 CB ILE A 58 -28.138 -51.438 24.607 1.00 31.73 C ATOM 285 CG1 ILE A 58 -27.695 -51.748 26.044 1.00 34.03 C ATOM 286 CG2 ILE A 58 -27.047 -51.833 23.619 1.00 30.99 C ATOM 287 CD1 ILE A 58 -27.646 -53.238 26.370 1.00 38.15 C ATOM 288 H ILE A 58 -27.040 -49.143 25.894 1.00 0.00 H ATOM 289 N MET A 59 -29.874 -48.340 25.614 1.00 32.17 N ATOM 290 CA MET A 59 -31.065 -47.924 26.347 1.00 36.32 C ATOM 291 C MET A 59 -32.220 -47.532 25.439 1.00 37.96 C ATOM 292 O MET A 59 -33.351 -47.412 25.922 1.00 39.50 O ATOM 293 CB MET A 59 -30.712 -46.755 27.272 1.00 37.39 C ATOM 294 CG MET A 59 -29.688 -47.105 28.339 1.00 41.32 C ATOM 295 SD MET A 59 -30.246 -48.435 29.417 1.00 49.42 S ATOM 296 CE MET A 59 -31.641 -47.640 30.216 1.00 54.03 C ATOM 297 H MET A 59 -29.124 -47.647 25.418 1.00 0.00 H ATOM 298 N ASN A 60 -31.973 -47.345 24.146 1.00 38.30 N ATOM 299 CA ASN A 60 -33.020 -46.991 23.207 1.00 43.75 C ATOM 300 C ASN A 60 -33.370 -48.242 22.408 1.00 45.13 C ATOM 301 O ASN A 60 -32.769 -49.303 22.591 1.00 42.38 O ATOM 302 CB ASN A 60 -32.586 -45.864 22.269 1.00 46.33 C ATOM 303 CG ASN A 60 -31.996 -44.668 23.008 1.00 51.18 C ATOM 304 OD1 ASN A 60 -30.778 -44.462 23.023 1.00 52.04 O ATOM 305 ND2 ASN A 60 -32.864 -43.866 23.609 1.00 54.38 N ATOM 306 HD22 ASN A 60 -33.881 -44.078 23.570 1.00 0.00 H ATOM 307 HD21 ASN A 60 -32.528 -43.024 24.119 1.00 0.00 H ATOM 308 H ASN A 60 -30.999 -47.456 23.797 1.00 0.00 H ATOM 309 N ASP A 61 -34.352 -48.115 21.510 1.00 50.08 N ATOM 310 CA ASP A 61 -34.792 -49.270 20.732 1.00 52.17 C ATOM 311 C ASP A 61 -33.628 -49.883 19.961 1.00 46.60 C ATOM 312 O ASP A 61 -33.506 -51.111 19.889 1.00 46.74 O ATOM 313 CB ASP A 61 -35.917 -48.877 19.775 1.00 58.57 C ATOM 314 CG ASP A 61 -37.180 -48.457 20.498 1.00 65.56 C ATOM 315 OD1 ASP A 61 -37.410 -48.930 21.631 1.00 68.39 O ATOM 316 OD2 ASP A 61 -37.948 -47.656 19.925 1.00 69.02 O ATOM 317 H ASP A 61 -34.805 -47.190 21.365 1.00 0.00 H ATOM 318 N MET A 62 -32.753 -49.044 19.391 1.00 42.40 N ATOM 319 CA MET A 62 -31.586 -49.548 18.686 1.00 38.37 C ATOM 320 C MET A 62 -30.304 -49.122 19.393 1.00 32.68 C ATOM 321 O MET A 62 -30.233 -48.031 19.972 1.00 28.90 O ATOM 322 CB MET A 62 -31.493 -49.059 17.232 1.00 42.44 C ATOM 323 CG MET A 62 -32.221 -49.913 16.204 1.00 45.15 C ATOM 324 SD MET A 62 -31.976 -49.271 14.523 1.00 44.31 S ATOM 325 CE MET A 62 -30.208 -49.275 14.345 1.00 40.82 C ATOM 326 H MET A 62 -32.911 -48.018 19.454 1.00 0.00 H ATOM 327 N PRO A 63 -29.268 -49.948 19.330 1.00 31.46 N ATOM 328 CA PRO A 63 -27.982 -49.550 19.915 1.00 28.64 C ATOM 329 C PRO A 63 -27.416 -48.306 19.262 1.00 27.38 C ATOM 330 O PRO A 63 -27.604 -48.054 18.070 1.00 28.79 O ATOM 331 CB PRO A 63 -27.074 -50.755 19.655 1.00 29.94 C ATOM 332 CG PRO A 63 -27.992 -51.886 19.425 1.00 34.91 C ATOM 333 CD PRO A 63 -29.217 -51.312 18.785 1.00 36.26 C ATOM 334 N ILE A 64 -26.716 -47.533 20.086 1.00 25.08 N ATOM 335 CA ILE A 64 -25.977 -46.338 19.686 1.00 26.52 C ATOM 336 C ILE A 64 -24.498 -46.647 19.862 1.00 22.40 C ATOM 337 O ILE A 64 -24.103 -47.203 20.895 1.00 23.73 O ATOM 338 CB ILE A 64 -26.388 -45.127 20.545 1.00 38.42 C ATOM 339 CG1 ILE A 64 -27.875 -44.817 20.366 1.00 46.68 C ATOM 340 CG2 ILE A 64 -25.525 -43.925 20.216 1.00 40.55 C ATOM 341 CD1 ILE A 64 -28.410 -43.798 21.363 1.00 53.69 C ATOM 342 H ILE A 64 -26.693 -47.799 21.091 1.00 0.00 H ATOM 343 N TYR A 65 -23.676 -46.314 18.863 1.00 17.99 N ATOM 344 CA TYR A 65 -22.231 -46.451 18.978 1.00 15.78 C ATOM 345 C TYR A 65 -21.544 -45.090 19.048 1.00 14.92 C ATOM 346 O TYR A 65 -22.083 -44.067 18.629 1.00 15.47 O ATOM 347 CB TYR A 65 -21.667 -47.275 17.800 1.00 14.88 C ATOM 348 CG TYR A 65 -22.254 -48.656 17.790 1.00 16.74 C ATOM 349 CD1 TYR A 65 -21.778 -49.648 18.639 1.00 17.67 C ATOM 350 CD2 TYR A 65 -23.367 -48.951 17.027 1.00 16.95 C ATOM 351 CE1 TYR A 65 -22.348 -50.872 18.685 1.00 19.53 C ATOM 352 CE2 TYR A 65 -23.952 -50.189 17.073 1.00 19.21 C ATOM 353 CZ TYR A 65 -23.433 -51.151 17.907 1.00 20.88 C ATOM 354 OH TYR A 65 -24.007 -52.394 17.985 1.00 24.56 O ATOM 355 HH TYR A 65 -23.986 -52.822 17.093 1.00 0.00 H ATOM 356 H TYR A 65 -24.080 -45.946 17.978 1.00 0.00 H ATOM 357 N MET A 66 -20.343 -45.079 19.614 1.00 13.82 N ATOM 358 CA MET A 66 -19.591 -43.847 19.752 1.00 12.94 C ATOM 359 C MET A 66 -18.143 -44.204 20.018 1.00 12.81 C ATOM 360 O MET A 66 -17.831 -45.288 20.525 1.00 14.35 O ATOM 361 CB MET A 66 -20.143 -42.987 20.897 1.00 14.21 C ATOM 362 CG MET A 66 -20.002 -43.688 22.236 1.00 16.00 C ATOM 363 SD MET A 66 -21.143 -43.171 23.514 1.00 18.06 S ATOM 364 CE MET A 66 -22.636 -43.872 22.814 1.00 18.49 C ATOM 365 H MET A 66 -19.935 -45.969 19.964 1.00 0.00 H ATOM 366 N TYR A 67 -17.270 -43.256 19.749 1.00 11.75 N ATOM 367 CA TYR A 67 -15.924 -43.288 20.311 1.00 12.17 C ATOM 368 C TYR A 67 -15.869 -42.257 21.426 1.00 12.71 C ATOM 369 O TYR A 67 -16.149 -41.077 21.191 1.00 13.14 O ATOM 370 CB TYR A 67 -14.866 -42.983 19.236 1.00 11.04 C ATOM 371 CG TYR A 67 -14.592 -44.169 18.352 1.00 11.59 C ATOM 372 CD1 TYR A 67 -13.785 -45.190 18.805 1.00 13.45 C ATOM 373 CD2 TYR A 67 -15.129 -44.276 17.070 1.00 11.41 C ATOM 374 CE1 TYR A 67 -13.559 -46.306 18.047 1.00 13.48 C ATOM 375 CE2 TYR A 67 -14.882 -45.412 16.291 1.00 11.37 C ATOM 376 CZ TYR A 67 -14.079 -46.398 16.787 1.00 12.35 C ATOM 377 OH TYR A 67 -13.833 -47.544 16.044 1.00 14.20 O ATOM 378 HH TYR A 67 -13.235 -48.145 16.555 1.00 0.00 H ATOM 379 H TYR A 67 -17.545 -42.471 19.125 1.00 0.00 H ATOM 380 N SER A 68 -15.494 -42.691 22.625 1.00 13.49 N ATOM 381 CA SER A 68 -15.500 -41.813 23.784 1.00 14.52 C ATOM 382 C SER A 68 -14.189 -41.911 24.546 1.00 13.93 C ATOM 383 O SER A 68 -13.553 -42.967 24.605 1.00 14.05 O ATOM 384 CB SER A 68 -16.654 -42.149 24.728 1.00 17.10 C ATOM 385 OG SER A 68 -16.418 -43.381 25.382 1.00 19.12 O ATOM 386 HG SER A 68 -17.175 -43.582 25.988 1.00 0.00 H ATOM 387 H SER A 68 -15.190 -43.679 22.737 1.00 0.00 H ATOM 388 N VAL A 69 -13.802 -40.792 25.146 1.00 14.46 N ATOM 389 CA VAL A 69 -12.640 -40.727 26.022 1.00 15.17 C ATOM 390 C VAL A 69 -12.957 -39.764 27.150 1.00 16.08 C ATOM 391 O VAL A 69 -13.661 -38.771 26.950 1.00 16.40 O ATOM 392 CB VAL A 69 -11.380 -40.309 25.237 1.00 17.06 C ATOM 393 CG1 VAL A 69 -11.543 -38.904 24.609 1.00 16.63 C ATOM 394 CG2 VAL A 69 -10.165 -40.443 26.116 1.00 19.95 C ATOM 395 H VAL A 69 -14.352 -39.924 24.984 1.00 0.00 H ATOM 396 N CYS A 70 -12.471 -40.073 28.338 1.00 16.33 N ATOM 397 CA CYS A 70 -12.798 -39.244 29.500 1.00 17.91 C ATOM 398 C CYS A 70 -11.701 -39.367 30.555 1.00 20.79 C ATOM 399 O CYS A 70 -11.962 -39.617 31.727 1.00 23.47 O ATOM 400 CB CYS A 70 -14.167 -39.615 30.069 1.00 19.11 C ATOM 401 SG CYS A 70 -14.776 -38.444 31.331 1.00 22.37 S ATOM 402 H CYS A 70 -11.856 -40.905 28.449 1.00 0.00 H ATOM 403 N ASN A 71 -10.456 -39.150 30.138 1.00 23.35 N ATOM 404 CA ASN A 71 -9.307 -39.240 31.043 1.00 26.20 C ATOM 405 C ASN A 71 -9.020 -37.892 31.691 1.00 28.31 C ATOM 406 O ASN A 71 -7.940 -37.312 31.566 1.00 31.62 O ATOM 407 CB ASN A 71 -8.076 -39.736 30.298 1.00 24.84 C ATOM 408 CG ASN A 71 -8.170 -41.182 29.932 1.00 26.15 C ATOM 409 OD1 ASN A 71 -8.993 -41.922 30.470 1.00 27.77 O ATOM 410 ND2 ASN A 71 -7.332 -41.599 29.019 1.00 24.49 N ATOM 411 HD22 ASN A 71 -6.654 -40.935 28.593 1.00 0.00 H ATOM 412 HD21 ASN A 71 -7.343 -42.595 28.719 1.00 0.00 H ATOM 413 H ASN A 71 -10.294 -38.909 29.139 1.00 0.00 H ATOM 414 N VAL A 72 -10.032 -37.380 32.360 1.00 27.06 N ATOM 415 CA VAL A 72 -9.858 -36.193 33.157 1.00 27.70 C ATOM 416 C VAL A 72 -9.183 -36.581 34.477 1.00 33.00 C ATOM 417 O VAL A 72 -9.207 -37.735 34.907 1.00 33.63 O ATOM 418 CB VAL A 72 -11.218 -35.502 33.357 1.00 30.62 C ATOM 419 CG1 VAL A 72 -11.876 -35.215 31.996 1.00 30.65 C ATOM 420 CG2 VAL A 72 -12.140 -36.340 34.210 1.00 29.78 C ATOM 421 H VAL A 72 -10.965 -37.837 32.312 1.00 0.00 H ATOM 422 N MET A 73 -8.536 -35.618 35.121 1.00 35.99 N ATOM 423 CA MET A 73 -7.782 -35.876 36.354 1.00 42.29 C ATOM 424 C MET A 73 -6.648 -36.891 36.169 1.00 41.07 C ATOM 425 O MET A 73 -6.331 -37.639 37.101 1.00 42.26 O ATOM 426 CB MET A 73 -8.680 -36.421 37.472 1.00 50.60 C ATOM 427 CG MET A 73 -9.783 -35.522 37.952 1.00 59.26 C ATOM 428 SD MET A 73 -10.042 -35.477 39.747 1.00 67.28 S ATOM 429 CE MET A 73 -9.301 -37.002 40.343 1.00 69.61 C ATOM 430 H MET A 73 -8.564 -34.651 34.741 1.00 0.00 H ATOM 431 N SER A 74 -5.989 -36.923 35.008 1.00 41.99 N ATOM 432 CA SER A 74 -4.986 -37.958 34.767 1.00 47.47 C ATOM 433 C SER A 74 -3.752 -37.403 34.068 1.00 50.58 C ATOM 434 O SER A 74 -3.079 -38.121 33.317 1.00 50.41 O ATOM 435 CB SER A 74 -5.570 -39.107 33.937 1.00 49.02 C ATOM 436 OG SER A 74 -5.631 -40.298 34.701 1.00 53.17 O ATOM 437 HG SER A 74 -6.010 -41.025 34.147 1.00 0.00 H ATOM 438 H SER A 74 -6.189 -36.212 34.276 1.00 0.00 H ATOM 439 N GLY A 75 -3.430 -36.142 34.310 1.00 54.87 N ATOM 440 CA GLY A 75 -2.267 -35.558 33.693 1.00 59.64 C ATOM 441 C GLY A 75 -2.471 -35.337 32.202 1.00 59.99 C ATOM 442 O GLY A 75 -3.574 -35.431 31.661 1.00 56.44 O ATOM 443 H GLY A 75 -4.019 -35.571 34.948 1.00 0.00 H ATOM 444 N ASP A 76 -1.355 -35.053 31.538 1.00 64.39 N ATOM 445 CA ASP A 76 -1.395 -34.680 30.134 1.00 64.86 C ATOM 446 C ASP A 76 -1.867 -35.862 29.295 1.00 49.04 C ATOM 447 O ASP A 76 -1.432 -37.001 29.481 1.00 48.95 O ATOM 448 CB ASP A 76 -0.020 -34.194 29.682 1.00 80.52 C ATOM 449 CG ASP A 76 -0.013 -33.704 28.245 1.00 92.61 C ATOM 450 OD1 ASP A 76 -1.067 -33.770 27.577 1.00 95.62 O ATOM 451 OD2 ASP A 76 1.052 -33.235 27.787 1.00 98.51 O ATOM 452 H ASP A 76 -0.440 -35.098 32.030 1.00 0.00 H ATOM 453 N GLN A 77 -2.776 -35.571 28.373 1.00 36.62 N ATOM 454 CA GLN A 77 -3.396 -36.555 27.498 1.00 27.49 C ATOM 455 C GLN A 77 -3.112 -36.180 26.063 1.00 23.76 C ATOM 456 O GLN A 77 -3.117 -34.995 25.706 1.00 24.91 O ATOM 457 CB GLN A 77 -4.909 -36.612 27.685 1.00 24.81 C ATOM 458 CG GLN A 77 -5.320 -37.035 29.047 1.00 25.17 C ATOM 459 CD GLN A 77 -4.974 -38.466 29.324 1.00 26.66 C ATOM 460 OE1 GLN A 77 -5.279 -39.352 28.535 1.00 21.36 O ATOM 461 NE2 GLN A 77 -4.304 -38.703 30.439 1.00 33.19 N ATOM 462 HE22 GLN A 77 -4.067 -37.919 31.080 1.00 0.00 H ATOM 463 HE21 GLN A 77 -4.014 -39.673 30.675 1.00 0.00 H ATOM 464 H GLN A 77 -3.064 -34.577 28.269 1.00 0.00 H ATOM 465 N ASP A 78 -2.864 -37.189 25.235 1.00 21.13 N ATOM 466 CA ASP A 78 -2.624 -36.968 23.822 1.00 20.30 C ATOM 467 C ASP A 78 -3.129 -38.215 23.103 1.00 18.47 C ATOM 468 O ASP A 78 -2.365 -39.073 22.652 1.00 20.31 O ATOM 469 CB ASP A 78 -1.140 -36.672 23.566 1.00 22.03 C ATOM 470 CG ASP A 78 -0.826 -36.380 22.096 1.00 24.54 C ATOM 471 OD1 ASP A 78 -1.695 -35.923 21.335 1.00 23.63 O ATOM 472 OD2 ASP A 78 0.350 -36.580 21.727 1.00 27.33 O ATOM 473 H ASP A 78 -2.841 -38.159 25.609 1.00 0.00 H ATOM 474 N ASN A 79 -4.449 -38.331 23.017 1.00 16.19 N ATOM 475 CA ASN A 79 -5.108 -39.541 22.525 1.00 14.78 C ATOM 476 C ASN A 79 -5.656 -39.333 21.122 1.00 13.86 C ATOM 477 O ASN A 79 -6.374 -38.361 20.862 1.00 14.23 O ATOM 478 CB ASN A 79 -6.245 -39.954 23.467 1.00 15.00 C ATOM 479 CG ASN A 79 -5.773 -40.142 24.861 1.00 16.48 C ATOM 480 OD1 ASN A 79 -4.861 -40.930 25.108 1.00 18.90 O ATOM 481 ND2 ASN A 79 -6.363 -39.394 25.806 1.00 16.86 N ATOM 482 HD22 ASN A 79 -7.131 -38.741 25.549 1.00 0.00 H ATOM 483 HD21 ASN A 79 -6.053 -39.467 26.796 1.00 0.00 H ATOM 484 H ASN A 79 -5.040 -37.527 23.312 1.00 0.00 H ATOM 485 N TRP A 80 -5.360 -40.269 20.212 1.00 13.76 N ATOM 486 CA TRP A 80 -5.710 -40.111 18.814 1.00 12.38 C ATOM 487 C TRP A 80 -6.623 -41.218 18.319 1.00 11.79 C ATOM 488 O TRP A 80 -6.475 -42.387 18.702 1.00 12.79 O ATOM 489 CB TRP A 80 -4.463 -40.077 17.933 1.00 12.56 C ATOM 490 CG TRP A 80 -3.646 -38.846 18.097 1.00 14.05 C ATOM 491 CD1 TRP A 80 -2.833 -38.549 19.135 1.00 15.37 C ATOM 492 CD2 TRP A 80 -3.589 -37.727 17.195 1.00 14.80 C ATOM 493 NE1 TRP A 80 -2.250 -37.306 18.939 1.00 16.02 N ATOM 494 CE2 TRP A 80 -2.719 -36.793 17.758 1.00 15.53 C ATOM 495 CE3 TRP A 80 -4.199 -37.434 15.971 1.00 15.56 C ATOM 496 CZ2 TRP A 80 -2.401 -35.582 17.116 1.00 15.87 C ATOM 497 CZ3 TRP A 80 -3.915 -36.229 15.356 1.00 15.44 C ATOM 498 CH2 TRP A 80 -3.017 -35.320 15.931 1.00 15.71 C ATOM 499 HE1 TRP A 80 -1.573 -36.843 19.578 1.00 0.00 H ATOM 500 H TRP A 80 -4.866 -41.132 20.516 1.00 0.00 H ATOM 501 N LEU A 81 -7.562 -40.828 17.479 1.00 10.76 N ATOM 502 CA LEU A 81 -8.518 -41.698 16.807 1.00 11.42 C ATOM 503 C LEU A 81 -8.425 -41.386 15.325 1.00 10.88 C ATOM 504 O LEU A 81 -8.535 -40.221 14.962 1.00 10.91 O ATOM 505 CB LEU A 81 -9.915 -41.382 17.301 1.00 11.24 C ATOM 506 CG LEU A 81 -11.100 -42.065 16.660 1.00 11.55 C ATOM 507 CD1 LEU A 81 -11.111 -43.540 16.966 1.00 12.66 C ATOM 508 CD2 LEU A 81 -12.368 -41.386 17.163 1.00 11.33 C ATOM 509 H LEU A 81 -7.626 -39.809 17.279 1.00 0.00 H ATOM 510 N ARG A 82 -8.187 -42.377 14.480 1.00 9.08 N ATOM 511 CA ARG A 82 -8.002 -42.141 13.042 1.00 9.30 C ATOM 512 C ARG A 82 -9.007 -42.944 12.240 1.00 10.08 C ATOM 513 O ARG A 82 -9.095 -44.174 12.412 1.00 11.35 O ATOM 514 CB ARG A 82 -6.589 -42.492 12.584 1.00 9.98 C ATOM 515 CG ARG A 82 -6.248 -41.993 11.170 1.00 10.11 C ATOM 516 CD ARG A 82 -5.249 -42.851 10.468 1.00 11.17 C ATOM 517 NE ARG A 82 -5.843 -44.156 10.179 1.00 10.79 N ATOM 518 CZ ARG A 82 -5.135 -45.219 9.799 1.00 12.58 C ATOM 519 NH1 ARG A 82 -3.832 -45.116 9.610 1.00 13.19 N ATOM 520 NH2 ARG A 82 -5.744 -46.392 9.615 1.00 13.81 N ATOM 521 HE ARG A 82 -6.873 -44.260 10.275 1.00 0.00 H ATOM 522 HH12 ARG A 82 -3.282 -45.948 9.313 1.00 0.00 H ATOM 523 HH11 ARG A 82 -3.356 -44.203 9.758 1.00 0.00 H ATOM 524 HH22 ARG A 82 -5.193 -47.223 9.318 1.00 0.00 H ATOM 525 HH21 ARG A 82 -6.769 -46.475 9.768 1.00 0.00 H ATOM 526 H ARG A 82 -8.129 -43.349 14.844 1.00 0.00 H ATOM 527 N THR A 83 -9.714 -42.285 11.319 1.00 9.83 N ATOM 528 CA THR A 83 -10.606 -43.009 10.427 1.00 9.96 C ATOM 529 C THR A 83 -9.791 -43.952 9.536 1.00 10.10 C ATOM 530 O THR A 83 -8.576 -43.824 9.406 1.00 11.07 O ATOM 531 CB THR A 83 -11.435 -42.070 9.524 1.00 10.31 C ATOM 532 OG1 THR A 83 -10.592 -41.451 8.540 1.00 11.18 O ATOM 533 CG2 THR A 83 -12.204 -41.003 10.318 1.00 10.34 C ATOM 534 HG1 THR A 83 -10.172 -42.151 7.980 1.00 0.00 H ATOM 535 H THR A 83 -9.627 -41.252 11.239 1.00 0.00 H ATOM 536 N ASN A 84 -10.469 -44.894 8.902 1.00 9.97 N ATOM 537 CA ASN A 84 -9.853 -45.597 7.790 1.00 10.53 C ATOM 538 C ASN A 84 -9.636 -44.630 6.615 1.00 10.56 C ATOM 539 O ASN A 84 -10.165 -43.519 6.563 1.00 11.32 O ATOM 540 CB ASN A 84 -10.695 -46.812 7.383 1.00 11.89 C ATOM 541 CG ASN A 84 -10.967 -47.728 8.546 1.00 12.28 C ATOM 542 OD1 ASN A 84 -10.124 -47.911 9.429 1.00 13.34 O ATOM 543 ND2 ASN A 84 -12.151 -48.345 8.563 1.00 13.29 N ATOM 544 HD22 ASN A 84 -12.840 -48.169 7.804 1.00 0.00 H ATOM 545 HD21 ASN A 84 -12.384 -49.001 9.335 1.00 0.00 H ATOM 546 H ASN A 84 -11.438 -45.130 9.198 1.00 0.00 H ATOM 547 N TRP A 85 -8.849 -45.076 5.652 1.00 11.74 N ATOM 548 CA TRP A 85 -8.614 -44.289 4.460 1.00 12.10 C ATOM 549 C TRP A 85 -9.928 -44.100 3.718 1.00 12.52 C ATOM 550 O TRP A 85 -10.741 -45.030 3.629 1.00 14.83 O ATOM 551 CB TRP A 85 -7.589 -45.013 3.611 1.00 13.13 C ATOM 552 CG TRP A 85 -7.022 -44.302 2.417 1.00 16.78 C ATOM 553 CD1 TRP A 85 -6.023 -43.381 2.400 1.00 18.29 C ATOM 554 CD2 TRP A 85 -7.394 -44.526 1.063 1.00 19.13 C ATOM 555 NE1 TRP A 85 -5.725 -43.043 1.086 1.00 19.46 N ATOM 556 CE2 TRP A 85 -6.584 -43.714 0.261 1.00 22.98 C ATOM 557 CE3 TRP A 85 -8.347 -45.339 0.457 1.00 24.16 C ATOM 558 CZ2 TRP A 85 -6.697 -43.691 -1.132 1.00 28.05 C ATOM 559 CZ3 TRP A 85 -8.465 -45.318 -0.923 1.00 28.79 C ATOM 560 CH2 TRP A 85 -7.648 -44.493 -1.701 1.00 31.17 C ATOM 561 HE1 TRP A 85 -4.975 -42.390 0.781 1.00 0.00 H ATOM 562 H TRP A 85 -8.392 -46.005 5.752 1.00 0.00 H ATOM 563 N VAL A 86 -10.126 -42.880 3.210 1.00 13.28 N ATOM 564 CA VAL A 86 -11.303 -42.483 2.471 1.00 13.65 C ATOM 565 C VAL A 86 -10.887 -42.181 1.042 1.00 14.80 C ATOM 566 O VAL A 86 -10.093 -41.258 0.803 1.00 15.26 O ATOM 567 CB VAL A 86 -11.978 -41.253 3.100 1.00 15.37 C ATOM 568 CG1 VAL A 86 -13.250 -40.892 2.328 1.00 17.58 C ATOM 569 CG2 VAL A 86 -12.228 -41.461 4.592 1.00 15.71 C ATOM 570 H VAL A 86 -9.383 -42.168 3.356 1.00 0.00 H ATOM 571 N TYR A 87 -11.488 -42.905 0.102 1.00 16.61 N ATOM 572 CA TYR A 87 -11.294 -42.673 -1.326 1.00 18.57 C ATOM 573 C TYR A 87 -11.977 -41.364 -1.716 1.00 18.88 C ATOM 574 O TYR A 87 -13.181 -41.189 -1.494 1.00 20.86 O ATOM 575 CB TYR A 87 -11.862 -43.869 -2.097 1.00 25.57 C ATOM 576 CG TYR A 87 -11.670 -43.914 -3.596 1.00 37.11 C ATOM 577 CD1 TYR A 87 -10.551 -44.520 -4.154 1.00 46.44 C ATOM 578 CD2 TYR A 87 -12.645 -43.420 -4.453 1.00 40.52 C ATOM 579 CE1 TYR A 87 -10.386 -44.593 -5.530 1.00 50.56 C ATOM 580 CE2 TYR A 87 -12.488 -43.486 -5.827 1.00 44.46 C ATOM 581 CZ TYR A 87 -11.356 -44.076 -6.358 1.00 50.28 C ATOM 582 OH TYR A 87 -11.185 -44.154 -7.723 1.00 55.86 O ATOM 583 HH TYR A 87 -10.326 -44.604 -7.922 1.00 0.00 H ATOM 584 H TYR A 87 -12.125 -43.672 0.398 1.00 0.00 H ATOM 585 N ARG A 88 -11.202 -40.437 -2.272 1.00 18.05 N ATOM 586 CA ARG A 88 -11.707 -39.104 -2.589 1.00 20.93 C ATOM 587 C ARG A 88 -12.627 -39.114 -3.803 1.00 20.37 C ATOM 588 O ARG A 88 -13.602 -38.355 -3.852 1.00 20.88 O ATOM 589 CB ARG A 88 -10.500 -38.177 -2.817 1.00 24.34 C ATOM 590 CG ARG A 88 -10.766 -36.863 -3.491 1.00 25.27 C ATOM 591 CD ARG A 88 -9.499 -36.007 -3.544 1.00 23.65 C ATOM 592 NE ARG A 88 -8.721 -36.165 -4.761 1.00 25.21 N ATOM 593 CZ ARG A 88 -9.013 -35.566 -5.908 1.00 31.15 C ATOM 594 NH1 ARG A 88 -10.072 -34.770 -5.990 1.00 30.81 N ATOM 595 NH2 ARG A 88 -8.254 -35.758 -6.982 1.00 36.09 N ATOM 596 HE ARG A 88 -7.886 -36.784 -4.731 1.00 0.00 H ATOM 597 HH12 ARG A 88 -10.301 -34.300 -6.889 1.00 0.00 H ATOM 598 HH11 ARG A 88 -10.673 -34.616 -5.155 1.00 0.00 H ATOM 599 HH22 ARG A 88 -8.490 -35.284 -7.877 1.00 0.00 H ATOM 600 HH21 ARG A 88 -7.424 -36.382 -6.927 1.00 0.00 H ATOM 601 H ARG A 88 -10.211 -40.667 -2.487 1.00 0.00 H ATOM 602 N GLY A 89 -12.333 -39.944 -4.800 1.00 21.36 N ATOM 603 CA GLY A 89 -13.103 -39.896 -6.029 1.00 22.28 C ATOM 604 C GLY A 89 -13.032 -38.509 -6.640 1.00 23.16 C ATOM 605 O GLY A 89 -11.954 -37.911 -6.753 1.00 24.21 O ATOM 606 H GLY A 89 -11.554 -40.625 -4.699 1.00 0.00 H ATOM 607 N GLU A 90 -14.196 -37.954 -6.972 1.00 23.56 N ATOM 608 CA GLU A 90 -14.289 -36.663 -7.636 1.00 27.25 C ATOM 609 C GLU A 90 -14.274 -35.487 -6.672 1.00 23.73 C ATOM 610 O GLU A 90 -14.231 -34.333 -7.122 1.00 26.31 O ATOM 611 CB GLU A 90 -15.584 -36.577 -8.447 1.00 40.46 C ATOM 612 CG GLU A 90 -15.669 -37.547 -9.597 1.00 57.38 C ATOM 613 CD GLU A 90 -16.827 -37.219 -10.512 1.00 72.82 C ATOM 614 OE1 GLU A 90 -17.890 -36.806 -9.998 1.00 76.87 O ATOM 615 OE2 GLU A 90 -16.668 -37.358 -11.742 1.00 79.38 O ATOM 616 H GLU A 90 -15.074 -38.464 -6.748 1.00 0.00 H ATOM 617 N ALA A 91 -14.302 -35.757 -5.378 1.00 20.57 N ATOM 618 CA ALA A 91 -14.403 -34.696 -4.386 1.00 20.26 C ATOM 619 C ALA A 91 -13.183 -33.780 -4.430 1.00 21.35 C ATOM 620 O ALA A 91 -12.042 -34.241 -4.410 1.00 23.36 O ATOM 621 CB ALA A 91 -14.549 -35.304 -2.994 1.00 18.93 C ATOM 622 H ALA A 91 -14.251 -36.747 -5.063 1.00 0.00 H ATOM 623 N GLU A 92 -13.431 -32.483 -4.451 1.00 21.16 N ATOM 624 CA GLU A 92 -12.379 -31.481 -4.321 1.00 26.16 C ATOM 625 C GLU A 92 -12.484 -30.703 -3.030 1.00 20.56 C ATOM 626 O GLU A 92 -11.461 -30.352 -2.427 1.00 21.97 O ATOM 627 CB GLU A 92 -12.437 -30.502 -5.495 1.00 41.87 C ATOM 628 CG GLU A 92 -12.301 -31.149 -6.861 1.00 61.47 C ATOM 629 CD GLU A 92 -12.501 -30.152 -7.988 1.00 78.76 C ATOM 630 OE1 GLU A 92 -12.872 -28.995 -7.698 1.00 83.86 O ATOM 631 OE2 GLU A 92 -12.297 -30.526 -9.163 1.00 85.37 O ATOM 632 H GLU A 92 -14.414 -32.164 -4.565 1.00 0.00 H ATOM 633 N ARG A 93 -13.695 -30.442 -2.551 1.00 20.02 N ATOM 634 CA ARG A 93 -13.892 -29.750 -1.280 1.00 19.09 C ATOM 635 C ARG A 93 -14.926 -30.534 -0.484 1.00 17.10 C ATOM 636 O ARG A 93 -16.062 -30.705 -0.949 1.00 18.33 O ATOM 637 CB ARG A 93 -14.319 -28.295 -1.506 1.00 19.46 C ATOM 638 CG ARG A 93 -13.173 -27.390 -2.063 1.00 21.65 C ATOM 639 CD ARG A 93 -13.540 -25.915 -2.255 1.00 24.29 C ATOM 640 NE ARG A 93 -12.498 -25.145 -2.953 1.00 25.22 N ATOM 641 CZ ARG A 93 -11.537 -24.429 -2.358 1.00 21.60 C ATOM 642 NH1 ARG A 93 -11.438 -24.385 -1.040 1.00 22.26 N ATOM 643 NH2 ARG A 93 -10.651 -23.755 -3.088 1.00 24.00 N ATOM 644 HE ARG A 93 -12.510 -25.158 -3.993 1.00 0.00 H ATOM 645 HH12 ARG A 93 -10.685 -23.824 -0.594 1.00 0.00 H ATOM 646 HH11 ARG A 93 -12.113 -24.912 -0.450 1.00 0.00 H ATOM 647 HH22 ARG A 93 -9.906 -23.200 -2.620 1.00 0.00 H ATOM 648 HH21 ARG A 93 -10.704 -23.783 -4.126 1.00 0.00 H ATOM 649 H ARG A 93 -14.528 -30.739 -3.098 1.00 0.00 H ATOM 650 N ILE A 94 -14.513 -31.035 0.698 1.00 15.96 N ATOM 651 CA ILE A 94 -15.321 -31.909 1.531 1.00 15.70 C ATOM 652 C ILE A 94 -15.847 -31.112 2.715 1.00 15.12 C ATOM 653 O ILE A 94 -15.278 -30.103 3.147 1.00 16.01 O ATOM 654 CB ILE A 94 -14.561 -33.169 2.025 1.00 15.02 C ATOM 655 CG1 ILE A 94 -13.300 -32.809 2.815 1.00 14.92 C ATOM 656 CG2 ILE A 94 -14.239 -34.128 0.859 1.00 17.23 C ATOM 657 CD1 ILE A 94 -12.634 -33.986 3.478 1.00 15.46 C ATOM 658 H ILE A 94 -13.562 -30.781 1.032 1.00 0.00 H ATOM 659 N PHE A 95 -16.967 -31.593 3.228 1.00 14.57 N ATOM 660 CA PHE A 95 -17.635 -31.082 4.412 1.00 14.35 C ATOM 661 C PHE A 95 -17.632 -32.202 5.435 1.00 13.12 C ATOM 662 O PHE A 95 -17.976 -33.349 5.105 1.00 12.76 O ATOM 663 CB PHE A 95 -19.061 -30.663 4.071 1.00 15.06 C ATOM 664 CG PHE A 95 -19.133 -29.546 3.071 1.00 18.11 C ATOM 665 CD1 PHE A 95 -18.954 -29.808 1.726 1.00 19.99 C ATOM 666 CD2 PHE A 95 -19.352 -28.256 3.478 1.00 19.18 C ATOM 667 CE1 PHE A 95 -19.009 -28.783 0.798 1.00 22.05 C ATOM 668 CE2 PHE A 95 -19.416 -27.228 2.562 1.00 20.88 C ATOM 669 CZ PHE A 95 -19.235 -27.497 1.213 1.00 22.23 C ATOM 670 H PHE A 95 -17.405 -32.403 2.744 1.00 0.00 H ATOM 671 N ILE A 96 -17.230 -31.872 6.662 1.00 12.76 N ATOM 672 CA ILE A 96 -17.022 -32.830 7.744 1.00 11.69 C ATOM 673 C ILE A 96 -17.991 -32.433 8.839 1.00 11.82 C ATOM 674 O ILE A 96 -17.792 -31.406 9.494 1.00 12.84 O ATOM 675 CB ILE A 96 -15.587 -32.802 8.276 1.00 12.12 C ATOM 676 CG1 ILE A 96 -14.597 -33.161 7.157 1.00 13.24 C ATOM 677 CG2 ILE A 96 -15.439 -33.710 9.467 1.00 11.92 C ATOM 678 CD1 ILE A 96 -13.185 -32.677 7.448 1.00 15.58 C ATOM 679 H ILE A 96 -17.053 -30.867 6.862 1.00 0.00 H ATOM 680 N GLU A 97 -19.005 -33.266 9.072 1.00 11.21 N ATOM 681 CA GLU A 97 -20.068 -33.011 10.038 1.00 11.84 C ATOM 682 C GLU A 97 -19.893 -33.933 11.235 1.00 11.90 C ATOM 683 O GLU A 97 -19.935 -35.163 11.092 1.00 11.59 O ATOM 684 CB GLU A 97 -21.414 -33.229 9.369 1.00 12.50 C ATOM 685 CG GLU A 97 -22.623 -32.991 10.228 1.00 14.56 C ATOM 686 CD GLU A 97 -23.839 -33.606 9.609 1.00 17.11 C ATOM 687 OE1 GLU A 97 -24.046 -34.830 9.810 1.00 18.78 O ATOM 688 OE2 GLU A 97 -24.527 -32.893 8.841 1.00 18.13 O ATOM 689 H GLU A 97 -19.041 -34.154 8.531 1.00 0.00 H ATOM 690 N LEU A 98 -19.697 -33.339 12.405 1.00 12.17 N ATOM 691 CA LEU A 98 -19.483 -34.073 13.654 1.00 12.38 C ATOM 692 C LEU A 98 -20.649 -33.879 14.608 1.00 12.94 C ATOM 693 O LEU A 98 -21.156 -32.767 14.754 1.00 13.98 O ATOM 694 CB LEU A 98 -18.219 -33.579 14.373 1.00 12.61 C ATOM 695 CG LEU A 98 -16.989 -33.526 13.480 1.00 12.85 C ATOM 696 CD1 LEU A 98 -15.838 -32.948 14.288 1.00 15.01 C ATOM 697 CD2 LEU A 98 -16.615 -34.864 12.913 1.00 11.80 C ATOM 698 H LEU A 98 -19.695 -32.299 12.437 1.00 0.00 H ATOM 699 N LYS A 99 -21.057 -34.945 15.308 1.00 12.84 N ATOM 700 CA LYS A 99 -22.008 -34.825 16.412 1.00 12.84 C ATOM 701 C LYS A 99 -21.381 -35.458 17.639 1.00 12.31 C ATOM 702 O LYS A 99 -20.814 -36.554 17.554 1.00 13.02 O ATOM 703 CB LYS A 99 -23.350 -35.494 16.091 1.00 14.26 C ATOM 704 CG LYS A 99 -23.951 -34.973 14.794 1.00 15.72 C ATOM 705 CD LYS A 99 -25.250 -35.668 14.486 1.00 17.69 C ATOM 706 CE LYS A 99 -25.703 -35.299 13.112 1.00 20.15 C ATOM 707 NZ LYS A 99 -27.000 -35.979 12.841 1.00 22.97 N ATOM 708 HZ1 LYS A 99 -26.871 -37.009 12.907 1.00 0.00 H ATOM 709 HZ2 LYS A 99 -27.704 -35.671 13.541 1.00 0.00 H ATOM 710 HZ3 LYS A 99 -27.327 -35.730 11.886 1.00 0.00 H ATOM 711 H LYS A 99 -20.687 -35.885 15.059 1.00 0.00 H ATOM 712 N PHE A 100 -21.458 -34.754 18.770 1.00 12.68 N ATOM 713 CA PHE A 100 -20.662 -35.118 19.935 1.00 13.29 C ATOM 714 C PHE A 100 -21.227 -34.490 21.199 1.00 13.65 C ATOM 715 O PHE A 100 -21.940 -33.473 21.152 1.00 14.19 O ATOM 716 CB PHE A 100 -19.199 -34.684 19.761 1.00 13.72 C ATOM 717 CG PHE A 100 -19.043 -33.206 19.572 1.00 14.49 C ATOM 718 CD1 PHE A 100 -19.255 -32.607 18.331 1.00 14.33 C ATOM 719 CD2 PHE A 100 -18.751 -32.398 20.654 1.00 14.72 C ATOM 720 CE1 PHE A 100 -19.154 -31.211 18.182 1.00 13.52 C ATOM 721 CE2 PHE A 100 -18.645 -31.025 20.512 1.00 14.89 C ATOM 722 CZ PHE A 100 -18.843 -30.437 19.287 1.00 13.93 C ATOM 723 H PHE A 100 -22.095 -33.934 18.821 1.00 0.00 H ATOM 724 N THR A 101 -20.870 -35.095 22.332 1.00 13.59 N ATOM 725 CA THR A 101 -21.177 -34.532 23.649 1.00 14.88 C ATOM 726 C THR A 101 -19.875 -34.189 24.364 1.00 15.12 C ATOM 727 O THR A 101 -18.835 -34.819 24.128 1.00 15.62 O ATOM 728 CB THR A 101 -21.979 -35.502 24.533 1.00 18.24 C ATOM 729 OG1 THR A 101 -21.214 -36.686 24.767 1.00 18.54 O ATOM 730 CG2 THR A 101 -23.287 -35.908 23.890 1.00 20.17 C ATOM 731 HG1 THR A 101 -20.369 -36.447 25.224 1.00 0.00 H ATOM 732 H THR A 101 -20.356 -35.998 22.279 1.00 0.00 H ATOM 733 N VAL A 102 -19.946 -33.210 25.273 1.00 16.62 N ATOM 734 CA VAL A 102 -18.819 -32.832 26.124 1.00 16.55 C ATOM 735 C VAL A 102 -19.357 -32.597 27.532 1.00 17.06 C ATOM 736 O VAL A 102 -20.247 -31.762 27.721 1.00 17.30 O ATOM 737 CB VAL A 102 -18.114 -31.567 25.611 1.00 17.39 C ATOM 738 CG1 VAL A 102 -16.991 -31.161 26.561 1.00 18.55 C ATOM 739 CG2 VAL A 102 -17.577 -31.794 24.201 1.00 16.22 C ATOM 740 H VAL A 102 -20.843 -32.695 25.379 1.00 0.00 H ATOM 741 N ARG A 103 -18.812 -33.297 28.530 1.00 17.23 N ATOM 742 CA ARG A 103 -19.223 -33.056 29.910 1.00 18.22 C ATOM 743 C ARG A 103 -18.536 -31.834 30.509 1.00 18.47 C ATOM 744 O ARG A 103 -17.347 -31.580 30.268 1.00 19.00 O ATOM 745 CB ARG A 103 -18.959 -34.272 30.797 1.00 18.85 C ATOM 746 CG ARG A 103 -19.792 -35.480 30.373 1.00 18.15 C ATOM 747 CD ARG A 103 -19.712 -36.621 31.353 1.00 19.02 C ATOM 748 NE ARG A 103 -20.319 -36.282 32.633 1.00 20.91 N ATOM 749 CZ ARG A 103 -20.326 -37.063 33.705 1.00 22.97 C ATOM 750 NH1 ARG A 103 -19.733 -38.254 33.670 1.00 22.85 N ATOM 751 NH2 ARG A 103 -20.912 -36.636 34.819 1.00 25.17 N ATOM 752 HE ARG A 103 -20.783 -35.355 32.713 1.00 0.00 H ATOM 753 HH12 ARG A 103 -19.741 -38.864 34.513 1.00 0.00 H ATOM 754 HH11 ARG A 103 -19.262 -38.575 32.800 1.00 0.00 H ATOM 755 HH22 ARG A 103 -20.923 -37.240 35.665 1.00 0.00 H ATOM 756 HH21 ARG A 103 -21.359 -35.697 34.844 1.00 0.00 H ATOM 757 H ARG A 103 -18.091 -34.018 28.323 1.00 0.00 H ATOM 758 N ASP A 104 -19.312 -31.080 31.287 1.00 18.94 N ATOM 759 CA ASP A 104 -18.805 -29.901 31.986 1.00 19.62 C ATOM 760 C ASP A 104 -17.668 -30.319 32.908 1.00 19.94 C ATOM 761 O ASP A 104 -17.815 -31.228 33.719 1.00 20.90 O ATOM 762 CB ASP A 104 -19.948 -29.229 32.764 1.00 22.81 C ATOM 763 CG ASP A 104 -19.580 -27.832 33.318 1.00 28.99 C ATOM 764 OD1 ASP A 104 -18.459 -27.598 33.788 1.00 30.09 O ATOM 765 OD2 ASP A 104 -20.441 -26.933 33.228 1.00 34.71 O ATOM 766 H ASP A 104 -20.313 -31.340 31.401 1.00 0.00 H ATOM 767 N CYS A 105 -16.535 -29.627 32.797 1.00 19.74 N ATOM 768 CA CYS A 105 -15.422 -29.916 33.689 1.00 21.32 C ATOM 769 C CYS A 105 -15.753 -29.645 35.158 1.00 21.47 C ATOM 770 O CYS A 105 -15.090 -30.213 36.031 1.00 22.79 O ATOM 771 CB CYS A 105 -14.199 -29.117 33.261 1.00 23.55 C ATOM 772 SG CYS A 105 -13.471 -29.746 31.730 1.00 23.85 S ATOM 773 H CYS A 105 -16.446 -28.883 32.076 1.00 0.00 H ATOM 774 N ASN A 106 -16.756 -28.812 35.455 1.00 22.05 N ATOM 775 CA ASN A 106 -17.177 -28.633 36.845 1.00 23.70 C ATOM 776 C ASN A 106 -17.759 -29.910 37.446 1.00 24.39 C ATOM 777 O ASN A 106 -17.950 -29.970 38.661 1.00 27.30 O ATOM 778 CB ASN A 106 -18.233 -27.522 36.990 1.00 25.43 C ATOM 779 CG ASN A 106 -17.695 -26.157 36.624 1.00 25.60 C ATOM 780 OD1 ASN A 106 -16.512 -25.881 36.793 1.00 26.01 O ATOM 781 ND2 ASN A 106 -18.593 -25.251 36.246 1.00 26.76 N ATOM 782 HD22 ASN A 106 -19.587 -25.528 36.114 1.00 0.00 H ATOM 783 HD21 ASN A 106 -18.301 -24.266 36.083 1.00 0.00 H ATOM 784 H ASN A 106 -17.238 -28.290 34.696 1.00 0.00 H ATOM 785 N SER A 107 -18.059 -30.919 36.614 1.00 24.28 N ATOM 786 CA SER A 107 -18.606 -32.182 37.092 1.00 26.86 C ATOM 787 C SER A 107 -17.613 -32.999 37.890 1.00 29.05 C ATOM 788 O SER A 107 -18.021 -33.900 38.631 1.00 33.81 O ATOM 789 CB SER A 107 -19.049 -33.040 35.907 1.00 27.30 C ATOM 790 OG SER A 107 -19.965 -32.363 35.095 1.00 29.85 O ATOM 791 HG SER A 107 -20.229 -32.946 34.340 1.00 0.00 H ATOM 792 H SER A 107 -17.896 -30.795 35.594 1.00 0.00 H ATOM 793 N PHE A 108 -16.361 -32.745 37.736 1.00 26.92 N ATOM 794 CA PHE A 108 -15.350 -33.645 38.236 1.00 28.65 C ATOM 795 C PHE A 108 -14.644 -33.010 39.414 1.00 37.27 C ATOM 796 O PHE A 108 -14.627 -31.785 39.542 1.00 36.53 O ATOM 797 CB PHE A 108 -14.358 -33.978 37.119 1.00 27.21 C ATOM 798 CG PHE A 108 -15.031 -34.412 35.862 1.00 24.96 C ATOM 799 CD1 PHE A 108 -15.756 -35.591 35.844 1.00 26.36 C ATOM 800 CD2 PHE A 108 -14.993 -33.638 34.711 1.00 24.47 C ATOM 801 CE1 PHE A 108 -16.407 -36.004 34.712 1.00 24.18 C ATOM 802 CE2 PHE A 108 -15.639 -34.054 33.571 1.00 23.14 C ATOM 803 CZ PHE A 108 -16.348 -35.243 33.570 1.00 23.39 C ATOM 804 H PHE A 108 -16.073 -31.876 37.243 1.00 0.00 H ATOM 805 N PRO A 109 -13.992 -33.803 40.272 1.00 39.72 N ATOM 806 CA PRO A 109 -13.446 -33.224 41.520 1.00 43.24 C ATOM 807 C PRO A 109 -12.505 -32.033 41.354 1.00 42.34 C ATOM 808 O PRO A 109 -12.676 -31.027 42.055 1.00 42.12 O ATOM 809 CB PRO A 109 -12.738 -34.428 42.160 1.00 44.26 C ATOM 810 CG PRO A 109 -13.553 -35.592 41.722 1.00 43.49 C ATOM 811 CD PRO A 109 -14.016 -35.278 40.317 1.00 42.21 C ATOM 812 N GLY A 110 -11.503 -32.111 40.482 1.00 35.39 N ATOM 813 CA GLY A 110 -10.525 -31.047 40.339 1.00 34.10 C ATOM 814 C GLY A 110 -10.811 -30.043 39.242 1.00 29.48 C ATOM 815 O GLY A 110 -9.950 -29.204 38.944 1.00 28.83 O ATOM 816 H GLY A 110 -11.418 -32.959 39.885 1.00 0.00 H ATOM 817 N GLY A 111 -11.984 -30.108 38.622 1.00 26.08 N ATOM 818 CA GLY A 111 -12.399 -29.168 37.600 1.00 24.51 C ATOM 819 C GLY A 111 -11.431 -29.109 36.434 1.00 25.76 C ATOM 820 O GLY A 111 -10.769 -30.085 36.087 1.00 23.03 O ATOM 821 H GLY A 111 -12.638 -30.873 38.883 1.00 0.00 H ATOM 822 N ALA A 112 -11.351 -27.932 35.814 1.00 26.00 N ATOM 823 CA ALA A 112 -10.549 -27.759 34.605 1.00 25.27 C ATOM 824 C ALA A 112 -9.064 -27.568 34.882 1.00 24.22 C ATOM 825 O ALA A 112 -8.308 -27.331 33.938 1.00 26.04 O ATOM 826 CB ALA A 112 -11.058 -26.570 33.790 1.00 23.40 C ATOM 827 H ALA A 112 -11.871 -27.118 36.199 1.00 0.00 H ATOM 828 N SER A 113 -8.618 -27.662 36.131 1.00 28.17 N ATOM 829 CA SER A 113 -7.177 -27.774 36.336 1.00 26.29 C ATOM 830 C SER A 113 -6.638 -29.088 35.795 1.00 29.56 C ATOM 831 O SER A 113 -5.417 -29.247 35.690 1.00 37.58 O ATOM 832 CB SER A 113 -6.845 -27.632 37.816 1.00 29.24 C ATOM 833 OG SER A 113 -7.258 -26.362 38.309 1.00 27.48 O ATOM 834 HG SER A 113 -7.032 -26.293 39.270 1.00 0.00 H ATOM 835 H SER A 113 -9.275 -27.656 36.937 1.00 0.00 H ATOM 836 N SER A 114 -7.523 -30.012 35.436 1.00 29.84 N ATOM 837 CA SER A 114 -7.146 -31.267 34.808 1.00 27.94 C ATOM 838 C SER A 114 -8.318 -31.757 33.965 1.00 25.57 C ATOM 839 O SER A 114 -8.713 -32.921 34.025 1.00 27.51 O ATOM 840 CB SER A 114 -6.734 -32.298 35.857 1.00 29.96 C ATOM 841 OG SER A 114 -7.706 -32.432 36.886 1.00 28.71 O ATOM 842 HG SER A 114 -8.566 -32.721 36.490 1.00 0.00 H ATOM 843 H SER A 114 -8.531 -29.829 35.613 1.00 0.00 H ATOM 844 N CYS A 115 -8.893 -30.840 33.158 1.00 24.07 N ATOM 845 CA CYS A 115 -10.032 -31.144 32.293 1.00 20.91 C ATOM 846 C CYS A 115 -10.193 -30.032 31.257 1.00 19.00 C ATOM 847 O CYS A 115 -10.051 -28.841 31.564 1.00 21.30 O ATOM 848 CB CYS A 115 -11.298 -31.315 33.147 1.00 22.08 C ATOM 849 SG CYS A 115 -12.798 -31.619 32.216 1.00 22.41 S ATOM 850 H CYS A 115 -8.508 -29.874 33.151 1.00 0.00 H ATOM 851 N LYS A 116 -10.467 -30.437 30.018 1.00 18.87 N ATOM 852 CA LYS A 116 -10.706 -29.533 28.907 1.00 21.81 C ATOM 853 C LYS A 116 -12.107 -29.754 28.348 1.00 19.05 C ATOM 854 O LYS A 116 -12.744 -30.773 28.621 1.00 19.23 O ATOM 855 CB LYS A 116 -9.647 -29.736 27.804 1.00 27.07 C ATOM 856 CG LYS A 116 -8.242 -29.378 28.269 1.00 35.75 C ATOM 857 CD LYS A 116 -8.119 -27.871 28.456 1.00 46.09 C ATOM 858 CE LYS A 116 -6.673 -27.398 28.526 1.00 55.17 C ATOM 859 NZ LYS A 116 -6.180 -27.342 29.932 1.00 60.00 N ATOM 860 HZ1 LYS A 116 -6.769 -26.681 30.478 1.00 0.00 H ATOM 861 HZ2 LYS A 116 -6.236 -28.290 30.356 1.00 0.00 H ATOM 862 HZ3 LYS A 116 -5.192 -27.016 29.939 1.00 0.00 H ATOM 863 H LYS A 116 -10.512 -31.460 29.836 1.00 0.00 H ATOM 864 N GLU A 117 -12.606 -28.758 27.600 1.00 18.54 N ATOM 865 CA GLU A 117 -13.934 -28.826 26.988 1.00 18.21 C ATOM 866 C GLU A 117 -13.892 -28.708 25.462 1.00 18.88 C ATOM 867 O GLU A 117 -14.893 -28.353 24.841 1.00 21.86 O ATOM 868 CB GLU A 117 -14.847 -27.768 27.624 1.00 19.79 C ATOM 869 CG GLU A 117 -15.294 -28.201 29.027 1.00 20.90 C ATOM 870 CD GLU A 117 -15.889 -27.098 29.880 1.00 24.85 C ATOM 871 OE1 GLU A 117 -15.948 -25.929 29.446 1.00 28.16 O ATOM 872 OE2 GLU A 117 -16.339 -27.420 30.987 1.00 25.25 O ATOM 873 H GLU A 117 -12.028 -27.907 27.450 1.00 0.00 H ATOM 874 N THR A 118 -12.745 -28.980 24.853 1.00 16.70 N ATOM 875 CA THR A 118 -12.595 -29.008 23.399 1.00 16.81 C ATOM 876 C THR A 118 -11.877 -30.279 22.995 1.00 16.07 C ATOM 877 O THR A 118 -11.289 -30.959 23.828 1.00 16.64 O ATOM 878 CB THR A 118 -11.782 -27.810 22.876 1.00 18.27 C ATOM 879 OG1 THR A 118 -10.448 -27.848 23.415 1.00 19.00 O ATOM 880 CG2 THR A 118 -12.432 -26.496 23.261 1.00 19.45 C ATOM 881 HG1 THR A 118 -10.005 -28.689 23.138 1.00 0.00 H ATOM 882 H THR A 118 -11.911 -29.184 25.440 1.00 0.00 H ATOM 883 N PHE A 119 -11.872 -30.566 21.691 1.00 15.43 N ATOM 884 CA PHE A 119 -11.003 -31.579 21.102 1.00 14.32 C ATOM 885 C PHE A 119 -10.614 -31.078 19.711 1.00 13.07 C ATOM 886 O PHE A 119 -11.161 -30.092 19.218 1.00 14.92 O ATOM 887 CB PHE A 119 -11.647 -32.973 21.022 1.00 14.93 C ATOM 888 CG PHE A 119 -12.830 -33.066 20.110 1.00 16.12 C ATOM 889 CD1 PHE A 119 -14.075 -32.680 20.549 1.00 15.76 C ATOM 890 CD2 PHE A 119 -12.713 -33.542 18.815 1.00 17.75 C ATOM 891 CE1 PHE A 119 -15.179 -32.766 19.729 1.00 16.37 C ATOM 892 CE2 PHE A 119 -13.840 -33.618 17.985 1.00 18.11 C ATOM 893 CZ PHE A 119 -15.068 -33.231 18.465 1.00 17.58 C ATOM 894 H PHE A 119 -12.518 -30.043 21.066 1.00 0.00 H ATOM 895 N ASN A 120 -9.651 -31.752 19.082 1.00 12.94 N ATOM 896 CA ASN A 120 -9.092 -31.246 17.836 1.00 13.26 C ATOM 897 C ASN A 120 -9.343 -32.176 16.662 1.00 12.44 C ATOM 898 O ASN A 120 -9.255 -33.404 16.783 1.00 12.87 O ATOM 899 CB ASN A 120 -7.602 -31.026 17.973 1.00 13.80 C ATOM 900 CG ASN A 120 -7.273 -30.002 19.032 1.00 17.52 C ATOM 901 OD1 ASN A 120 -7.954 -28.970 19.159 1.00 16.87 O ATOM 902 ND2 ASN A 120 -6.240 -30.278 19.810 1.00 22.24 N ATOM 903 HD22 ASN A 120 -5.700 -31.155 19.665 1.00 0.00 H ATOM 904 HD21 ASN A 120 -5.968 -29.618 20.566 1.00 0.00 H ATOM 905 H ASN A 120 -9.297 -32.644 19.483 1.00 0.00 H ATOM 906 N LEU A 121 -9.660 -31.570 15.521 1.00 12.51 N ATOM 907 CA LEU A 121 -9.905 -32.272 14.272 1.00 11.66 C ATOM 908 C LEU A 121 -8.725 -32.046 13.339 1.00 11.34 C ATOM 909 O LEU A 121 -8.328 -30.899 13.110 1.00 12.30 O ATOM 910 CB LEU A 121 -11.193 -31.779 13.616 1.00 12.37 C ATOM 911 CG LEU A 121 -11.498 -32.251 12.195 1.00 12.82 C ATOM 912 CD1 LEU A 121 -11.793 -33.757 12.168 1.00 13.19 C ATOM 913 CD2 LEU A 121 -12.643 -31.467 11.591 1.00 14.06 C ATOM 914 H LEU A 121 -9.737 -30.533 15.523 1.00 0.00 H ATOM 915 N TYR A 122 -8.213 -33.153 12.782 1.00 10.97 N ATOM 916 CA TYR A 122 -7.073 -33.198 11.872 1.00 12.02 C ATOM 917 C TYR A 122 -7.400 -33.969 10.590 1.00 11.58 C ATOM 918 O TYR A 122 -8.350 -34.759 10.524 1.00 12.18 O ATOM 919 CB TYR A 122 -5.887 -33.896 12.527 1.00 12.96 C ATOM 920 CG TYR A 122 -5.162 -33.139 13.603 1.00 13.41 C ATOM 921 CD1 TYR A 122 -5.676 -33.020 14.890 1.00 13.83 C ATOM 922 CD2 TYR A 122 -3.935 -32.559 13.342 1.00 13.12 C ATOM 923 CE1 TYR A 122 -5.002 -32.355 15.852 1.00 15.16 C ATOM 924 CE2 TYR A 122 -3.244 -31.883 14.314 1.00 15.08 C ATOM 925 CZ TYR A 122 -3.790 -31.795 15.578 1.00 17.01 C ATOM 926 OH TYR A 122 -3.100 -31.112 16.566 1.00 21.39 O ATOM 927 HH TYR A 122 -3.619 -31.139 17.408 1.00 0.00 H ATOM 928 H TYR A 122 -8.668 -34.058 13.019 1.00 0.00 H ATOM 929 N TYR A 123 -6.575 -33.763 9.563 1.00 11.99 N ATOM 930 CA TYR A 123 -6.633 -34.617 8.378 1.00 12.04 C ATOM 931 C TYR A 123 -5.251 -34.792 7.765 1.00 12.17 C ATOM 932 O TYR A 123 -4.311 -34.048 8.050 1.00 13.12 O ATOM 933 CB TYR A 123 -7.591 -34.096 7.296 1.00 12.52 C ATOM 934 CG TYR A 123 -7.063 -33.006 6.376 1.00 13.40 C ATOM 935 CD1 TYR A 123 -6.624 -31.787 6.874 1.00 14.25 C ATOM 936 CD2 TYR A 123 -7.018 -33.192 5.004 1.00 14.35 C ATOM 937 CE1 TYR A 123 -6.174 -30.783 6.032 1.00 15.68 C ATOM 938 CE2 TYR A 123 -6.555 -32.200 4.163 1.00 15.77 C ATOM 939 CZ TYR A 123 -6.134 -30.987 4.684 1.00 17.43 C ATOM 940 OH TYR A 123 -5.658 -29.993 3.842 1.00 21.20 O ATOM 941 HH TYR A 123 -5.404 -29.201 4.379 1.00 0.00 H ATOM 942 H TYR A 123 -5.884 -32.987 9.605 1.00 0.00 H ATOM 943 N ALA A 124 -5.156 -35.815 6.918 1.00 11.43 N ATOM 944 CA ALA A 124 -3.975 -36.032 6.085 1.00 12.55 C ATOM 945 C ALA A 124 -4.393 -36.648 4.760 1.00 13.22 C ATOM 946 O ALA A 124 -5.232 -37.557 4.726 1.00 13.60 O ATOM 947 CB ALA A 124 -2.957 -36.953 6.760 1.00 14.17 C ATOM 948 H ALA A 124 -5.950 -36.483 6.847 1.00 0.00 H ATOM 949 N GLU A 125 -3.799 -36.162 3.669 1.00 14.67 N ATOM 950 CA GLU A 125 -4.021 -36.722 2.347 1.00 14.69 C ATOM 951 C GLU A 125 -2.901 -37.688 1.993 1.00 16.05 C ATOM 952 O GLU A 125 -1.737 -37.465 2.341 1.00 18.26 O ATOM 953 CB GLU A 125 -4.076 -35.650 1.254 1.00 16.46 C ATOM 954 CG GLU A 125 -5.173 -34.614 1.413 1.00 19.69 C ATOM 955 CD GLU A 125 -5.251 -33.713 0.207 1.00 24.46 C ATOM 956 OE1 GLU A 125 -5.670 -34.172 -0.865 1.00 25.31 O ATOM 957 OE2 GLU A 125 -4.863 -32.546 0.330 1.00 26.41 O ATOM 958 H GLU A 125 -3.153 -35.353 3.768 1.00 0.00 H ATOM 959 N SER A 126 -3.252 -38.721 1.237 1.00 15.77 N ATOM 960 CA SER A 126 -2.242 -39.627 0.715 1.00 20.00 C ATOM 961 C SER A 126 -2.802 -40.421 -0.464 1.00 19.24 C ATOM 962 O SER A 126 -3.966 -40.839 -0.464 1.00 20.52 O ATOM 963 CB SER A 126 -1.739 -40.576 1.806 1.00 24.28 C ATOM 964 OG SER A 126 -2.761 -41.457 2.179 1.00 25.18 O ATOM 965 HG SER A 126 -3.044 -41.985 1.391 1.00 0.00 H ATOM 966 H SER A 126 -4.255 -38.883 1.017 1.00 0.00 H ATOM 967 N ASP A 127 -1.911 -40.744 -1.403 1.00 25.54 N ATOM 968 CA ASP A 127 -2.322 -41.559 -2.541 1.00 26.68 C ATOM 969 C ASP A 127 -2.516 -43.024 -2.162 1.00 27.39 C ATOM 970 O ASP A 127 -3.346 -43.710 -2.775 1.00 30.18 O ATOM 971 CB ASP A 127 -1.287 -41.461 -3.651 1.00 25.08 C ATOM 972 CG ASP A 127 -1.383 -40.174 -4.438 1.00 27.46 C ATOM 973 OD1 ASP A 127 -2.472 -39.580 -4.530 1.00 26.82 O ATOM 974 OD2 ASP A 127 -0.351 -39.760 -5.014 1.00 30.59 O ATOM 975 H ASP A 127 -0.927 -40.416 -1.324 1.00 0.00 H ATOM 976 N LEU A 128 -1.798 -43.513 -1.154 1.00 24.12 N ATOM 977 CA LEU A 128 -1.909 -44.899 -0.741 1.00 23.84 C ATOM 978 C LEU A 128 -2.345 -44.967 0.712 1.00 19.67 C ATOM 979 O LEU A 128 -2.164 -44.032 1.487 1.00 19.21 O ATOM 980 CB LEU A 128 -0.610 -45.680 -0.925 1.00 32.52 C ATOM 981 CG LEU A 128 -0.115 -45.789 -2.364 1.00 39.64 C ATOM 982 CD1 LEU A 128 1.225 -46.475 -2.390 1.00 43.61 C ATOM 983 CD2 LEU A 128 -1.131 -46.571 -3.188 1.00 40.57 C ATOM 984 H LEU A 128 -1.140 -42.885 -0.649 1.00 0.00 H ATOM 985 N ASP A 129 -2.968 -46.075 1.049 1.00 19.74 N ATOM 986 CA ASP A 129 -3.377 -46.362 2.418 1.00 19.74 C ATOM 987 C ASP A 129 -2.175 -46.936 3.155 1.00 19.82 C ATOM 988 O ASP A 129 -1.606 -47.952 2.728 1.00 22.09 O ATOM 989 CB ASP A 129 -4.549 -47.347 2.355 1.00 19.73 C ATOM 990 CG ASP A 129 -5.110 -47.751 3.707 1.00 18.63 C ATOM 991 OD1 ASP A 129 -4.760 -47.199 4.772 1.00 18.52 O ATOM 992 OD2 ASP A 129 -5.926 -48.710 3.687 1.00 18.98 O ATOM 993 H ASP A 129 -3.177 -46.775 0.309 1.00 0.00 H ATOM 994 N TYR A 130 -1.778 -46.283 4.251 1.00 19.62 N ATOM 995 CA TYR A 130 -0.685 -46.780 5.075 1.00 21.17 C ATOM 996 C TYR A 130 -1.137 -47.814 6.100 1.00 16.16 C ATOM 997 O TYR A 130 -0.314 -48.294 6.892 1.00 15.21 O ATOM 998 CB TYR A 130 -0.022 -45.639 5.870 1.00 33.86 C ATOM 999 CG TYR A 130 0.602 -44.492 5.097 1.00 53.05 C ATOM 1000 CD1 TYR A 130 1.965 -44.489 4.827 1.00 63.57 C ATOM 1001 CD2 TYR A 130 -0.144 -43.391 4.696 1.00 61.63 C ATOM 1002 CE1 TYR A 130 2.563 -43.447 4.149 1.00 69.75 C ATOM 1003 CE2 TYR A 130 0.448 -42.337 4.011 1.00 67.79 C ATOM 1004 CZ TYR A 130 1.803 -42.375 3.741 1.00 71.60 C ATOM 1005 OH TYR A 130 2.408 -41.342 3.064 1.00 75.13 O ATOM 1006 HH TYR A 130 1.992 -41.246 2.171 1.00 0.00 H ATOM 1007 H TYR A 130 -2.259 -45.402 4.521 1.00 0.00 H ATOM 1008 N GLY A 131 -2.415 -48.190 6.082 1.00 17.08 N ATOM 1009 CA GLY A 131 -2.914 -49.230 6.960 1.00 16.97 C ATOM 1010 C GLY A 131 -2.795 -48.869 8.430 1.00 15.85 C ATOM 1011 O GLY A 131 -3.260 -47.816 8.899 1.00 15.82 O ATOM 1012 H GLY A 131 -3.071 -47.726 5.422 1.00 0.00 H ATOM 1013 N THR A 132 -2.169 -49.761 9.187 1.00 13.98 N ATOM 1014 CA THR A 132 -1.992 -49.581 10.619 1.00 14.66 C ATOM 1015 C THR A 132 -0.870 -48.611 10.969 1.00 14.79 C ATOM 1016 O THR A 132 -0.693 -48.314 12.157 1.00 16.57 O ATOM 1017 CB THR A 132 -1.715 -50.924 11.314 1.00 16.59 C ATOM 1018 OG1 THR A 132 -0.490 -51.502 10.823 1.00 16.88 O ATOM 1019 CG2 THR A 132 -2.813 -51.933 11.084 1.00 18.53 C ATOM 1020 HG1 THR A 132 0.261 -50.884 11.005 1.00 0.00 H ATOM 1021 H THR A 132 -1.791 -50.620 8.740 1.00 0.00 H ATOM 1022 N ASN A 133 -0.117 -48.102 9.995 1.00 14.20 N ATOM 1023 CA ASN A 133 0.945 -47.133 10.280 1.00 15.47 C ATOM 1024 C ASN A 133 0.320 -45.739 10.357 1.00 19.04 C ATOM 1025 O ASN A 133 0.108 -45.072 9.346 1.00 23.51 O ATOM 1026 CB ASN A 133 2.040 -47.221 9.231 1.00 17.15 C ATOM 1027 CG ASN A 133 3.183 -46.260 9.484 1.00 20.17 C ATOM 1028 OD1 ASN A 133 3.432 -45.850 10.631 1.00 22.25 O ATOM 1029 ND2 ASN A 133 3.875 -45.897 8.434 1.00 20.60 N ATOM 1030 HD22 ASN A 133 3.627 -46.268 7.494 1.00 0.00 H ATOM 1031 HD21 ASN A 133 4.672 -45.238 8.539 1.00 0.00 H ATOM 1032 H ASN A 133 -0.286 -48.398 9.013 1.00 0.00 H ATOM 1033 N PHE A 134 0.144 -45.258 11.571 1.00 16.89 N ATOM 1034 CA PHE A 134 -0.397 -43.939 11.853 1.00 16.43 C ATOM 1035 C PHE A 134 0.749 -43.054 12.321 1.00 18.15 C ATOM 1036 O PHE A 134 1.427 -43.381 13.301 1.00 20.32 O ATOM 1037 CB PHE A 134 -1.455 -43.994 12.946 1.00 15.36 C ATOM 1038 CG PHE A 134 -1.855 -42.650 13.486 1.00 17.42 C ATOM 1039 CD1 PHE A 134 -2.385 -41.647 12.683 1.00 18.16 C ATOM 1040 CD2 PHE A 134 -1.621 -42.365 14.815 1.00 18.42 C ATOM 1041 CE1 PHE A 134 -2.721 -40.425 13.198 1.00 19.08 C ATOM 1042 CE2 PHE A 134 -1.946 -41.124 15.346 1.00 18.39 C ATOM 1043 CZ PHE A 134 -2.500 -40.160 14.559 1.00 18.77 C ATOM 1044 H PHE A 134 0.409 -45.859 12.377 1.00 0.00 H ATOM 1045 N GLN A 135 1.025 -41.998 11.585 1.00 17.49 N ATOM 1046 CA GLN A 135 2.045 -41.028 11.976 1.00 19.18 C ATOM 1047 C GLN A 135 1.379 -39.667 12.101 1.00 19.39 C ATOM 1048 O GLN A 135 1.079 -39.026 11.087 1.00 19.28 O ATOM 1049 CB GLN A 135 3.175 -40.975 10.956 1.00 24.65 C ATOM 1050 CG GLN A 135 3.905 -42.290 10.768 1.00 31.54 C ATOM 1051 CD GLN A 135 4.619 -42.717 12.028 1.00 39.33 C ATOM 1052 OE1 GLN A 135 4.972 -41.883 12.869 1.00 44.28 O ATOM 1053 NE2 GLN A 135 4.836 -44.020 12.174 1.00 41.61 N ATOM 1054 HE22 GLN A 135 4.521 -44.685 11.439 1.00 0.00 H ATOM 1055 HE21 GLN A 135 5.321 -44.374 13.023 1.00 0.00 H ATOM 1056 H GLN A 135 0.501 -41.850 10.699 1.00 0.00 H ATOM 1057 N LYS A 136 1.219 -39.191 13.340 1.00 18.01 N ATOM 1058 CA LYS A 136 0.485 -37.950 13.535 1.00 18.70 C ATOM 1059 C LYS A 136 1.193 -36.768 12.865 1.00 17.57 C ATOM 1060 O LYS A 136 0.522 -35.789 12.529 1.00 17.85 O ATOM 1061 CB LYS A 136 0.268 -37.685 15.035 1.00 22.03 C ATOM 1062 CG LYS A 136 1.531 -37.498 15.837 1.00 28.24 C ATOM 1063 CD LYS A 136 1.246 -37.280 17.328 1.00 35.46 C ATOM 1064 CE LYS A 136 0.872 -38.573 18.024 1.00 44.14 C ATOM 1065 NZ LYS A 136 0.942 -38.459 19.517 1.00 51.62 N ATOM 1066 HZ1 LYS A 136 1.912 -38.210 19.799 1.00 0.00 H ATOM 1067 HZ2 LYS A 136 0.285 -37.719 19.838 1.00 0.00 H ATOM 1068 HZ3 LYS A 136 0.677 -39.369 19.946 1.00 0.00 H ATOM 1069 H LYS A 136 1.615 -39.702 14.155 1.00 0.00 H ATOM 1070 N ARG A 137 2.508 -36.849 12.646 1.00 19.11 N ATOM 1071 CA ARG A 137 3.253 -35.727 12.044 1.00 20.15 C ATOM 1072 C ARG A 137 2.845 -35.459 10.593 1.00 19.26 C ATOM 1073 O ARG A 137 3.189 -34.399 10.045 1.00 20.90 O ATOM 1074 CB ARG A 137 4.761 -35.983 12.121 1.00 23.60 C ATOM 1075 CG ARG A 137 5.224 -37.051 11.149 1.00 27.10 C ATOM 1076 CD ARG A 137 6.696 -37.420 11.269 1.00 34.08 C ATOM 1077 NE ARG A 137 6.946 -38.626 10.478 1.00 40.24 N ATOM 1078 CZ ARG A 137 7.081 -38.646 9.153 1.00 47.43 C ATOM 1079 NH1 ARG A 137 7.015 -37.522 8.451 1.00 52.77 N ATOM 1080 NH2 ARG A 137 7.286 -39.796 8.527 1.00 48.64 N ATOM 1081 HE ARG A 137 7.024 -39.530 10.986 1.00 0.00 H ATOM 1082 HH12 ARG A 137 7.122 -37.548 7.417 1.00 0.00 H ATOM 1083 HH11 ARG A 137 6.857 -36.615 8.935 1.00 0.00 H ATOM 1084 HH22 ARG A 137 7.392 -39.813 7.493 1.00 0.00 H ATOM 1085 HH21 ARG A 137 7.341 -40.681 9.070 1.00 0.00 H ATOM 1086 H ARG A 137 3.016 -37.719 12.905 1.00 0.00 H ATOM 1087 N LEU A 138 2.146 -36.403 9.953 1.00 18.88 N ATOM 1088 CA LEU A 138 1.619 -36.211 8.607 1.00 19.03 C ATOM 1089 C LEU A 138 0.303 -35.434 8.590 1.00 17.56 C ATOM 1090 O LEU A 138 -0.138 -35.028 7.510 1.00 18.51 O ATOM 1091 CB LEU A 138 1.411 -37.562 7.918 1.00 21.27 C ATOM 1092 CG LEU A 138 2.690 -38.375 7.707 1.00 25.82 C ATOM 1093 CD1 LEU A 138 2.361 -39.719 7.068 1.00 29.32 C ATOM 1094 CD2 LEU A 138 3.696 -37.617 6.861 1.00 27.06 C ATOM 1095 H LEU A 138 1.972 -37.309 10.434 1.00 0.00 H ATOM 1096 N PHE A 139 -0.302 -35.178 9.751 1.00 16.09 N ATOM 1097 CA PHE A 139 -1.641 -34.612 9.849 1.00 14.52 C ATOM 1098 C PHE A 139 -1.579 -33.116 10.125 1.00 16.16 C ATOM 1099 O PHE A 139 -0.662 -32.627 10.785 1.00 18.64 O ATOM 1100 CB PHE A 139 -2.428 -35.319 10.964 1.00 12.84 C ATOM 1101 CG PHE A 139 -2.915 -36.678 10.574 1.00 12.48 C ATOM 1102 CD1 PHE A 139 -2.034 -37.740 10.487 1.00 13.86 C ATOM 1103 CD2 PHE A 139 -4.252 -36.907 10.271 1.00 11.58 C ATOM 1104 CE1 PHE A 139 -2.456 -38.980 10.081 1.00 13.74 C ATOM 1105 CE2 PHE A 139 -4.689 -38.167 9.878 1.00 11.24 C ATOM 1106 CZ PHE A 139 -3.786 -39.203 9.786 1.00 12.41 C ATOM 1107 H PHE A 139 0.208 -35.393 10.631 1.00 0.00 H ATOM 1108 N THR A 140 -2.540 -32.390 9.551 1.00 14.89 N ATOM 1109 CA THR A 140 -2.712 -30.951 9.730 1.00 15.67 C ATOM 1110 C THR A 140 -4.010 -30.708 10.492 1.00 13.69 C ATOM 1111 O THR A 140 -5.023 -31.363 10.228 1.00 14.07 O ATOM 1112 CB THR A 140 -2.755 -30.233 8.380 1.00 19.89 C ATOM 1113 OG1 THR A 140 -1.486 -30.398 7.731 1.00 22.38 O ATOM 1114 CG2 THR A 140 -3.040 -28.739 8.546 1.00 22.68 C ATOM 1115 HG1 THR A 140 -1.310 -31.362 7.594 1.00 0.00 H ATOM 1116 H THR A 140 -3.214 -32.884 8.932 1.00 0.00 H ATOM 1117 N LYS A 141 -3.973 -29.793 11.460 1.00 15.54 N ATOM 1118 CA LYS A 141 -5.181 -29.485 12.220 1.00 14.31 C ATOM 1119 C LYS A 141 -6.124 -28.656 11.358 1.00 14.83 C ATOM 1120 O LYS A 141 -5.736 -27.625 10.794 1.00 17.58 O ATOM 1121 CB LYS A 141 -4.820 -28.736 13.502 1.00 15.05 C ATOM 1122 CG LYS A 141 -5.996 -28.504 14.407 1.00 16.79 C ATOM 1123 CD LYS A 141 -5.588 -27.875 15.724 1.00 22.15 C ATOM 1124 CE LYS A 141 -6.787 -27.417 16.510 1.00 29.63 C ATOM 1125 NZ LYS A 141 -6.354 -26.554 17.638 1.00 38.21 N ATOM 1126 HZ1 LYS A 141 -5.720 -27.093 18.262 1.00 0.00 H ATOM 1127 HZ2 LYS A 141 -5.851 -25.724 17.265 1.00 0.00 H ATOM 1128 HZ3 LYS A 141 -7.189 -26.243 18.175 1.00 0.00 H ATOM 1129 H LYS A 141 -3.084 -29.298 11.674 1.00 0.00 H ATOM 1130 N ILE A 142 -7.380 -29.088 11.303 1.00 14.13 N ATOM 1131 CA ILE A 142 -8.435 -28.341 10.651 1.00 14.12 C ATOM 1132 C ILE A 142 -8.961 -27.272 11.602 1.00 14.75 C ATOM 1133 O ILE A 142 -9.007 -26.081 11.264 1.00 17.84 O ATOM 1134 CB ILE A 142 -9.552 -29.302 10.183 1.00 14.07 C ATOM 1135 CG1 ILE A 142 -9.050 -30.219 9.060 1.00 14.64 C ATOM 1136 CG2 ILE A 142 -10.762 -28.510 9.672 1.00 14.72 C ATOM 1137 CD1 ILE A 142 -9.961 -31.427 8.764 1.00 15.26 C ATOM 1138 H ILE A 142 -7.614 -29.999 11.746 1.00 0.00 H ATOM 1139 N ASP A 143 -9.309 -27.686 12.825 1.00 14.66 N ATOM 1140 CA ASP A 143 -9.752 -26.719 13.819 1.00 15.41 C ATOM 1141 C ASP A 143 -9.827 -27.358 15.191 1.00 15.11 C ATOM 1142 O ASP A 143 -9.895 -28.593 15.324 1.00 14.90 O ATOM 1143 CB ASP A 143 -11.123 -26.148 13.452 1.00 16.34 C ATOM 1144 CG ASP A 143 -11.364 -24.764 14.010 1.00 19.09 C ATOM 1145 OD1 ASP A 143 -10.437 -24.118 14.595 1.00 20.23 O ATOM 1146 OD2 ASP A 143 -12.515 -24.294 13.843 1.00 21.39 O ATOM 1147 H ASP A 143 -9.263 -28.697 13.066 1.00 0.00 H ATOM 1148 N THR A 144 -9.854 -26.498 16.201 1.00 15.46 N ATOM 1149 CA THR A 144 -10.363 -26.867 17.506 1.00 17.38 C ATOM 1150 C THR A 144 -11.874 -26.947 17.411 1.00 17.09 C ATOM 1151 O THR A 144 -12.519 -26.050 16.847 1.00 20.22 O ATOM 1152 CB THR A 144 -9.939 -25.824 18.546 1.00 22.34 C ATOM 1153 OG1 THR A 144 -8.506 -25.805 18.621 1.00 26.67 O ATOM 1154 CG2 THR A 144 -10.535 -26.136 19.909 1.00 22.24 C ATOM 1155 HG1 THR A 144 -8.179 -26.700 18.889 1.00 0.00 H ATOM 1156 H THR A 144 -9.500 -25.532 16.052 1.00 0.00 H ATOM 1157 N ILE A 145 -12.441 -28.019 17.942 1.00 16.11 N ATOM 1158 CA ILE A 145 -13.879 -28.254 17.960 1.00 16.90 C ATOM 1159 C ILE A 145 -14.376 -28.013 19.379 1.00 17.60 C ATOM 1160 O ILE A 145 -13.922 -28.666 20.326 1.00 18.56 O ATOM 1161 CB ILE A 145 -14.225 -29.675 17.494 1.00 16.21 C ATOM 1162 CG1 ILE A 145 -13.592 -29.985 16.124 1.00 14.78 C ATOM 1163 CG2 ILE A 145 -15.748 -29.868 17.496 1.00 17.86 C ATOM 1164 CD1 ILE A 145 -14.041 -29.111 14.980 1.00 15.29 C ATOM 1165 H ILE A 145 -11.823 -28.736 18.372 1.00 0.00 H ATOM 1166 N ALA A 146 -15.292 -27.060 19.523 1.00 17.70 N ATOM 1167 CA ALA A 146 -15.850 -26.702 20.808 1.00 18.36 C ATOM 1168 C ALA A 146 -17.361 -26.895 20.817 1.00 19.47 C ATOM 1169 O ALA A 146 -18.020 -26.657 19.802 1.00 19.13 O ATOM 1170 CB ALA A 146 -15.538 -25.246 21.170 1.00 19.68 C ATOM 1171 H ALA A 146 -15.620 -26.552 18.677 1.00 0.00 H ATOM 1172 N PRO A 147 -17.927 -27.335 21.939 1.00 18.94 N ATOM 1173 CA PRO A 147 -19.376 -27.549 22.011 1.00 18.94 C ATOM 1174 C PRO A 147 -20.131 -26.247 22.221 1.00 19.96 C ATOM 1175 O PRO A 147 -19.726 -25.394 23.011 1.00 21.64 O ATOM 1176 CB PRO A 147 -19.526 -28.459 23.244 1.00 19.66 C ATOM 1177 CG PRO A 147 -18.428 -28.007 24.125 1.00 20.64 C ATOM 1178 CD PRO A 147 -17.266 -27.700 23.205 1.00 20.58 C ATOM 1179 N ASP A 148 -21.261 -26.112 21.523 1.00 18.84 N ATOM 1180 CA ASP A 148 -22.186 -25.024 21.854 1.00 22.11 C ATOM 1181 C ASP A 148 -22.816 -25.230 23.226 1.00 21.92 C ATOM 1182 O ASP A 148 -23.156 -24.262 23.907 1.00 23.97 O ATOM 1183 CB ASP A 148 -23.291 -24.926 20.798 1.00 28.33 C ATOM 1184 CG ASP A 148 -22.882 -24.107 19.582 1.00 37.28 C ATOM 1185 OD1 ASP A 148 -21.737 -23.610 19.538 1.00 40.89 O ATOM 1186 OD2 ASP A 148 -23.722 -23.960 18.668 1.00 42.48 O ATOM 1187 H ASP A 148 -21.483 -26.773 20.751 1.00 0.00 H ATOM 1188 N GLU A 149 -22.983 -26.488 23.642 1.00 22.46 N ATOM 1189 CA GLU A 149 -23.672 -26.828 24.883 1.00 25.25 C ATOM 1190 C GLU A 149 -22.899 -27.920 25.603 1.00 22.03 C ATOM 1191 O GLU A 149 -22.756 -29.020 25.065 1.00 19.73 O ATOM 1192 CB GLU A 149 -25.100 -27.321 24.634 1.00 35.28 C ATOM 1193 CG GLU A 149 -26.101 -26.313 24.157 1.00 48.85 C ATOM 1194 CD GLU A 149 -27.466 -26.602 24.762 1.00 62.75 C ATOM 1195 OE1 GLU A 149 -28.282 -27.278 24.101 1.00 67.45 O ATOM 1196 OE2 GLU A 149 -27.702 -26.189 25.921 1.00 68.65 O ATOM 1197 H GLU A 149 -22.605 -27.260 23.056 1.00 0.00 H ATOM 1198 N ILE A 150 -22.424 -27.643 26.804 1.00 22.85 N ATOM 1199 CA ILE A 150 -21.812 -28.686 27.605 1.00 24.38 C ATOM 1200 C ILE A 150 -22.913 -29.394 28.385 1.00 25.70 C ATOM 1201 O ILE A 150 -23.989 -28.840 28.649 1.00 31.18 O ATOM 1202 CB ILE A 150 -20.696 -28.178 28.555 1.00 31.71 C ATOM 1203 CG1 ILE A 150 -21.205 -27.088 29.495 1.00 39.69 C ATOM 1204 CG2 ILE A 150 -19.460 -27.735 27.738 1.00 32.12 C ATOM 1205 CD1 ILE A 150 -20.107 -26.450 30.328 1.00 46.45 C ATOM 1206 H ILE A 150 -22.489 -26.674 27.176 1.00 0.00 H ATOM 1207 N THR A 151 -22.650 -30.635 28.748 1.00 22.18 N ATOM 1208 CA THR A 151 -23.605 -31.441 29.508 1.00 23.15 C ATOM 1209 C THR A 151 -23.243 -31.379 30.987 1.00 23.56 C ATOM 1210 O THR A 151 -22.169 -31.841 31.385 1.00 23.79 O ATOM 1211 CB THR A 151 -23.590 -32.882 28.985 1.00 22.90 C ATOM 1212 OG1 THR A 151 -23.982 -32.910 27.608 1.00 22.57 O ATOM 1213 CG2 THR A 151 -24.538 -33.779 29.785 1.00 24.17 C ATOM 1214 HG1 THR A 151 -23.351 -32.364 27.075 1.00 0.00 H ATOM 1215 H THR A 151 -21.735 -31.053 28.485 1.00 0.00 H ATOM 1216 N VAL A 152 -24.155 -30.853 31.810 1.00 24.60 N ATOM 1217 CA VAL A 152 -23.886 -30.757 33.244 1.00 25.48 C ATOM 1218 C VAL A 152 -24.337 -32.054 33.905 1.00 26.46 C ATOM 1219 O VAL A 152 -25.057 -32.864 33.319 1.00 26.58 O ATOM 1220 CB VAL A 152 -24.553 -29.529 33.916 1.00 27.07 C ATOM 1221 CG1 VAL A 152 -24.174 -28.250 33.191 1.00 26.64 C ATOM 1222 CG2 VAL A 152 -26.053 -29.686 33.951 1.00 29.02 C ATOM 1223 H VAL A 152 -25.060 -30.510 31.429 1.00 0.00 H ATOM 1224 N SER A 153 -23.878 -32.270 35.136 1.00 29.06 N ATOM 1225 CA SER A 153 -24.085 -33.562 35.779 1.00 34.66 C ATOM 1226 C SER A 153 -25.570 -33.899 35.924 1.00 32.51 C ATOM 1227 O SER A 153 -25.958 -35.060 35.772 1.00 32.93 O ATOM 1228 CB SER A 153 -23.390 -33.589 37.139 1.00 42.49 C ATOM 1229 OG SER A 153 -22.004 -33.826 36.955 1.00 45.25 O ATOM 1230 HG SER A 153 -21.554 -33.844 37.836 1.00 0.00 H ATOM 1231 H SER A 153 -23.370 -31.515 35.640 1.00 0.00 H ATOM 1232 N SER A 154 -26.415 -32.917 36.253 1.00 31.63 N ATOM 1233 CA SER A 154 -27.819 -33.269 36.467 1.00 35.25 C ATOM 1234 C SER A 154 -28.448 -33.760 35.169 1.00 34.61 C ATOM 1235 O SER A 154 -29.283 -34.669 35.181 1.00 37.56 O ATOM 1236 CB SER A 154 -28.621 -32.085 37.014 1.00 36.27 C ATOM 1237 OG SER A 154 -28.561 -30.969 36.146 1.00 35.51 O ATOM 1238 HG SER A 154 -27.618 -30.686 36.039 1.00 0.00 H ATOM 1239 H SER A 154 -26.086 -31.936 36.354 1.00 0.00 H ATOM 1240 N ASP A 155 -28.042 -33.183 34.039 1.00 33.49 N ATOM 1241 CA ASP A 155 -28.542 -33.660 32.754 1.00 33.96 C ATOM 1242 C ASP A 155 -27.950 -35.020 32.413 1.00 32.31 C ATOM 1243 O ASP A 155 -28.649 -35.890 31.882 1.00 34.79 O ATOM 1244 CB ASP A 155 -28.258 -32.625 31.666 1.00 35.40 C ATOM 1245 CG ASP A 155 -29.180 -31.411 31.779 1.00 39.44 C ATOM 1246 OD1 ASP A 155 -30.275 -31.556 32.380 1.00 42.51 O ATOM 1247 OD2 ASP A 155 -28.824 -30.323 31.284 1.00 39.09 O ATOM 1248 H ASP A 155 -27.368 -32.392 34.073 1.00 0.00 H ATOM 1249 N PHE A 156 -26.664 -35.219 32.696 1.00 30.33 N ATOM 1250 CA PHE A 156 -26.053 -36.525 32.469 1.00 28.74 C ATOM 1251 C PHE A 156 -26.751 -37.608 33.279 1.00 30.02 C ATOM 1252 O PHE A 156 -27.071 -38.684 32.758 1.00 31.12 O ATOM 1253 CB PHE A 156 -24.562 -36.457 32.801 1.00 27.17 C ATOM 1254 CG PHE A 156 -23.832 -37.731 32.541 1.00 26.93 C ATOM 1255 CD1 PHE A 156 -23.786 -38.727 33.497 1.00 30.21 C ATOM 1256 CD2 PHE A 156 -23.170 -37.923 31.345 1.00 26.03 C ATOM 1257 CE1 PHE A 156 -23.105 -39.901 33.254 1.00 31.01 C ATOM 1258 CE2 PHE A 156 -22.497 -39.094 31.098 1.00 25.68 C ATOM 1259 CZ PHE A 156 -22.460 -40.075 32.042 1.00 28.66 C ATOM 1260 H PHE A 156 -26.092 -34.440 33.081 1.00 0.00 H ATOM 1261 N GLU A 157 -27.019 -37.343 34.560 1.00 31.49 N ATOM 1262 CA GLU A 157 -27.655 -38.362 35.379 1.00 35.45 C ATOM 1263 C GLU A 157 -29.108 -38.589 34.985 1.00 33.52 C ATOM 1264 O GLU A 157 -29.620 -39.693 35.182 1.00 34.20 O ATOM 1265 CB GLU A 157 -27.578 -37.974 36.855 1.00 46.78 C ATOM 1266 CG GLU A 157 -26.163 -37.974 37.411 1.00 56.43 C ATOM 1267 CD GLU A 157 -25.497 -39.338 37.339 1.00 64.68 C ATOM 1268 OE1 GLU A 157 -26.201 -40.361 37.485 1.00 68.73 O ATOM 1269 OE2 GLU A 157 -24.266 -39.383 37.134 1.00 65.74 O ATOM 1270 H GLU A 157 -26.775 -36.418 34.967 1.00 0.00 H ATOM 1271 N ALA A 158 -29.759 -37.597 34.377 1.00 33.19 N ATOM 1272 CA ALA A 158 -31.125 -37.764 33.910 1.00 34.90 C ATOM 1273 C ALA A 158 -31.200 -38.345 32.512 1.00 34.62 C ATOM 1274 O ALA A 158 -32.308 -38.517 31.990 1.00 37.55 O ATOM 1275 CB ALA A 158 -31.857 -36.419 33.924 1.00 36.18 C ATOM 1276 H ALA A 158 -29.280 -36.685 34.234 1.00 0.00 H ATOM 1277 N ARG A 159 -30.055 -38.674 31.910 1.00 32.52 N ATOM 1278 CA ARG A 159 -30.000 -39.219 30.551 1.00 33.42 C ATOM 1279 C ARG A 159 -30.534 -38.215 29.537 1.00 33.79 C ATOM 1280 O ARG A 159 -31.206 -38.578 28.573 1.00 34.83 O ATOM 1281 CB ARG A 159 -30.744 -40.552 30.428 1.00 37.44 C ATOM 1282 CG ARG A 159 -30.023 -41.780 30.998 1.00 42.76 C ATOM 1283 CD ARG A 159 -29.418 -41.569 32.377 1.00 51.09 C ATOM 1284 NE ARG A 159 -28.721 -42.771 32.837 1.00 60.43 N ATOM 1285 CZ ARG A 159 -27.811 -42.794 33.808 1.00 66.71 C ATOM 1286 NH1 ARG A 159 -27.467 -41.674 34.429 1.00 71.63 N ATOM 1287 NH2 ARG A 159 -27.232 -43.936 34.149 1.00 65.87 N ATOM 1288 HE ARG A 159 -28.953 -43.672 32.372 1.00 0.00 H ATOM 1289 HH12 ARG A 159 -26.755 -41.697 35.187 1.00 0.00 H ATOM 1290 HH11 ARG A 159 -27.909 -40.772 34.158 1.00 0.00 H ATOM 1291 HH22 ARG A 159 -26.521 -43.952 34.908 1.00 0.00 H ATOM 1292 HH21 ARG A 159 -27.488 -44.816 33.658 1.00 0.00 H ATOM 1293 H ARG A 159 -29.163 -38.538 32.428 1.00 0.00 H ATOM 1294 N HIS A 160 -30.268 -36.930 29.780 1.00 33.04 N ATOM 1295 CA HIS A 160 -30.585 -35.877 28.819 1.00 32.50 C ATOM 1296 C HIS A 160 -29.276 -35.188 28.449 1.00 30.82 C ATOM 1297 O HIS A 160 -29.051 -34.024 28.802 1.00 34.35 O ATOM 1298 CB HIS A 160 -31.599 -34.874 29.403 1.00 35.05 C ATOM 1299 CG HIS A 160 -32.953 -35.456 29.674 1.00 42.22 C ATOM 1300 ND1 HIS A 160 -33.673 -35.168 30.812 1.00 44.73 N ATOM 1301 CD2 HIS A 160 -33.728 -36.287 28.938 1.00 44.01 C ATOM 1302 CE1 HIS A 160 -34.828 -35.811 30.774 1.00 48.06 C ATOM 1303 NE2 HIS A 160 -34.884 -36.498 29.647 1.00 47.38 N ATOM 1304 H HIS A 160 -29.821 -36.670 30.682 1.00 0.00 H ATOM 1305 N VAL A 161 -28.481 -35.845 27.614 1.00 27.29 N ATOM 1306 CA VAL A 161 -27.208 -35.253 27.232 1.00 26.27 C ATOM 1307 C VAL A 161 -27.475 -34.196 26.172 1.00 24.72 C ATOM 1308 O VAL A 161 -28.497 -34.223 25.481 1.00 26.92 O ATOM 1309 CB VAL A 161 -26.210 -36.305 26.712 1.00 29.57 C ATOM 1310 CG1 VAL A 161 -26.015 -37.397 27.739 1.00 36.34 C ATOM 1311 CG2 VAL A 161 -26.689 -36.870 25.382 1.00 27.49 C ATOM 1312 H VAL A 161 -28.764 -36.772 27.237 1.00 0.00 H ATOM 1313 N LYS A 162 -26.547 -33.261 26.045 1.00 23.21 N ATOM 1314 CA LYS A 162 -26.664 -32.195 25.059 1.00 21.96 C ATOM 1315 C LYS A 162 -25.802 -32.547 23.850 1.00 20.33 C ATOM 1316 O LYS A 162 -24.567 -32.478 23.897 1.00 19.25 O ATOM 1317 CB LYS A 162 -26.261 -30.849 25.662 1.00 24.05 C ATOM 1318 CG LYS A 162 -27.016 -30.488 26.946 1.00 28.26 C ATOM 1319 CD LYS A 162 -28.490 -30.320 26.674 1.00 34.27 C ATOM 1320 CE LYS A 162 -29.221 -29.705 27.873 1.00 42.19 C ATOM 1321 NZ LYS A 162 -30.674 -29.548 27.599 1.00 48.34 N ATOM 1322 HZ1 LYS A 162 -30.805 -28.925 26.776 1.00 0.00 H ATOM 1323 HZ2 LYS A 162 -31.091 -30.480 27.400 1.00 0.00 H ATOM 1324 HZ3 LYS A 162 -31.139 -29.129 28.430 1.00 0.00 H ATOM 1325 H LYS A 162 -25.713 -33.288 26.665 1.00 0.00 H ATOM 1326 N LEU A 163 -26.453 -32.905 22.747 1.00 19.90 N ATOM 1327 CA LEU A 163 -25.761 -33.237 21.512 1.00 18.73 C ATOM 1328 C LEU A 163 -25.418 -31.955 20.762 1.00 18.47 C ATOM 1329 O LEU A 163 -26.223 -31.017 20.718 1.00 20.83 O ATOM 1330 CB LEU A 163 -26.627 -34.142 20.645 1.00 20.61 C ATOM 1331 CG LEU A 163 -25.903 -34.768 19.458 1.00 22.51 C ATOM 1332 CD1 LEU A 163 -24.868 -35.764 19.932 1.00 21.82 C ATOM 1333 CD2 LEU A 163 -26.929 -35.416 18.545 1.00 26.73 C ATOM 1334 H LEU A 163 -27.492 -32.949 22.768 1.00 0.00 H ATOM 1335 N ASN A 164 -24.161 -31.854 20.338 1.00 17.04 N ATOM 1336 CA ASN A 164 -23.660 -30.751 19.534 1.00 17.13 C ATOM 1337 C ASN A 164 -23.429 -31.195 18.105 1.00 16.52 C ATOM 1338 O ASN A 164 -23.095 -32.353 17.867 1.00 16.60 O ATOM 1339 CB ASN A 164 -22.349 -30.238 20.096 1.00 17.35 C ATOM 1340 CG ASN A 164 -22.510 -29.685 21.473 1.00 19.16 C ATOM 1341 OD1 ASN A 164 -22.957 -28.559 21.634 1.00 19.89 O ATOM 1342 ND2 ASN A 164 -22.206 -30.485 22.485 1.00 20.43 N ATOM 1343 HD22 ASN A 164 -21.828 -31.436 22.301 1.00 0.00 H ATOM 1344 HD21 ASN A 164 -22.346 -30.162 23.464 1.00 0.00 H ATOM 1345 H ASN A 164 -23.496 -32.610 20.598 1.00 0.00 H ATOM 1346 N VAL A 165 -23.601 -30.266 17.165 1.00 15.45 N ATOM 1347 CA VAL A 165 -23.247 -30.459 15.767 1.00 15.05 C ATOM 1348 C VAL A 165 -22.261 -29.372 15.353 1.00 14.24 C ATOM 1349 O VAL A 165 -22.535 -28.177 15.552 1.00 15.83 O ATOM 1350 CB VAL A 165 -24.470 -30.418 14.835 1.00 18.97 C ATOM 1351 CG1 VAL A 165 -24.031 -30.760 13.391 1.00 18.59 C ATOM 1352 CG2 VAL A 165 -25.563 -31.341 15.328 1.00 22.87 C ATOM 1353 H VAL A 165 -24.011 -29.353 17.446 1.00 0.00 H ATOM 1354 N GLU A 166 -21.117 -29.786 14.785 1.00 13.61 N ATOM 1355 CA GLU A 166 -20.146 -28.868 14.216 1.00 14.06 C ATOM 1356 C GLU A 166 -19.755 -29.371 12.840 1.00 13.46 C ATOM 1357 O GLU A 166 -19.601 -30.579 12.634 1.00 14.22 O ATOM 1358 CB GLU A 166 -18.895 -28.735 15.087 1.00 14.97 C ATOM 1359 CG GLU A 166 -19.151 -28.009 16.392 1.00 16.76 C ATOM 1360 CD GLU A 166 -19.414 -26.522 16.190 1.00 19.04 C ATOM 1361 OE1 GLU A 166 -18.929 -25.960 15.180 1.00 19.62 O ATOM 1362 OE2 GLU A 166 -20.089 -25.891 17.035 1.00 21.37 O ATOM 1363 H GLU A 166 -20.918 -30.806 14.751 1.00 0.00 H ATOM 1364 N GLU A 167 -19.571 -28.447 11.916 1.00 14.11 N ATOM 1365 CA GLU A 167 -19.144 -28.777 10.572 1.00 13.78 C ATOM 1366 C GLU A 167 -17.959 -27.917 10.180 1.00 14.15 C ATOM 1367 O GLU A 167 -17.893 -26.730 10.528 1.00 15.68 O ATOM 1368 CB GLU A 167 -20.246 -28.578 9.546 1.00 15.25 C ATOM 1369 CG GLU A 167 -19.932 -29.193 8.194 1.00 16.37 C ATOM 1370 CD GLU A 167 -20.999 -28.892 7.190 1.00 18.69 C ATOM 1371 OE1 GLU A 167 -21.078 -27.737 6.730 1.00 19.91 O ATOM 1372 OE2 GLU A 167 -21.789 -29.801 6.875 1.00 19.27 O ATOM 1373 H GLU A 167 -19.738 -27.450 12.161 1.00 0.00 H ATOM 1374 N ARG A 168 -17.023 -28.539 9.485 1.00 12.86 N ATOM 1375 CA ARG A 168 -15.914 -27.815 8.888 1.00 13.20 C ATOM 1376 C ARG A 168 -15.721 -28.290 7.451 1.00 14.69 C ATOM 1377 O ARG A 168 -16.013 -29.441 7.126 1.00 14.80 O ATOM 1378 CB ARG A 168 -14.621 -28.013 9.663 1.00 13.72 C ATOM 1379 CG ARG A 168 -14.630 -27.588 11.113 1.00 14.27 C ATOM 1380 CD ARG A 168 -14.751 -26.051 11.250 1.00 14.71 C ATOM 1381 NE ARG A 168 -14.610 -25.652 12.654 1.00 15.86 N ATOM 1382 CZ ARG A 168 -15.574 -25.744 13.565 1.00 16.84 C ATOM 1383 NH1 ARG A 168 -16.789 -26.180 13.247 1.00 15.79 N ATOM 1384 NH2 ARG A 168 -15.315 -25.403 14.824 1.00 19.12 N ATOM 1385 HE ARG A 168 -13.692 -25.270 12.958 1.00 0.00 H ATOM 1386 HH12 ARG A 168 -17.527 -26.243 13.978 1.00 0.00 H ATOM 1387 HH11 ARG A 168 -17.002 -26.458 12.268 1.00 0.00 H ATOM 1388 HH22 ARG A 168 -16.061 -25.471 15.545 1.00 0.00 H ATOM 1389 HH21 ARG A 168 -14.366 -25.068 15.087 1.00 0.00 H ATOM 1390 H ARG A 168 -17.082 -29.570 9.363 1.00 0.00 H ATOM 1391 N SER A 169 -15.168 -27.421 6.601 1.00 15.63 N ATOM 1392 CA SER A 169 -14.891 -27.778 5.212 1.00 19.03 C ATOM 1393 C SER A 169 -13.395 -27.693 4.927 1.00 15.33 C ATOM 1394 O SER A 169 -12.716 -26.776 5.405 1.00 15.51 O ATOM 1395 CB SER A 169 -15.655 -26.876 4.228 1.00 19.67 C ATOM 1396 OG SER A 169 -15.349 -27.220 2.876 1.00 22.04 O ATOM 1397 HG SER A 169 -15.606 -28.162 2.710 1.00 0.00 H ATOM 1398 H SER A 169 -14.929 -26.466 6.936 1.00 0.00 H ATOM 1399 N VAL A 170 -12.906 -28.668 4.143 1.00 14.42 N ATOM 1400 CA VAL A 170 -11.499 -28.794 3.779 1.00 16.46 C ATOM 1401 C VAL A 170 -11.386 -28.919 2.265 1.00 15.12 C ATOM 1402 O VAL A 170 -12.159 -29.631 1.619 1.00 14.90 O ATOM 1403 CB VAL A 170 -10.847 -30.017 4.451 1.00 24.08 C ATOM 1404 CG1 VAL A 170 -9.434 -30.210 3.938 1.00 29.07 C ATOM 1405 CG2 VAL A 170 -10.874 -29.865 5.956 1.00 26.63 C ATOM 1406 H VAL A 170 -13.571 -29.376 3.773 1.00 0.00 H ATOM 1407 N GLY A 171 -10.376 -28.258 1.711 1.00 16.34 N ATOM 1408 CA GLY A 171 -10.039 -28.391 0.320 1.00 16.80 C ATOM 1409 C GLY A 171 -9.124 -27.257 -0.084 1.00 17.10 C ATOM 1410 O GLY A 171 -8.909 -26.310 0.689 1.00 18.24 O ATOM 1411 H GLY A 171 -9.808 -27.621 2.305 1.00 0.00 H ATOM 1412 N PRO A 172 -8.594 -27.295 -1.296 1.00 16.29 N ATOM 1413 CA PRO A 172 -8.859 -28.334 -2.293 1.00 17.60 C ATOM 1414 C PRO A 172 -8.051 -29.585 -2.043 1.00 18.51 C ATOM 1415 O PRO A 172 -6.888 -29.496 -1.694 1.00 21.54 O ATOM 1416 CB PRO A 172 -8.466 -27.671 -3.603 1.00 18.99 C ATOM 1417 CG PRO A 172 -7.441 -26.675 -3.255 1.00 20.92 C ATOM 1418 CD PRO A 172 -7.744 -26.216 -1.835 1.00 19.15 C ATOM 1419 N LEU A 173 -8.709 -30.735 -2.182 1.00 17.09 N ATOM 1420 CA LEU A 173 -8.042 -32.024 -2.084 1.00 17.15 C ATOM 1421 C LEU A 173 -7.416 -32.394 -3.418 1.00 20.36 C ATOM 1422 O LEU A 173 -7.926 -32.047 -4.487 1.00 22.49 O ATOM 1423 CB LEU A 173 -9.033 -33.102 -1.666 1.00 16.70 C ATOM 1424 CG LEU A 173 -9.740 -32.892 -0.332 1.00 19.51 C ATOM 1425 CD1 LEU A 173 -10.798 -33.985 -0.126 1.00 21.04 C ATOM 1426 CD2 LEU A 173 -8.735 -32.870 0.808 1.00 20.81 C ATOM 1427 H LEU A 173 -9.732 -30.710 -2.366 1.00 0.00 H ATOM 1428 N THR A 174 -6.286 -33.090 -3.355 1.00 23.95 N ATOM 1429 CA THR A 174 -5.602 -33.469 -4.591 1.00 29.30 C ATOM 1430 C THR A 174 -5.103 -34.904 -4.659 1.00 27.05 C ATOM 1431 O THR A 174 -4.831 -35.373 -5.773 1.00 31.67 O ATOM 1432 CB THR A 174 -4.420 -32.522 -4.836 1.00 36.21 C ATOM 1433 OG1 THR A 174 -3.569 -32.528 -3.686 1.00 33.49 O ATOM 1434 CG2 THR A 174 -4.915 -31.099 -5.110 1.00 43.23 C ATOM 1435 HG1 THR A 174 -4.082 -32.224 -2.896 1.00 0.00 H ATOM 1436 H THR A 174 -5.890 -33.364 -2.433 1.00 0.00 H ATOM 1437 N ARG A 175 -4.998 -35.635 -3.557 1.00 20.14 N ATOM 1438 CA ARG A 175 -4.504 -37.002 -3.571 1.00 18.46 C ATOM 1439 C ARG A 175 -5.660 -38.001 -3.693 1.00 18.23 C ATOM 1440 O ARG A 175 -6.832 -37.648 -3.569 1.00 19.76 O ATOM 1441 CB ARG A 175 -3.696 -37.275 -2.296 1.00 19.52 C ATOM 1442 CG ARG A 175 -2.519 -36.314 -2.062 1.00 26.06 C ATOM 1443 CD ARG A 175 -1.388 -36.619 -3.032 1.00 38.95 C ATOM 1444 NE ARG A 175 -0.108 -36.073 -2.586 1.00 52.53 N ATOM 1445 CZ ARG A 175 0.354 -34.868 -2.910 1.00 61.79 C ATOM 1446 NH1 ARG A 175 -0.353 -34.058 -3.688 1.00 64.29 N ATOM 1447 NH2 ARG A 175 1.534 -34.474 -2.452 1.00 65.87 N ATOM 1448 HE ARG A 175 0.484 -36.668 -1.972 1.00 0.00 H ATOM 1449 HH12 ARG A 175 0.019 -33.118 -3.934 1.00 0.00 H ATOM 1450 HH11 ARG A 175 -1.279 -34.363 -4.051 1.00 0.00 H ATOM 1451 HH22 ARG A 175 1.901 -33.533 -2.701 1.00 0.00 H ATOM 1452 HH21 ARG A 175 2.093 -35.105 -1.843 1.00 0.00 H ATOM 1453 H ARG A 175 -5.280 -35.214 -2.649 1.00 0.00 H ATOM 1454 N LYS A 176 -5.309 -39.280 -3.868 1.00 19.53 N ATOM 1455 CA LYS A 176 -6.337 -40.284 -4.108 1.00 21.60 C ATOM 1456 C LYS A 176 -7.255 -40.454 -2.906 1.00 20.19 C ATOM 1457 O LYS A 176 -8.419 -40.830 -3.069 1.00 20.83 O ATOM 1458 CB LYS A 176 -5.697 -41.628 -4.472 1.00 28.28 C ATOM 1459 CG LYS A 176 -5.039 -41.622 -5.845 1.00 40.11 C ATOM 1460 CD LYS A 176 -4.511 -42.995 -6.223 1.00 51.82 C ATOM 1461 CE LYS A 176 -3.907 -42.969 -7.617 1.00 58.54 C ATOM 1462 NZ LYS A 176 -3.373 -44.297 -8.036 1.00 62.52 N ATOM 1463 HZ1 LYS A 176 -2.631 -44.596 -7.372 1.00 0.00 H ATOM 1464 HZ2 LYS A 176 -4.144 -44.995 -8.034 1.00 0.00 H ATOM 1465 HZ3 LYS A 176 -2.973 -44.222 -8.993 1.00 0.00 H ATOM 1466 H LYS A 176 -4.307 -39.556 -3.833 1.00 0.00 H ATOM 1467 N GLY A 177 -6.760 -40.196 -1.702 1.00 16.02 N ATOM 1468 CA GLY A 177 -7.609 -40.343 -0.530 1.00 14.93 C ATOM 1469 C GLY A 177 -7.076 -39.545 0.632 1.00 15.09 C ATOM 1470 O GLY A 177 -6.082 -38.825 0.537 1.00 16.61 O ATOM 1471 H GLY A 177 -5.771 -39.891 -1.597 1.00 0.00 H ATOM 1472 N PHE A 178 -7.757 -39.712 1.758 1.00 13.20 N ATOM 1473 CA PHE A 178 -7.418 -38.953 2.947 1.00 11.79 C ATOM 1474 C PHE A 178 -7.894 -39.704 4.176 1.00 11.22 C ATOM 1475 O PHE A 178 -8.748 -40.595 4.103 1.00 11.36 O ATOM 1476 CB PHE A 178 -8.031 -37.540 2.923 1.00 12.19 C ATOM 1477 CG PHE A 178 -9.532 -37.539 2.861 1.00 12.40 C ATOM 1478 CD1 PHE A 178 -10.279 -37.513 4.032 1.00 12.78 C ATOM 1479 CD2 PHE A 178 -10.195 -37.567 1.644 1.00 13.00 C ATOM 1480 CE1 PHE A 178 -11.657 -37.556 3.994 1.00 13.31 C ATOM 1481 CE2 PHE A 178 -11.587 -37.597 1.599 1.00 13.25 C ATOM 1482 CZ PHE A 178 -12.315 -37.567 2.762 1.00 13.25 C ATOM 1483 H PHE A 178 -8.542 -40.394 1.789 1.00 0.00 H ATOM 1484 N TYR A 179 -7.338 -39.306 5.307 1.00 11.22 N ATOM 1485 CA TYR A 179 -7.763 -39.718 6.633 1.00 11.15 C ATOM 1486 C TYR A 179 -8.248 -38.503 7.401 1.00 10.57 C ATOM 1487 O TYR A 179 -7.704 -37.396 7.249 1.00 11.29 O ATOM 1488 CB TYR A 179 -6.600 -40.321 7.441 1.00 12.36 C ATOM 1489 CG TYR A 179 -5.890 -41.512 6.842 1.00 12.06 C ATOM 1490 CD1 TYR A 179 -6.338 -42.788 7.082 1.00 11.28 C ATOM 1491 CD2 TYR A 179 -4.763 -41.351 6.070 1.00 11.88 C ATOM 1492 CE1 TYR A 179 -5.667 -43.864 6.571 1.00 11.42 C ATOM 1493 CE2 TYR A 179 -4.089 -42.421 5.565 1.00 12.82 C ATOM 1494 CZ TYR A 179 -4.571 -43.665 5.802 1.00 13.31 C ATOM 1495 OH TYR A 179 -3.890 -44.731 5.269 1.00 15.87 O ATOM 1496 HH TYR A 179 -4.349 -45.572 5.519 1.00 0.00 H ATOM 1497 H TYR A 179 -6.535 -38.648 5.242 1.00 0.00 H ATOM 1498 N LEU A 180 -9.210 -38.719 8.290 1.00 9.87 N ATOM 1499 CA LEU A 180 -9.455 -37.769 9.371 1.00 10.65 C ATOM 1500 C LEU A 180 -8.919 -38.351 10.673 1.00 10.70 C ATOM 1501 O LEU A 180 -8.873 -39.566 10.857 1.00 10.78 O ATOM 1502 CB LEU A 180 -10.949 -37.454 9.540 1.00 11.88 C ATOM 1503 CG LEU A 180 -11.701 -36.962 8.309 1.00 12.67 C ATOM 1504 CD1 LEU A 180 -13.149 -36.670 8.665 1.00 13.90 C ATOM 1505 CD2 LEU A 180 -11.010 -35.782 7.670 1.00 13.38 C ATOM 1506 H LEU A 180 -9.796 -39.575 8.215 1.00 0.00 H ATOM 1507 N ALA A 181 -8.558 -37.472 11.601 1.00 10.82 N ATOM 1508 CA ALA A 181 -8.179 -37.924 12.934 1.00 10.91 C ATOM 1509 C ALA A 181 -8.682 -36.938 13.975 1.00 10.19 C ATOM 1510 O ALA A 181 -8.920 -35.760 13.680 1.00 11.85 O ATOM 1511 CB ALA A 181 -6.661 -38.086 13.064 1.00 11.26 C ATOM 1512 H ALA A 181 -8.546 -36.457 11.376 1.00 0.00 H ATOM 1513 N PHE A 182 -8.872 -37.456 15.187 1.00 10.14 N ATOM 1514 CA PHE A 182 -9.404 -36.706 16.325 1.00 10.75 C ATOM 1515 C PHE A 182 -8.417 -36.830 17.470 1.00 12.21 C ATOM 1516 O PHE A 182 -8.051 -37.942 17.852 1.00 13.21 O ATOM 1517 CB PHE A 182 -10.789 -37.233 16.705 1.00 10.67 C ATOM 1518 CG PHE A 182 -11.726 -37.295 15.543 1.00 11.92 C ATOM 1519 CD1 PHE A 182 -11.778 -38.407 14.742 1.00 13.12 C ATOM 1520 CD2 PHE A 182 -12.516 -36.206 15.232 1.00 14.00 C ATOM 1521 CE1 PHE A 182 -12.634 -38.452 13.651 1.00 13.52 C ATOM 1522 CE2 PHE A 182 -13.360 -36.257 14.145 1.00 15.04 C ATOM 1523 CZ PHE A 182 -13.406 -37.353 13.361 1.00 14.21 C ATOM 1524 H PHE A 182 -8.627 -38.456 15.334 1.00 0.00 H ATOM 1525 N GLN A 183 -7.990 -35.695 18.008 1.00 12.36 N ATOM 1526 CA GLN A 183 -7.033 -35.655 19.099 1.00 12.88 C ATOM 1527 C GLN A 183 -7.749 -35.173 20.346 1.00 13.28 C ATOM 1528 O GLN A 183 -8.334 -34.085 20.345 1.00 14.78 O ATOM 1529 CB GLN A 183 -5.865 -34.730 18.793 1.00 14.28 C ATOM 1530 CG GLN A 183 -4.871 -34.675 19.919 1.00 15.86 C ATOM 1531 CD GLN A 183 -3.956 -33.471 19.826 1.00 18.93 C ATOM 1532 OE1 GLN A 183 -4.332 -32.413 19.276 1.00 20.14 O ATOM 1533 NE2 GLN A 183 -2.736 -33.618 20.339 1.00 20.66 N ATOM 1534 HE22 GLN A 183 -2.465 -34.516 20.788 1.00 0.00 H ATOM 1535 HE21 GLN A 183 -2.054 -32.835 20.291 1.00 0.00 H ATOM 1536 H GLN A 183 -8.356 -34.797 17.633 1.00 0.00 H ATOM 1537 N ASP A 184 -7.686 -35.972 21.392 1.00 12.97 N ATOM 1538 CA ASP A 184 -8.154 -35.587 22.718 1.00 14.40 C ATOM 1539 C ASP A 184 -6.972 -35.162 23.570 1.00 17.00 C ATOM 1540 O ASP A 184 -5.962 -35.876 23.645 1.00 18.60 O ATOM 1541 CB ASP A 184 -8.894 -36.739 23.382 1.00 14.50 C ATOM 1542 CG ASP A 184 -9.011 -36.543 24.859 1.00 16.08 C ATOM 1543 OD1 ASP A 184 -9.741 -35.599 25.255 1.00 17.13 O ATOM 1544 OD2 ASP A 184 -8.365 -37.288 25.633 1.00 16.94 O ATOM 1545 H ASP A 184 -7.283 -36.922 21.266 1.00 0.00 H ATOM 1546 N ILE A 185 -7.109 -34.003 24.218 1.00 17.86 N ATOM 1547 CA ILE A 185 -6.077 -33.428 25.074 1.00 19.53 C ATOM 1548 C ILE A 185 -6.489 -33.436 26.550 1.00 20.26 C ATOM 1549 O ILE A 185 -5.837 -32.793 27.383 1.00 23.05 O ATOM 1550 CB ILE A 185 -5.726 -32.005 24.601 1.00 24.47 C ATOM 1551 CG1 ILE A 185 -7.005 -31.162 24.523 1.00 29.56 C ATOM 1552 CG2 ILE A 185 -5.021 -32.058 23.235 1.00 23.67 C ATOM 1553 CD1 ILE A 185 -6.781 -29.673 24.474 1.00 35.79 C ATOM 1554 H ILE A 185 -8.001 -33.481 24.106 1.00 0.00 H ATOM 1555 N GLY A 186 -7.555 -34.154 26.892 1.00 19.35 N ATOM 1556 CA GLY A 186 -7.995 -34.265 28.277 1.00 20.15 C ATOM 1557 C GLY A 186 -9.420 -33.814 28.528 1.00 19.85 C ATOM 1558 O GLY A 186 -9.720 -33.219 29.569 1.00 22.41 O ATOM 1559 H GLY A 186 -8.089 -34.650 26.150 1.00 0.00 H ATOM 1560 N ALA A 187 -10.310 -34.112 27.594 1.00 18.44 N ATOM 1561 CA ALA A 187 -11.713 -33.757 27.689 1.00 18.52 C ATOM 1562 C ALA A 187 -12.511 -35.022 27.977 1.00 18.41 C ATOM 1563 O ALA A 187 -11.980 -36.136 27.963 1.00 19.25 O ATOM 1564 CB ALA A 187 -12.205 -33.094 26.401 1.00 18.20 C ATOM 1565 H ALA A 187 -9.987 -34.626 26.750 1.00 0.00 H ATOM 1566 N CYS A 188 -13.799 -34.844 28.233 1.00 18.05 N ATOM 1567 CA CYS A 188 -14.698 -35.962 28.476 1.00 16.91 C ATOM 1568 C CYS A 188 -15.709 -35.926 27.333 1.00 16.58 C ATOM 1569 O CYS A 188 -16.758 -35.295 27.434 1.00 17.64 O ATOM 1570 CB CYS A 188 -15.323 -35.838 29.847 1.00 18.92 C ATOM 1571 SG CYS A 188 -16.215 -37.298 30.397 1.00 21.19 S ATOM 1572 H CYS A 188 -14.179 -33.876 28.261 1.00 0.00 H ATOM 1573 N VAL A 189 -15.378 -36.594 26.226 1.00 15.67 N ATOM 1574 CA VAL A 189 -16.027 -36.382 24.935 1.00 16.58 C ATOM 1575 C VAL A 189 -16.537 -37.711 24.402 1.00 15.62 C ATOM 1576 O VAL A 189 -15.822 -38.722 24.453 1.00 15.02 O ATOM 1577 CB VAL A 189 -15.064 -35.768 23.892 1.00 17.63 C ATOM 1578 CG1 VAL A 189 -15.694 -35.793 22.494 1.00 17.10 C ATOM 1579 CG2 VAL A 189 -14.675 -34.368 24.265 1.00 17.64 C ATOM 1580 H VAL A 189 -14.619 -37.302 26.286 1.00 0.00 H ATOM 1581 N ALA A 190 -17.746 -37.704 23.863 1.00 15.16 N ATOM 1582 CA ALA A 190 -18.287 -38.825 23.118 1.00 13.38 C ATOM 1583 C ALA A 190 -18.570 -38.360 21.697 1.00 13.04 C ATOM 1584 O ALA A 190 -19.316 -37.390 21.509 1.00 14.53 O ATOM 1585 CB ALA A 190 -19.574 -39.374 23.740 1.00 14.39 C ATOM 1586 H ALA A 190 -18.336 -36.855 23.979 1.00 0.00 H ATOM 1587 N LEU A 191 -18.012 -39.066 20.731 1.00 12.53 N ATOM 1588 CA LEU A 191 -18.160 -38.749 19.307 1.00 12.46 C ATOM 1589 C LEU A 191 -19.144 -39.763 18.717 1.00 12.66 C ATOM 1590 O LEU A 191 -18.838 -40.968 18.615 1.00 13.36 O ATOM 1591 CB LEU A 191 -16.801 -38.801 18.605 1.00 13.48 C ATOM 1592 CG LEU A 191 -16.763 -38.476 17.111 1.00 15.10 C ATOM 1593 CD1 LEU A 191 -17.212 -37.070 16.826 1.00 16.19 C ATOM 1594 CD2 LEU A 191 -15.314 -38.691 16.615 1.00 15.45 C ATOM 1595 H LEU A 191 -17.437 -39.891 20.994 1.00 0.00 H ATOM 1596 N LEU A 192 -20.327 -39.276 18.352 1.00 12.92 N ATOM 1597 CA LEU A 192 -21.445 -40.115 17.925 1.00 12.71 C ATOM 1598 C LEU A 192 -21.645 -40.129 16.415 1.00 12.83 C ATOM 1599 O LEU A 192 -22.295 -41.061 15.900 1.00 14.59 O ATOM 1600 CB LEU A 192 -22.759 -39.664 18.580 1.00 14.72 C ATOM 1601 CG LEU A 192 -23.039 -40.236 19.971 1.00 21.32 C ATOM 1602 CD1 LEU A 192 -22.116 -39.581 20.937 1.00 20.57 C ATOM 1603 CD2 LEU A 192 -24.502 -40.010 20.353 1.00 27.70 C ATOM 1604 H LEU A 192 -20.463 -38.245 18.372 1.00 0.00 H ATOM 1605 N SER A 193 -21.160 -39.117 15.692 1.00 12.74 N ATOM 1606 CA SER A 193 -21.421 -39.046 14.262 1.00 12.79 C ATOM 1607 C SER A 193 -20.245 -38.355 13.596 1.00 11.60 C ATOM 1608 O SER A 193 -19.718 -37.369 14.119 1.00 11.99 O ATOM 1609 CB SER A 193 -22.738 -38.316 13.963 1.00 14.65 C ATOM 1610 OG SER A 193 -23.127 -38.481 12.603 1.00 14.83 O ATOM 1611 HG SER A 193 -22.423 -38.113 12.013 1.00 0.00 H ATOM 1612 H SER A 193 -20.593 -38.376 16.152 1.00 0.00 H ATOM 1613 N VAL A 194 -19.816 -38.927 12.470 1.00 11.63 N ATOM 1614 CA VAL A 194 -18.803 -38.355 11.598 1.00 12.23 C ATOM 1615 C VAL A 194 -19.313 -38.611 10.179 1.00 12.26 C ATOM 1616 O VAL A 194 -19.262 -39.745 9.697 1.00 12.67 O ATOM 1617 CB VAL A 194 -17.420 -39.000 11.790 1.00 12.07 C ATOM 1618 CG1 VAL A 194 -16.398 -38.348 10.850 1.00 12.66 C ATOM 1619 CG2 VAL A 194 -16.942 -38.919 13.218 1.00 11.65 C ATOM 1620 H VAL A 194 -20.233 -39.840 12.199 1.00 0.00 H ATOM 1621 N ARG A 195 -19.774 -37.563 9.503 1.00 11.74 N ATOM 1622 CA ARG A 195 -20.340 -37.691 8.167 1.00 12.75 C ATOM 1623 C ARG A 195 -19.555 -36.756 7.252 1.00 12.97 C ATOM 1624 O ARG A 195 -19.493 -35.552 7.509 1.00 13.20 O ATOM 1625 CB ARG A 195 -21.837 -37.380 8.183 1.00 15.05 C ATOM 1626 CG ARG A 195 -22.566 -37.778 6.910 1.00 17.29 C ATOM 1627 CD ARG A 195 -24.092 -37.615 7.021 1.00 19.00 C ATOM 1628 NE ARG A 195 -24.431 -36.201 7.095 1.00 19.94 N ATOM 1629 CZ ARG A 195 -24.734 -35.455 6.037 1.00 22.92 C ATOM 1630 NH1 ARG A 195 -24.789 -35.994 4.821 1.00 25.06 N ATOM 1631 NH2 ARG A 195 -24.985 -34.164 6.191 1.00 23.88 N ATOM 1632 HE ARG A 195 -24.436 -35.748 8.031 1.00 0.00 H ATOM 1633 HH12 ARG A 195 -25.027 -35.402 4.000 1.00 0.00 H ATOM 1634 HH11 ARG A 195 -24.594 -37.007 4.692 1.00 0.00 H ATOM 1635 HH22 ARG A 195 -25.222 -33.578 5.365 1.00 0.00 H ATOM 1636 HH21 ARG A 195 -24.945 -33.736 7.138 1.00 0.00 H ATOM 1637 H ARG A 195 -19.729 -36.621 9.942 1.00 0.00 H ATOM 1638 N VAL A 196 -18.930 -37.316 6.229 1.00 13.11 N ATOM 1639 CA VAL A 196 -18.103 -36.565 5.289 1.00 13.47 C ATOM 1640 C VAL A 196 -18.763 -36.633 3.918 1.00 13.31 C ATOM 1641 O VAL A 196 -19.086 -37.723 3.433 1.00 14.11 O ATOM 1642 CB VAL A 196 -16.669 -37.126 5.219 1.00 14.97 C ATOM 1643 CG1 VAL A 196 -15.810 -36.267 4.305 1.00 16.05 C ATOM 1644 CG2 VAL A 196 -16.055 -37.213 6.614 1.00 15.24 C ATOM 1645 H VAL A 196 -19.033 -38.341 6.088 1.00 0.00 H ATOM 1646 N TYR A 197 -18.948 -35.481 3.287 1.00 13.22 N ATOM 1647 CA TYR A 197 -19.643 -35.450 2.016 1.00 13.72 C ATOM 1648 C TYR A 197 -19.062 -34.360 1.132 1.00 14.93 C ATOM 1649 O TYR A 197 -18.398 -33.444 1.599 1.00 15.13 O ATOM 1650 CB TYR A 197 -21.151 -35.218 2.207 1.00 14.31 C ATOM 1651 CG TYR A 197 -21.539 -33.885 2.831 1.00 16.06 C ATOM 1652 CD1 TYR A 197 -21.655 -33.737 4.211 1.00 15.14 C ATOM 1653 CD2 TYR A 197 -21.785 -32.794 2.035 1.00 17.48 C ATOM 1654 CE1 TYR A 197 -22.016 -32.526 4.769 1.00 15.83 C ATOM 1655 CE2 TYR A 197 -22.148 -31.571 2.590 1.00 17.50 C ATOM 1656 CZ TYR A 197 -22.255 -31.451 3.940 1.00 17.54 C ATOM 1657 OH TYR A 197 -22.622 -30.212 4.453 1.00 20.34 O ATOM 1658 HH TYR A 197 -22.662 -30.264 5.441 1.00 0.00 H ATOM 1659 H TYR A 197 -18.593 -34.598 3.706 1.00 0.00 H ATOM 1660 N TYR A 198 -19.368 -34.455 -0.154 1.00 16.80 N ATOM 1661 CA TYR A 198 -19.174 -33.327 -1.051 1.00 18.17 C ATOM 1662 C TYR A 198 -20.518 -32.984 -1.669 1.00 18.95 C ATOM 1663 O TYR A 198 -21.472 -33.777 -1.635 1.00 17.91 O ATOM 1664 CB TYR A 198 -18.080 -33.588 -2.101 1.00 19.67 C ATOM 1665 CG TYR A 198 -18.311 -34.661 -3.130 1.00 22.06 C ATOM 1666 CD1 TYR A 198 -17.965 -35.990 -2.880 1.00 22.22 C ATOM 1667 CD2 TYR A 198 -18.818 -34.340 -4.375 1.00 22.81 C ATOM 1668 CE1 TYR A 198 -18.144 -36.976 -3.843 1.00 25.08 C ATOM 1669 CE2 TYR A 198 -19.005 -35.311 -5.338 1.00 24.32 C ATOM 1670 CZ TYR A 198 -18.668 -36.624 -5.073 1.00 26.56 C ATOM 1671 OH TYR A 198 -18.878 -37.573 -6.056 1.00 29.44 O ATOM 1672 HH TYR A 198 -18.591 -38.460 -5.723 1.00 0.00 H ATOM 1673 H TYR A 198 -19.752 -35.347 -0.526 1.00 0.00 H ATOM 1674 N LYS A 199 -20.619 -31.756 -2.162 1.00 21.63 N ATOM 1675 CA LYS A 199 -21.919 -31.163 -2.439 1.00 27.15 C ATOM 1676 C LYS A 199 -22.046 -30.822 -3.907 1.00 30.86 C ATOM 1677 O LYS A 199 -21.252 -30.037 -4.432 1.00 37.17 O ATOM 1678 CB LYS A 199 -22.105 -29.911 -1.566 1.00 32.50 C ATOM 1679 CG LYS A 199 -23.482 -29.275 -1.604 1.00 41.18 C ATOM 1680 CD LYS A 199 -23.574 -28.030 -0.686 1.00 48.41 C ATOM 1681 CE LYS A 199 -24.830 -27.208 -1.014 1.00 52.92 C ATOM 1682 NZ LYS A 199 -25.149 -26.040 -0.132 1.00 52.80 N ATOM 1683 HZ1 LYS A 199 -25.287 -26.372 0.844 1.00 0.00 H ATOM 1684 HZ2 LYS A 199 -24.362 -25.360 -0.161 1.00 0.00 H ATOM 1685 HZ3 LYS A 199 -26.019 -25.580 -0.469 1.00 0.00 H ATOM 1686 H LYS A 199 -19.756 -31.209 -2.353 1.00 0.00 H ATOM 1687 N LYS A 200 -23.046 -31.407 -4.560 1.00 27.75 N ATOM 1688 CA LYS A 200 -23.436 -31.038 -5.913 1.00 31.02 C ATOM 1689 C LYS A 200 -24.575 -30.014 -5.872 1.00 29.46 C ATOM 1690 O LYS A 200 -25.165 -29.740 -4.821 1.00 29.10 O ATOM 1691 CB LYS A 200 -23.847 -32.271 -6.716 1.00 37.21 C ATOM 1692 CG LYS A 200 -22.805 -33.378 -6.689 1.00 44.20 C ATOM 1693 CD LYS A 200 -22.602 -34.011 -8.059 1.00 54.54 C ATOM 1694 CE LYS A 200 -21.436 -34.990 -8.026 1.00 61.88 C ATOM 1695 NZ LYS A 200 -20.985 -35.422 -9.382 1.00 67.70 N ATOM 1696 HZ1 LYS A 200 -21.772 -35.890 -9.875 1.00 0.00 H ATOM 1697 HZ2 LYS A 200 -20.679 -34.590 -9.926 1.00 0.00 H ATOM 1698 HZ3 LYS A 200 -20.190 -36.086 -9.286 1.00 0.00 H ATOM 1699 H LYS A 200 -23.574 -32.164 -4.081 1.00 0.00 H ATOM 1700 N ALA A 201 -24.890 -29.450 -7.034 1.00 30.58 N ATOM 1701 CA ALA A 201 -26.035 -28.555 -7.131 1.00 30.07 C ATOM 1702 C ALA A 201 -27.326 -29.280 -6.746 1.00 30.43 C ATOM 1703 O ALA A 201 -27.411 -30.513 -6.762 1.00 30.94 O ATOM 1704 CB ALA A 201 -26.169 -27.995 -8.541 1.00 31.15 C ATOM 1705 H ALA A 201 -24.316 -29.649 -7.878 1.00 0.00 H ATOM 1706 N HIS A 202 -28.339 -28.479 -6.390 1.00 29.26 N ATOM 1707 CA HIS A 202 -29.670 -28.965 -6.007 1.00 30.67 C ATOM 1708 C HIS A 202 -29.626 -29.793 -4.734 1.00 28.02 C ATOM 1709 O HIS A 202 -30.201 -30.880 -4.633 1.00 30.24 O ATOM 1710 CB HIS A 202 -30.305 -29.738 -7.160 1.00 32.65 C ATOM 1711 CG HIS A 202 -30.143 -29.048 -8.471 1.00 34.76 C ATOM 1712 ND1 HIS A 202 -30.734 -27.833 -8.745 1.00 37.11 N ATOM 1713 CD2 HIS A 202 -29.425 -29.375 -9.572 1.00 35.43 C ATOM 1714 CE1 HIS A 202 -30.404 -27.450 -9.965 1.00 37.80 C ATOM 1715 NE2 HIS A 202 -29.607 -28.368 -10.486 1.00 37.16 N ATOM 1716 H HIS A 202 -28.173 -27.452 -6.385 1.00 0.00 H ATOM 1717 N HIS A 203 -28.943 -29.266 -3.726 1.00 24.48 N ATOM 1718 CA HIS A 203 -28.867 -29.942 -2.441 1.00 23.00 C ATOM 1719 C HIS A 203 -30.117 -29.606 -1.627 1.00 24.24 C ATOM 1720 O HIS A 203 -30.257 -28.497 -1.103 1.00 24.77 O ATOM 1721 CB HIS A 203 -27.598 -29.550 -1.702 1.00 23.15 C ATOM 1722 CG HIS A 203 -27.568 -30.042 -0.296 1.00 29.70 C ATOM 1723 ND1 HIS A 203 -28.085 -31.266 0.072 1.00 31.75 N ATOM 1724 CD2 HIS A 203 -27.106 -29.470 0.840 1.00 31.39 C ATOM 1725 CE1 HIS A 203 -27.945 -31.427 1.376 1.00 31.41 C ATOM 1726 NE2 HIS A 203 -27.352 -30.351 1.867 1.00 29.93 N ATOM 1727 H HIS A 203 -28.455 -28.357 -3.857 1.00 0.00 H ATOM 1728 N HIS A 204 -31.034 -30.572 -1.540 1.00 28.14 N ATOM 1729 CA HIS A 204 -32.235 -30.473 -0.715 1.00 30.61 C ATOM 1730 C HIS A 204 -32.725 -31.889 -0.423 1.00 31.91 C ATOM 1731 O HIS A 204 -32.196 -32.872 -0.952 1.00 30.99 O ATOM 1732 CB HIS A 204 -33.316 -29.634 -1.407 1.00 30.74 C ATOM 1733 CG HIS A 204 -33.721 -30.146 -2.754 1.00 30.88 C ATOM 1734 ND1 HIS A 204 -34.536 -31.249 -2.918 1.00 29.21 N ATOM 1735 CD2 HIS A 204 -33.445 -29.696 -3.999 1.00 32.26 C ATOM 1736 CE1 HIS A 204 -34.729 -31.462 -4.206 1.00 31.78 C ATOM 1737 NE2 HIS A 204 -34.084 -30.529 -4.885 1.00 31.06 N ATOM 1738 H HIS A 204 -30.885 -31.442 -2.089 1.00 0.00 H ATOM 1739 N HIS A 205 -33.749 -31.987 0.425 1.00 33.66 N ATOM 1740 CA HIS A 205 -34.401 -33.257 0.737 1.00 37.01 C ATOM 1741 C HIS A 205 -35.786 -33.297 0.077 1.00 53.42 C ATOM 1742 O HIS A 205 -36.178 -32.389 -0.660 1.00 46.54 O ATOM 1743 CB HIS A 205 -34.496 -33.464 2.251 1.00 31.26 C ATOM 1744 CG HIS A 205 -33.211 -33.234 2.991 1.00 33.88 C ATOM 1745 ND1 HIS A 205 -32.058 -33.947 2.745 1.00 30.90 N ATOM 1746 CD2 HIS A 205 -32.912 -32.382 4.001 1.00 33.08 C ATOM 1747 CE1 HIS A 205 -31.101 -33.536 3.561 1.00 32.18 C ATOM 1748 NE2 HIS A 205 -31.594 -32.581 4.330 1.00 32.48 N ATOM 1749 H HIS A 205 -34.099 -31.122 0.884 1.00 0.00 H ATOM 1750 N HIS A 206 -36.536 -34.367 0.330 1.00 79.54 N ATOM 1751 CA HIS A 206 -37.827 -34.545 -0.331 1.00103.12 C ATOM 1752 C HIS A 206 -38.704 -35.466 0.514 1.00108.81 C ATOM 1753 O HIS A 206 -38.346 -35.831 1.638 1.00108.51 O ATOM 1754 CB HIS A 206 -37.636 -35.086 -1.753 1.00116.48 C ATOM 1755 CG HIS A 206 -36.927 -36.403 -1.804 1.00124.20 C ATOM 1756 ND1 HIS A 206 -37.502 -37.575 -1.362 1.00126.25 N ATOM 1757 CD2 HIS A 206 -35.688 -36.732 -2.240 1.00125.62 C ATOM 1758 CE1 HIS A 206 -36.648 -38.570 -1.525 1.00125.87 C ATOM 1759 NE2 HIS A 206 -35.540 -38.086 -2.056 1.00124.99 N ATOM 1760 H HIS A 206 -36.200 -35.083 1.005 1.00 0.00 H ATOM 1761 N HIS A 207 -39.858 -35.843 -0.041 1.00114.21 N ATOM 1762 CA HIS A 207 -40.890 -36.611 0.663 1.00119.90 C ATOM 1763 C HIS A 207 -41.490 -35.798 1.808 1.00122.42 C ATOM 1764 O HIS A 207 -42.532 -35.160 1.648 1.00124.55 O ATOM 1765 CB HIS A 207 -40.333 -37.935 1.198 1.00121.51 C ATOM 1766 CG HIS A 207 -40.144 -38.983 0.144 1.00123.14 C ATOM 1767 ND1 HIS A 207 -39.542 -40.197 0.402 1.00122.61 N ATOM 1768 CD2 HIS A 207 -40.480 -39.002 -1.168 1.00124.59 C ATOM 1769 CE1 HIS A 207 -39.513 -40.916 -0.706 1.00123.09 C ATOM 1770 NE2 HIS A 207 -40.076 -40.214 -1.673 1.00124.42 N ATOM 1771 OXT HIS A 207 -40.954 -35.759 2.915 1.00122.32 O ATOM 1772 H HIS A 207 -40.036 -35.576 -1.030 1.00 0.00 H TER 1773 HIS A 207 HETATM 1774 O HOH 1 -4.193 -27.734 36.277 1.00 31.42 O HETATM 1775 O HOH 2 -4.746 -30.701 39.115 1.00 34.89 O HETATM 1776 O HOH 3 -3.374 -30.239 18.711 1.00 58.06 O HETATM 1777 O HOH 4 -7.089 -33.364 31.410 1.00 41.25 O HETATM 1778 O HOH 5 -20.713 -34.424 38.873 1.00 39.81 O HETATM 1779 O HOH 6 -24.507 -24.359 1.496 1.00 16.26 O HETATM 1780 O HOH 7 -12.234 -50.959 26.642 1.00 45.77 O HETATM 1781 O HOH 8 -18.015 -30.187 -2.410 1.00 24.41 O HETATM 1782 O HOH 9 -10.016 -50.094 16.774 1.00 28.53 O HETATM 1783 O HOH 10 -21.246 -53.736 15.181 1.00 31.36 O HETATM 1784 O HOH 11 -14.156 -31.217 44.103 1.00 34.35 O HETATM 1785 O HOH 12 -25.711 -31.341 5.185 1.00 23.92 O HETATM 1786 O HOH 13 -12.344 -49.285 17.147 1.00 23.70 O HETATM 1787 O HOH 14 -19.199 -23.945 19.596 1.00 33.69 O HETATM 1788 O HOH 15 2.027 -39.836 -4.055 1.00 38.75 O HETATM 1789 O HOH 16 -26.450 -29.794 30.446 1.00 28.25 O HETATM 1790 O HOH 17 -13.992 -51.098 22.945 1.00 28.44 O HETATM 1791 O HOH 18 -4.406 -30.888 -1.883 1.00 35.30 O HETATM 1792 O HOH 19 -0.090 -39.939 21.362 1.00 34.57 O HETATM 1793 O HOH 20 -0.045 -37.987 4.234 1.00 26.17 O HETATM 1794 O HOH 21 -22.529 -36.143 11.602 1.00 13.24 O HETATM 1795 O HOH 22 -25.676 -27.391 -3.795 1.00 29.70 O HETATM 1796 O HOH 23 -9.650 -41.350 -5.335 1.00 26.45 O HETATM 1797 O HOH 24 -30.624 -35.346 37.342 1.00 30.65 O HETATM 1798 O HOH 25 -21.976 -40.448 11.135 1.00 14.83 O HETATM 1799 O HOH 26 -4.702 -33.632 29.610 1.00 42.79 O HETATM 1800 O HOH 27 -24.220 -30.558 7.652 1.00 27.26 O HETATM 1801 O HOH 28 -8.575 -28.805 21.817 1.00 29.70 O HETATM 1802 O HOH 29 -20.909 -46.915 14.030 1.00 36.40 O HETATM 1803 O HOH 30 -13.853 -44.279 26.882 1.00 29.26 O HETATM 1804 O HOH 31 0.829 -34.943 19.703 1.00 41.83 O HETATM 1805 O HOH 32 -21.453 -33.720 33.377 1.00 22.26 O HETATM 1806 O HOH 33 -9.766 -33.123 23.919 1.00 18.23 O HETATM 1807 O HOH 34 -12.828 -22.121 15.336 1.00 43.86 O HETATM 1808 O HOH 35 -25.972 -52.943 16.283 1.00 25.48 O HETATM 1809 O HOH 36 -21.358 -25.938 35.522 1.00 22.76 O HETATM 1810 O HOH 37 -6.253 -35.572 32.671 1.00 34.14 O HETATM 1811 O HOH 38 -11.351 -44.653 27.472 1.00 37.11 O HETATM 1812 O HOH 39 -29.684 -47.164 22.433 1.00 27.77 O HETATM 1813 O HOH 40 -21.574 -27.222 18.808 1.00 19.76 O HETATM 1814 O HOH 41 -22.575 -31.808 25.552 1.00 16.61 O HETATM 1815 O HOH 42 -30.875 -51.034 21.836 1.00 38.87 O HETATM 1816 O HOH 43 -9.635 -26.194 25.361 1.00 29.55 O HETATM 1817 O HOH 44 1.964 -51.520 11.905 1.00 26.98 O HETATM 1818 O HOH 45 -17.610 -24.038 30.373 1.00 41.44 O HETATM 1819 O HOH 46 -23.910 -42.901 17.007 1.00 17.69 O HETATM 1820 O HOH 47 -10.935 -22.198 16.423 1.00 43.99 O HETATM 1821 O HOH 48 -16.457 -55.137 11.330 1.00 22.14 O HETATM 1822 O HOH 49 -2.601 -39.724 26.149 1.00 26.41 O HETATM 1823 O HOH 50 -8.380 -46.516 10.972 1.00 12.85 O HETATM 1824 O HOH 51 0.823 -35.407 4.997 1.00 25.15 O HETATM 1825 O HOH 52 -19.446 -36.302 26.796 1.00 16.68 O HETATM 1826 O HOH 53 -1.284 -32.748 6.380 1.00 21.24 O HETATM 1827 O HOH 54 -15.437 -51.655 15.151 1.00 13.34 O HETATM 1828 O HOH 55 -8.009 -48.606 1.939 1.00 25.99 O HETATM 1829 O HOH 56 -8.021 -49.280 11.898 1.00 20.77 O HETATM 1830 O HOH 57 -26.115 -27.275 29.348 1.00 43.64 O HETATM 1831 O HOH 58 -3.471 -31.437 2.409 1.00 35.37 O HETATM 1832 O HOH 59 -9.590 -37.460 28.125 1.00 17.59 O HETATM 1833 O HOH 60 -19.079 -24.271 10.286 1.00 28.31 O HETATM 1834 O HOH 61 -14.933 -32.351 29.106 1.00 17.55 O HETATM 1835 O HOH 62 -23.675 -55.215 12.598 1.00 23.18 O HETATM 1836 O HOH 63 2.921 -40.786 19.695 1.00 37.77 O HETATM 1837 O HOH 64 -16.827 -39.393 -6.211 1.00 34.29 O HETATM 1838 O HOH 65 -15.336 -44.447 3.489 1.00 20.81 O HETATM 1839 O HOH 66 5.387 -34.064 8.409 1.00 40.42 O HETATM 1840 O HOH 67 -38.075 -30.531 -1.431 1.00 34.45 O HETATM 1841 O HOH 68 -7.015 -50.699 5.275 1.00 16.90 O HETATM 1842 O HOH 69 -21.325 -45.979 6.697 1.00 30.32 O HETATM 1843 O HOH 70 -18.213 -57.885 12.612 1.00 34.18 O HETATM 1844 O HOH 71 -26.881 -32.352 -8.777 1.00 36.71 O HETATM 1845 O HOH 72 -26.732 -35.541 10.026 1.00 25.54 O HETATM 1846 O HOH 73 -6.567 -25.531 9.152 1.00 22.99 O HETATM 1847 O HOH 74 -12.564 -25.372 7.934 1.00 36.38 O HETATM 1848 O HOH 75 -11.465 -23.713 2.999 1.00 25.82 O HETATM 1849 O HOH 76 -4.841 -27.627 -1.315 1.00 43.84 O HETATM 1850 O HOH 77 -12.909 -33.250 -9.396 1.00 38.42 O HETATM 1851 O HOH 78 -7.818 -49.080 8.338 1.00 22.01 O HETATM 1852 O HOH 79 -10.198 -26.068 6.792 1.00 41.09 O HETATM 1853 O HOH 80 -24.543 -53.042 13.971 1.00 26.32 O HETATM 1854 O HOH 81 -7.076 -47.265 6.384 1.00 16.68 O HETATM 1855 O HOH 82 -0.703 -46.072 16.230 1.00 34.54 O HETATM 1856 O HOH 83 -1.542 -28.516 12.138 1.00 20.45 O HETATM 1857 O HOH 84 3.624 -47.478 12.943 1.00 40.81 O HETATM 1858 O HOH 85 -3.137 -38.078 -6.841 1.00 35.86 O HETATM 1859 O HOH 86 0.686 -39.602 -1.293 1.00 28.43 O HETATM 1860 O HOH 87 -4.605 -46.145 -3.521 1.00 36.36 O HETATM 1861 O HOH 88 -11.307 -26.227 27.406 1.00 34.83 O HETATM 1862 O HOH 89 -13.570 -45.485 8.000 1.00 18.37 O HETATM 1863 O HOH 90 -24.672 -42.836 4.798 1.00 39.90 O HETATM 1864 O HOH 91 -32.595 -33.222 32.635 1.00 52.66 O HETATM 1865 O HOH 92 -2.036 -33.911 3.880 1.00 22.06 O HETATM 1866 O HOH 93 -14.627 -24.825 7.729 1.00 29.76 O HETATM 1867 O HOH 94 -15.972 -31.145 -4.509 1.00 26.77 O HETATM 1868 O HOH 95 -6.308 -28.825 1.297 1.00 32.80 O HETATM 1869 O HOH 96 -22.752 -24.881 27.531 1.00 35.45 O HETATM 1870 O HOH 97 -21.830 -30.399 36.084 1.00 33.96 O HETATM 1871 O HOH 98 0.863 -32.855 13.222 1.00 37.11 O HETATM 1872 O HOH 99 -18.362 -22.873 34.629 1.00 40.34 O HETATM 1873 O HOH 100 -25.362 -40.074 10.090 1.00 39.76 O HETATM 1874 O HOH 101 -7.326 -46.475 23.217 1.00 41.60 O HETATM 1875 O HOH 102 -11.547 -42.694 29.338 1.00 27.45 O HETATM 1876 O HOH 103 -19.095 -44.850 5.555 1.00 26.23 O HETATM 1877 O HOH 104 -13.171 -44.958 5.218 1.00 19.84 O HETATM 1878 O HOH 105 -16.497 -25.331 17.483 1.00 20.45 O HETATM 1879 O HOH 106 -41.351 -34.022 5.218 1.00 34.81 O HETATM 1880 O HOH 107 -13.233 -23.422 17.879 1.00 35.53 O HETATM 1881 O HOH 108 1.729 -41.077 15.504 1.00 32.71 O HETATM 1882 O HOH 109 -26.503 -38.934 -3.426 1.00 49.59 O HETATM 1883 O HOH 110 -13.410 -46.711 27.863 1.00 34.44 O HETATM 1884 O HOH 111 -4.840 -25.291 12.316 1.00 23.79 O HETATM 1885 O HOH 112 -9.690 -40.632 34.726 1.00 33.27 O HETATM 1886 O HOH 113 -16.292 -48.515 14.745 1.00 17.96 O HETATM 1887 O HOH 114 -24.585 -27.666 18.142 1.00 17.51 O HETATM 1888 O HOH 115 -24.610 -45.454 16.203 1.00 26.68 O HETATM 1889 O HOH 116 -25.698 -30.309 37.445 1.00 30.94 O HETATM 1890 O HOH 117 -7.479 -36.514 -0.791 1.00 22.04 O HETATM 1891 O HOH 118 -13.606 -44.826 0.895 1.00 23.65 O HETATM 1892 O HOH 119 -1.364 -49.722 0.358 1.00 27.03 O HETATM 1893 O HOH 120 -4.510 -27.506 4.989 1.00 34.94 O HETATM 1894 O HOH 121 2.485 -32.996 30.385 1.00 72.15 O HETATM 1895 O HOH 122 -18.440 -31.332 41.265 1.00 41.08 O HETATM 1896 O HOH 123 1.234 -46.667 13.959 1.00 34.06 O HETATM 1897 O HOH 124 -6.630 -43.220 21.822 1.00 17.52 O HETATM 1898 O HOH 125 -2.379 -42.638 8.805 1.00 16.98 O HETATM 1899 O HOH 126 -20.472 -25.670 12.535 1.00 23.05 O HETATM 1900 O HOH 127 -1.913 -49.269 14.713 1.00 25.24 O HETATM 1901 O HOH 128 -24.097 -40.749 -1.151 1.00 27.02 O HETATM 1902 O HOH 129 -5.840 -49.322 16.884 1.00 18.58 O HETATM 1903 O HOH 130 -3.681 -34.505 36.818 1.00 43.30 O HETATM 1904 O HOH 131 -27.008 -47.522 7.455 1.00 37.75 O HETATM 1905 O HOH 132 -9.009 -26.518 3.758 1.00 30.88 O HETATM 1906 O HOH 133 4.317 -38.958 13.819 1.00 29.06 O HETATM 1907 O HOH 134 -0.023 -41.967 8.748 1.00 31.14 O HETATM 1908 O HOH 135 -26.128 -38.925 12.886 1.00 29.86 O HETATM 1909 O HOH 136 -4.036 -47.877 -1.174 1.00 27.57 O HETATM 1910 O HOH 137 -11.976 -49.308 20.424 1.00 24.08 O HETATM 1911 O HOH 138 -22.537 -29.548 -9.023 1.00 41.01 O HETATM 1912 O HOH 139 -26.330 -38.691 4.670 1.00 32.85 O HETATM 1913 O HOH 140 -0.845 -31.152 20.211 1.00 39.64 O HETATM 1914 O HOH 141 -2.017 -47.456 16.871 1.00 34.58 O HETATM 1915 O HOH 142 -15.404 -42.925 -0.029 1.00 40.15 O HETATM 1916 O HOH 143 -9.541 -49.163 20.993 1.00 47.32 O HETATM 1917 O HOH 144 -5.460 -27.966 21.746 1.00 33.66 O HETATM 1918 O HOH 145 -5.139 -34.797 38.772 1.00 44.94 O HETATM 1919 O HOH 146 -25.746 -27.610 20.581 1.00 28.74 O HETATM 1920 O HOH 147 -15.892 -42.995 28.443 1.00 25.01 O HETATM 1921 O HOH 148 -15.139 -25.212 25.156 1.00 27.40 O HETATM 1922 O HOH 149 2.053 -43.053 7.810 1.00 37.59 O HETATM 1923 O HOH 150 -5.198 -33.434 40.895 1.00 44.21 O HETATM 1924 O HOH 151 -29.604 -32.284 22.527 1.00 39.18 O HETATM 1925 O HOH 152 -11.622 -24.766 9.896 1.00 52.51 O HETATM 1926 O HOH 153 -13.399 -21.367 12.787 1.00 43.43 O HETATM 1927 O HOH 154 -18.259 -47.859 13.219 1.00 31.97 O HETATM 1928 O HOH 155 -5.601 -50.068 9.488 1.00 36.97 O HETATM 1929 O HOH 156 -12.453 -47.631 2.301 1.00 31.75 O HETATM 1930 O HOH 157 1.108 -41.733 -0.151 1.00 54.13 O HETATM 1931 O HOH 158 -31.942 -37.832 37.137 1.00 35.59 O HETATM 1932 O HOH 159 -0.219 -40.433 25.114 1.00 55.91 O HETATM 1933 O HOH 160 -1.861 -40.441 28.514 1.00 55.25 O HETATM 1934 O HOH 161 1.827 -33.799 15.262 1.00 39.43 O HETATM 1935 O HOH 162 -24.379 -31.216 -10.266 1.00 46.60 O HETATM 1936 O HOH 163 -20.444 -43.861 3.253 1.00 39.76 O HETATM 1937 O HOH 164 -23.975 -57.458 13.850 1.00 31.27 O HETATM 1938 O HOH 165 -3.759 -47.409 -5.865 1.00 36.40 O HETATM 1939 O HOH 166 -15.578 -22.800 17.610 1.00 35.17 O HETATM 1940 O HOH 167 -30.772 -36.380 13.320 1.00 42.06 O HETATM 1941 O HOH 168 -15.694 -34.879 -14.507 1.00 34.49 O HETATM 1942 O HOH 169 -28.627 -34.139 -7.222 1.00 46.01 O HETATM 1943 O HOH 170 -29.019 -35.171 39.212 1.00 37.70 O HETATM 1944 O HOH 171 -25.868 -39.065 15.895 1.00 38.01 O HETATM 1945 O HOH 172 -17.861 -27.642 -3.057 1.00 36.69 O HETATM 1946 O HOH 173 -29.439 -36.784 22.305 1.00 39.81 O HETATM 1947 O HOH 174 -23.371 -24.334 34.835 1.00 38.58 O HETATM 1948 O HOH 175 -28.280 -37.949 16.382 1.00 35.17 O HETATM 1949 O HOH 176 -12.006 -22.492 9.974 1.00 42.22 O HETATM 1950 O HOH 177 -26.360 -41.450 17.490 1.00 32.05 O HETATM 1951 O HOH 178 -16.829 -46.520 3.980 1.00 41.57 O HETATM 1952 O HOH 179 -5.589 -50.264 12.071 1.00 26.18 O HETATM 1953 O HOH 180 4.026 -50.304 11.110 1.00 27.73 O HETATM 1954 O HOH 181 -4.276 -50.535 14.599 1.00 23.12 O HETATM 1955 O HOH 182 -14.384 -46.803 -0.967 1.00 32.34 O HETATM 1956 O HOH 183 -11.944 -53.958 16.358 1.00 19.83 O HETATM 1957 O HOH 184 -26.820 -48.863 27.709 1.00 27.61 O HETATM 1958 O HOH 185 -26.269 -48.369 33.004 1.00 36.98 O HETATM 1959 O HOH 186 -13.882 -57.793 15.525 1.00 30.63 O HETATM 1960 O HOH 187 -14.025 -43.420 30.611 1.00 31.95 O HETATM 1961 O HOH 188 -29.064 -41.693 24.336 1.00 38.40 O HETATM 1962 O HOH 189 -13.573 -52.143 20.050 1.00 24.68 O HETATM 1963 O HOH 190 -17.588 -54.249 27.538 1.00 41.84 O HETATM 1964 O HOH 191 -27.070 -38.495 21.854 1.00 32.20 O HETATM 1965 O HOH 192 -11.210 -58.761 15.035 1.00 23.34 O HETATM 1966 O HOH 193 -19.955 -57.677 20.371 1.00 43.41 O HETATM 1967 O HOH 194 -28.940 -43.833 28.368 1.00 27.96 O HETATM 1968 O HOH 195 -18.603 -43.035 27.169 1.00 20.33 O HETATM 1969 O HOH 196 -12.314 -41.707 33.716 1.00 32.91 O HETATM 1970 O HOH 197 -22.470 -47.939 31.644 1.00 30.49 O HETATM 1971 O HOH 198 -20.969 -53.571 24.596 1.00 38.78 O HETATM 1972 O HOH 199 -19.444 -41.176 34.877 1.00 30.47 O HETATM 1973 O HOH 200 -24.157 -43.741 33.187 1.00 35.01 O HETATM 1974 O HOH 201 -18.353 -56.182 22.855 1.00 31.76 O HETATM 1975 O HOH 202 -18.372 -48.792 31.012 1.00 32.12 O HETATM 1976 O HOH 203 -15.957 -41.855 40.106 1.00 46.77 O HETATM 1977 O HOH 204 -15.509 -55.419 24.458 1.00 48.05 O HETATM 1978 O HOH 205 -24.662 -49.646 31.401 1.00 34.71 O HETATM 1979 O HOH 206 -25.538 -51.126 29.373 1.00 33.42 O HETATM 1980 O HOH 207 -13.951 -53.737 24.082 1.00 39.93 O HETATM 1981 N BAL A 208 -11.930 -43.572 38.713 1.00 0.22 N HETATM 1982 CB BAL A 208 -12.926 -42.622 38.211 1.00 -0.02 C HETATM 1983 CA BAL A 208 -13.268 -42.970 36.735 1.00 0.08 C HETATM 1984 C BAL A 208 -14.627 -42.490 36.318 1.00 0.18 C HETATM 1985 O BAL A 208 -15.591 -42.616 37.048 1.00 -0.40 O HETATM 1986 N BAL A 208 -14.720 -41.935 35.109 1.00 -0.26 N HETATM 1987 CA BAL A 208 -15.972 -41.349 34.639 1.00 0.14 C HETATM 1988 C BAL A 208 -16.235 -41.738 33.181 1.00 0.21 C HETATM 1989 O BAL A 208 -15.304 -41.982 32.397 1.00 -0.39 O HETATM 1990 N BAL A 208 -17.511 -41.797 32.823 1.00 -0.26 N HETATM 1991 CA BAL A 208 -17.914 -42.051 31.447 1.00 0.13 C HETATM 1992 C BAL A 208 -18.263 -40.748 30.732 1.00 0.20 C HETATM 1993 O BAL A 208 -18.853 -39.835 31.320 1.00 -0.39 O HETATM 1994 N BAL A 208 -17.944 -40.693 29.439 1.00 -0.26 N HETATM 1995 CA BAL A 208 -18.334 -39.562 28.606 1.00 0.13 C HETATM 1996 C BAL A 208 -19.827 -39.576 28.308 1.00 0.20 C HETATM 1997 O BAL A 208 -20.421 -38.513 28.138 1.00 -0.39 O HETATM 1998 N BAL A 208 -20.454 -40.757 28.221 1.00 -0.26 N HETATM 1999 CA BAL A 208 -21.831 -40.862 27.766 1.00 0.14 C HETATM 2000 C BAL A 208 -22.610 -41.790 28.690 1.00 0.21 C HETATM 2001 O BAL A 208 -22.093 -42.838 29.083 1.00 -0.39 O HETATM 2002 N BAL A 208 -23.832 -41.432 29.096 1.00 -0.25 N HETATM 2003 CA BAL A 208 -24.535 -42.262 30.080 1.00 0.13 C HETATM 2004 C BAL A 208 -24.769 -43.678 29.574 1.00 0.20 C HETATM 2005 O BAL A 208 -25.048 -43.893 28.396 1.00 -0.39 O HETATM 2006 N BAL A 208 -24.648 -44.644 30.486 1.00 -0.26 N HETATM 2007 CA BAL A 208 -25.002 -46.036 30.205 1.00 0.14 C HETATM 2008 C BAL A 208 -24.252 -46.596 29.005 1.00 0.21 C HETATM 2009 O BAL A 208 -24.796 -47.408 28.249 1.00 -0.39 O HETATM 2010 N BAL A 208 -23.006 -46.185 28.812 1.00 -0.26 N HETATM 2011 CA BAL A 208 -22.196 -46.721 27.730 1.00 0.15 C HETATM 2012 C BAL A 208 -21.218 -47.763 28.262 1.00 0.21 C HETATM 2013 O BAL A 208 -20.734 -47.667 29.390 1.00 -0.39 O HETATM 2014 N BAL A 208 -20.956 -48.776 27.442 1.00 -0.26 N HETATM 2015 CA BAL A 208 -20.013 -49.836 27.806 1.00 0.13 C HETATM 2016 C BAL A 208 -19.128 -50.147 26.615 1.00 0.21 C HETATM 2017 O BAL A 208 -19.519 -49.962 25.454 1.00 -0.39 O HETATM 2018 N BAL A 208 -17.903 -50.600 26.872 1.00 -0.25 N HETATM 2019 CA BAL A 208 -16.991 -50.926 25.763 1.00 0.13 C HETATM 2020 C BAL A 208 -17.593 -51.975 24.845 1.00 0.20 C HETATM 2021 O BAL A 208 -18.260 -52.917 25.295 1.00 -0.39 O HETATM 2022 N BAL A 208 -17.363 -51.793 23.538 1.00 -0.26 N HETATM 2023 CA BAL A 208 -17.933 -52.625 22.491 1.00 0.14 C HETATM 2024 C BAL A 208 -16.882 -53.034 21.468 1.00 0.21 C HETATM 2025 O BAL A 208 -16.073 -52.204 21.036 1.00 -0.39 O HETATM 2026 N BAL A 208 -16.901 -54.303 21.067 1.00 -0.26 N HETATM 2027 CA BAL A 208 -16.054 -54.782 19.957 1.00 0.13 C HETATM 2028 C BAL A 208 -16.854 -55.801 19.150 1.00 0.21 C HETATM 2029 O BAL A 208 -17.439 -56.722 19.749 1.00 -0.39 O HETATM 2030 N BAL A 208 -16.961 -55.669 17.827 1.00 -0.25 N HETATM 2031 CA BAL A 208 -17.671 -56.711 17.077 1.00 0.13 C HETATM 2032 C BAL A 208 -16.952 -58.047 17.253 1.00 0.20 C HETATM 2033 O BAL A 208 -15.723 -58.119 17.323 1.00 -0.39 O HETATM 2034 N BAL A 208 -17.719 -59.125 17.269 1.00 -0.27 N HETATM 2035 CA BAL A 208 -17.099 -60.430 17.470 1.00 0.09 C HETATM 2036 C BAL A 208 -17.188 -61.285 16.214 1.00 0.06 C HETATM 2037 O BAL A 208 -16.445 -62.257 16.067 1.00 -0.57 O HETATM 2038 OXT BAL A 208 -17.975 -61.007 15.309 1.00 -0.57 O HETATM 2039 CB BAL A 208 -17.741 -61.124 18.674 1.00 -0.02 C HETATM 2040 CG BAL A 208 -17.366 -60.439 19.988 1.00 -0.04 C HETATM 2041 CD BAL A 208 -18.007 -61.064 21.218 1.00 -0.01 C HETATM 2042 CE BAL A 208 -17.560 -60.325 22.477 1.00 -0.04 C HETATM 2043 NZ BAL A 208 -18.157 -60.871 23.726 1.00 0.22 N HETATM 2044 H114 BAL A 208 -17.824 -60.342 24.517 1.00 0.20 H HETATM 2045 H115 BAL A 208 -17.890 -61.837 23.831 1.00 0.20 H HETATM 2046 H116 BAL A 208 -19.162 -60.803 23.676 1.00 0.20 H HETATM 2047 H112 BAL A 208 -17.852 -59.269 22.384 1.00 0.08 H HETATM 2048 H113 BAL A 208 -16.465 -60.397 22.553 1.00 0.08 H HETATM 2049 H110 BAL A 208 -17.705 -62.119 21.289 1.00 0.03 H HETATM 2050 H111 BAL A 208 -19.102 -61.001 21.129 1.00 0.03 H HETATM 2051 H108 BAL A 208 -17.681 -59.386 19.931 1.00 0.03 H HETATM 2052 H109 BAL A 208 -16.273 -60.489 20.105 1.00 0.03 H HETATM 2053 H106 BAL A 208 -17.400 -62.169 18.707 1.00 0.03 H HETATM 2054 H107 BAL A 208 -18.835 -61.099 18.558 1.00 0.03 H HETATM 2055 H105 BAL A 208 -16.034 -60.273 17.694 1.00 0.07 H HETATM 2056 H104 BAL A 208 -18.708 -59.046 17.145 1.00 0.19 H HETATM 2057 CB BAL A 208 -17.608 -56.231 15.622 1.00 -0.01 C HETATM 2058 CG BAL A 208 -17.181 -54.834 15.652 1.00 -0.03 C HETATM 2059 CD BAL A 208 -16.433 -54.611 16.937 1.00 0.04 C HETATM 2060 H102 BAL A 208 -15.349 -54.727 16.787 1.00 0.05 H HETATM 2061 H103 BAL A 208 -16.642 -53.611 17.346 1.00 0.05 H HETATM 2062 H100 BAL A 208 -18.059 -54.173 15.611 1.00 0.03 H HETATM 2063 H101 BAL A 208 -16.524 -54.625 14.795 1.00 0.03 H HETATM 2064 H98 BAL A 208 -18.600 -56.313 15.154 1.00 0.03 H HETATM 2065 H99 BAL A 208 -16.884 -56.835 15.056 1.00 0.03 H HETATM 2066 H97 BAL A 208 -18.714 -56.803 17.414 1.00 0.08 H HETATM 2067 CB BAL A 208 -14.739 -55.399 20.436 1.00 -0.01 C HETATM 2068 CG BAL A 208 -13.839 -55.841 19.294 1.00 -0.02 C HETATM 2069 CD BAL A 208 -12.449 -56.224 19.778 1.00 0.06 C HETATM 2070 NE BAL A 208 -11.703 -56.968 18.763 1.00 -0.27 N HETATM 2071 CZ BAL A 208 -10.811 -56.441 17.925 1.00 0.29 C HETATM 2072 NH1 BAL A 208 -10.525 -55.144 17.957 1.00 -0.28 N HETATM 2073 H93 BAL A 208 -9.833 -54.753 17.302 1.00 0.26 H HETATM 2074 H94 BAL A 208 -10.995 -54.529 18.637 1.00 0.26 H HETATM 2075 NH2 BAL A 208 -10.197 -57.224 17.047 1.00 -0.28 N HETATM 2076 H95 BAL A 208 -10.413 -58.231 17.015 1.00 0.26 H HETATM 2077 H96 BAL A 208 -9.505 -56.825 16.397 1.00 0.26 H HETATM 2078 H92 BAL A 208 -11.882 -57.980 18.690 1.00 0.26 H HETATM 2079 H90 BAL A 208 -12.546 -56.849 20.678 1.00 0.07 H HETATM 2080 H91 BAL A 208 -11.894 -55.307 20.026 1.00 0.07 H HETATM 2081 H88 BAL A 208 -13.749 -55.015 18.573 1.00 0.03 H HETATM 2082 H89 BAL A 208 -14.295 -56.711 18.799 1.00 0.03 H HETATM 2083 H86 BAL A 208 -14.970 -56.275 21.060 1.00 0.03 H HETATM 2084 H87 BAL A 208 -14.200 -54.652 21.038 1.00 0.03 H HETATM 2085 H85 BAL A 208 -15.812 -53.926 19.310 1.00 0.08 H HETATM 2086 H84 BAL A 208 -17.506 -54.950 21.531 1.00 0.19 H HETATM 2087 CB BAL A 208 -19.033 -51.888 21.745 1.00 0.02 C HETATM 2088 CG BAL A 208 -19.654 -52.705 20.639 1.00 -0.05 C HETATM 2089 CD1 BAL A 208 -20.538 -53.735 20.921 1.00 -0.07 C HETATM 2090 CE1 BAL A 208 -21.098 -54.479 19.904 1.00 -0.04 C HETATM 2091 CZ BAL A 208 -20.762 -54.226 18.597 1.00 0.08 C HETATM 2092 CE2 BAL A 208 -19.871 -53.235 18.293 1.00 -0.04 C HETATM 2093 CD2 BAL A 208 -19.321 -52.484 19.312 1.00 -0.07 C HETATM 2094 H80 BAL A 208 -18.611 -51.702 19.068 1.00 0.05 H HETATM 2095 H82 BAL A 208 -19.599 -53.041 17.262 1.00 0.05 H HETATM 2096 OH BAL A 208 -21.303 -54.970 17.569 1.00 -0.34 O HETATM 2097 H83 BAL A 208 -21.774 -54.395 16.978 1.00 0.25 H HETATM 2098 H81 BAL A 208 -21.806 -55.266 20.137 1.00 0.05 H HETATM 2099 H79 BAL A 208 -20.791 -53.958 21.951 1.00 0.05 H HETATM 2100 H77 BAL A 208 -18.606 -50.974 21.306 1.00 0.05 H HETATM 2101 H78 BAL A 208 -19.821 -51.617 22.463 1.00 0.05 H HETATM 2102 H76 BAL A 208 -18.354 -53.529 22.956 1.00 0.08 H HETATM 2103 H75 BAL A 208 -16.764 -51.040 23.266 1.00 0.19 H HETATM 2104 CB BAL A 208 -15.732 -51.439 26.470 1.00 -0.01 C HETATM 2105 CG BAL A 208 -15.763 -50.785 27.818 1.00 -0.03 C HETATM 2106 CD BAL A 208 -17.221 -50.687 28.187 1.00 0.04 C HETATM 2107 H73 BAL A 208 -17.547 -51.579 28.742 1.00 0.05 H HETATM 2108 H74 BAL A 208 -17.415 -49.788 28.791 1.00 0.05 H HETATM 2109 H71 BAL A 208 -15.311 -49.783 27.769 1.00 0.03 H HETATM 2110 H72 BAL A 208 -15.221 -51.397 28.554 1.00 0.03 H HETATM 2111 H69 BAL A 208 -14.828 -51.145 25.916 1.00 0.03 H HETATM 2112 H70 BAL A 208 -15.761 -52.534 26.569 1.00 0.03 H HETATM 2113 H68 BAL A 208 -16.761 -50.026 25.174 1.00 0.08 H HETATM 2114 CB BAL A 208 -20.741 -51.113 28.265 1.00 -0.01 C HETATM 2115 CG1 BAL A 208 -21.630 -50.801 29.457 1.00 -0.06 C HETATM 2116 H62 BAL A 208 -22.146 -51.717 29.779 1.00 0.02 H HETATM 2117 H63 BAL A 208 -22.373 -50.042 29.171 1.00 0.02 H HETATM 2118 H64 BAL A 208 -21.014 -50.418 30.284 1.00 0.02 H HETATM 2119 CG2 BAL A 208 -21.568 -51.711 27.139 1.00 -0.06 C HETATM 2120 H65 BAL A 208 -20.915 -51.933 26.282 1.00 0.02 H HETATM 2121 H66 BAL A 208 -22.344 -50.994 26.833 1.00 0.02 H HETATM 2122 H67 BAL A 208 -22.044 -52.640 27.487 1.00 0.02 H HETATM 2123 H61 BAL A 208 -19.987 -51.852 28.572 1.00 0.03 H HETATM 2124 H60 BAL A 208 -19.384 -49.477 28.634 1.00 0.08 H HETATM 2125 H59 BAL A 208 -21.414 -48.815 26.554 1.00 0.19 H HETATM 2126 CB BAL A 208 -21.450 -45.600 27.000 1.00 0.08 C HETATM 2127 OG BAL A 208 -20.608 -44.839 27.860 1.00 -0.39 O HETATM 2128 H58 BAL A 208 -20.172 -44.161 27.356 1.00 0.21 H HETATM 2129 H56 BAL A 208 -22.190 -44.924 26.546 1.00 0.06 H HETATM 2130 H57 BAL A 208 -20.830 -46.048 26.210 1.00 0.06 H HETATM 2131 H55 BAL A 208 -22.866 -47.213 27.010 1.00 0.08 H HETATM 2132 H54 BAL A 208 -22.617 -45.494 29.421 1.00 0.19 H HETATM 2133 CB BAL A 208 -26.505 -46.165 29.964 1.00 0.04 C HETATM 2134 CG BAL A 208 -27.319 -45.620 31.111 1.00 0.04 C HETATM 2135 OD1 BAL A 208 -27.130 -46.088 32.254 1.00 -0.57 O HETATM 2136 OD2 BAL A 208 -28.140 -44.716 30.861 1.00 -0.57 O HETATM 2137 H52 BAL A 208 -26.752 -47.229 29.830 1.00 0.05 H HETATM 2138 H53 BAL A 208 -26.765 -45.610 29.051 1.00 0.05 H HETATM 2139 H51 BAL A 208 -24.736 -46.638 31.087 1.00 0.08 H HETATM 2140 H50 BAL A 208 -24.303 -44.408 31.395 1.00 0.19 H HETATM 2141 CB BAL A 208 -25.865 -41.527 30.303 1.00 -0.01 C HETATM 2142 CG BAL A 208 -25.687 -40.178 29.762 1.00 -0.03 C HETATM 2143 CD BAL A 208 -24.588 -40.214 28.746 1.00 0.04 C HETATM 2144 H48 BAL A 208 -24.997 -40.285 27.727 1.00 0.05 H HETATM 2145 H49 BAL A 208 -23.951 -39.320 28.824 1.00 0.05 H HETATM 2146 H46 BAL A 208 -25.419 -39.485 30.573 1.00 0.03 H HETATM 2147 H47 BAL A 208 -26.621 -39.843 29.287 1.00 0.03 H HETATM 2148 H44 BAL A 208 -26.098 -41.479 31.377 1.00 0.03 H HETATM 2149 H45 BAL A 208 -26.679 -42.045 29.774 1.00 0.03 H HETATM 2150 H43 BAL A 208 -23.961 -42.310 31.017 1.00 0.08 H HETATM 2151 CB BAL A 208 -21.863 -41.394 26.324 1.00 0.02 C HETATM 2152 CG BAL A 208 -23.159 -41.168 25.593 1.00 -0.05 C HETATM 2153 CD1 BAL A 208 -24.219 -42.065 25.720 1.00 -0.07 C HETATM 2154 CE1 BAL A 208 -25.423 -41.841 25.064 1.00 -0.04 C HETATM 2155 CZ BAL A 208 -25.579 -40.707 24.290 1.00 0.08 C HETATM 2156 CE2 BAL A 208 -24.552 -39.801 24.169 1.00 -0.04 C HETATM 2157 CD2 BAL A 208 -23.356 -40.030 24.825 1.00 -0.07 C HETATM 2158 H39 BAL A 208 -22.555 -39.304 24.737 1.00 0.05 H HETATM 2159 H41 BAL A 208 -24.679 -38.912 23.562 1.00 0.05 H HETATM 2160 OH BAL A 208 -26.775 -40.485 23.651 1.00 -0.34 O HETATM 2161 H42 BAL A 208 -27.370 -41.201 23.838 1.00 0.25 H HETATM 2162 H40 BAL A 208 -26.236 -42.552 25.159 1.00 0.05 H HETATM 2163 H38 BAL A 208 -24.102 -42.948 26.338 1.00 0.05 H HETATM 2164 H36 BAL A 208 -21.673 -42.477 26.355 1.00 0.05 H HETATM 2165 H37 BAL A 208 -21.061 -40.897 25.759 1.00 0.05 H HETATM 2166 H35 BAL A 208 -22.294 -39.864 27.789 1.00 0.08 H HETATM 2167 H34 BAL A 208 -19.961 -41.589 28.476 1.00 0.19 H HETATM 2168 CB BAL A 208 -17.551 -39.554 27.281 1.00 -0.02 C HETATM 2169 H31 BAL A 208 -17.865 -38.692 26.675 1.00 0.03 H HETATM 2170 H32 BAL A 208 -17.754 -40.484 26.729 1.00 0.03 H HETATM 2171 H33 BAL A 208 -16.474 -39.481 27.492 1.00 0.03 H HETATM 2172 H30 BAL A 208 -18.099 -38.638 29.155 1.00 0.08 H HETATM 2173 H29 BAL A 208 -17.425 -41.444 29.031 1.00 0.19 H HETATM 2174 CB BAL A 208 -19.113 -42.991 31.398 1.00 -0.01 C HETATM 2175 CG BAL A 208 -18.947 -44.387 31.980 1.00 -0.04 C HETATM 2176 CD1 BAL A 208 -20.289 -45.075 31.851 1.00 -0.06 C HETATM 2177 H23 BAL A 208 -20.220 -46.094 32.261 1.00 0.02 H HETATM 2178 H24 BAL A 208 -20.575 -45.125 30.790 1.00 0.02 H HETATM 2179 H25 BAL A 208 -21.048 -44.506 32.409 1.00 0.02 H HETATM 2180 CD2 BAL A 208 -17.851 -45.198 31.281 1.00 -0.06 C HETATM 2181 H26 BAL A 208 -16.887 -44.680 31.388 1.00 0.02 H HETATM 2182 H27 BAL A 208 -18.096 -45.301 30.213 1.00 0.02 H HETATM 2183 H28 BAL A 208 -17.784 -46.195 31.740 1.00 0.02 H HETATM 2184 H22 BAL A 208 -18.683 -44.301 33.044 1.00 0.03 H HETATM 2185 H20 BAL A 208 -19.395 -43.108 30.341 1.00 0.03 H HETATM 2186 H21 BAL A 208 -19.934 -42.504 31.945 1.00 0.03 H HETATM 2187 H19 BAL A 208 -17.073 -42.526 30.922 1.00 0.08 H HETATM 2188 H18 BAL A 208 -18.217 -41.663 33.519 1.00 0.19 H HETATM 2189 CB BAL A 208 -15.951 -39.818 34.744 1.00 0.00 C HETATM 2190 CG BAL A 208 -15.687 -39.323 36.138 1.00 -0.04 C HETATM 2191 CD1 BAL A 208 -16.603 -38.962 37.078 1.00 0.02 C HETATM 2192 NE1 BAL A 208 -15.958 -38.581 38.246 1.00 -0.29 N HETATM 2193 CE2 BAL A 208 -14.604 -38.669 38.039 1.00 0.06 C HETATM 2194 CD2 BAL A 208 -14.402 -39.137 36.728 1.00 -0.02 C HETATM 2195 CE3 BAL A 208 -13.092 -39.320 36.266 1.00 -0.07 C HETATM 2196 CZ3 BAL A 208 -12.044 -39.041 37.116 1.00 -0.08 C HETATM 2197 CH2 BAL A 208 -12.273 -38.574 38.418 1.00 -0.08 C HETATM 2198 CZ2 BAL A 208 -13.543 -38.382 38.898 1.00 -0.04 C HETATM 2199 H15 BAL A 208 -13.716 -38.021 39.906 1.00 0.05 H HETATM 2200 H17 BAL A 208 -11.426 -38.360 39.060 1.00 0.05 H HETATM 2201 H16 BAL A 208 -11.026 -39.185 36.773 1.00 0.05 H HETATM 2202 H14 BAL A 208 -12.906 -39.675 35.259 1.00 0.05 H HETATM 2203 H13 BAL A 208 -16.417 -38.283 39.119 1.00 0.22 H HETATM 2204 H12 BAL A 208 -17.683 -38.971 36.934 1.00 0.08 H HETATM 2205 H10 BAL A 208 -16.927 -39.432 34.415 1.00 0.04 H HETATM 2206 H11 BAL A 208 -15.162 -39.433 34.081 1.00 0.04 H HETATM 2207 H9 BAL A 208 -16.791 -41.734 35.264 1.00 0.08 H HETATM 2208 H8 BAL A 208 -13.917 -41.920 34.513 1.00 0.19 H HETATM 2209 H6 BAL A 208 -13.230 -44.063 36.615 1.00 0.06 H HETATM 2210 H7 BAL A 208 -12.516 -42.503 36.082 1.00 0.06 H HETATM 2211 H4 BAL A 208 -12.520 -41.601 38.263 1.00 0.08 H HETATM 2212 H5 BAL A 208 -13.837 -42.686 38.824 1.00 0.08 H HETATM 2213 H1 BAL A 208 -11.706 -43.349 39.670 1.00 0.20 H HETATM 2214 H2 BAL A 208 -11.096 -43.513 38.150 1.00 0.20 H HETATM 2215 H3 BAL A 208 -12.303 -44.507 38.664 1.00 0.20 H CONECT 1 2 5 6 7 CONECT 5 1 CONECT 6 1 CONECT 7 1 CONECT 401 400 1571 CONECT 772 771 849 CONECT 849 772 848 CONECT 1571 401 1570 CONECT 1981 1982 2213 2214 2215 CONECT 1982 1981 1983 2211 2212 CONECT 1983 1982 1984 2209 2210 CONECT 1984 1983 1985 1986 CONECT 1985 1984 CONECT 1986 1984 1987 2208 CONECT 1987 1986 1988 2189 2207 CONECT 1988 1987 1989 1990 CONECT 1989 1988 CONECT 1990 1988 1991 2188 CONECT 1991 1990 1992 2174 2187 CONECT 1992 1991 1993 1994 CONECT 1993 1992 CONECT 1994 1992 1995 2173 CONECT 1995 1994 1996 2168 2172 CONECT 1996 1995 1997 1998 CONECT 1997 1996 CONECT 1998 1996 1999 2167 CONECT 1999 1998 2000 2151 2166 CONECT 2000 1999 2001 2002 CONECT 2001 2000 CONECT 2002 2000 2003 2143 CONECT 2003 2002 2004 2141 2150 CONECT 2004 2003 2005 2006 CONECT 2005 2004 CONECT 2006 2004 2007 2140 CONECT 2007 2006 2008 2133 2139 CONECT 2008 2007 2009 2010 CONECT 2009 2008 CONECT 2010 2008 2011 2132 CONECT 2011 2010 2012 2126 2131 CONECT 2012 2011 2013 2014 CONECT 2013 2012 CONECT 2014 2012 2015 2125 CONECT 2015 2014 2016 2114 2124 CONECT 2016 2015 2017 2018 CONECT 2017 2016 CONECT 2018 2016 2019 2106 CONECT 2019 2018 2020 2104 2113 CONECT 2020 2019 2021 2022 CONECT 2021 2020 CONECT 2022 2020 2023 2103 CONECT 2023 2022 2024 2087 2102 CONECT 2024 2023 2025 2026 CONECT 2025 2024 CONECT 2026 2024 2027 2086 CONECT 2027 2026 2028 2067 2085 CONECT 2028 2027 2029 2030 CONECT 2029 2028 CONECT 2030 2028 2031 2059 CONECT 2031 2030 2032 2057 2066 CONECT 2032 2031 2033 2034 CONECT 2033 2032 CONECT 2034 2032 2035 2056 CONECT 2035 2034 2036 2039 2055 CONECT 2036 2035 2037 2038 CONECT 2037 2036 CONECT 2038 2036 CONECT 2039 2035 2040 2053 2054 CONECT 2040 2039 2041 2051 2052 CONECT 2041 2040 2042 2049 2050 CONECT 2042 2041 2043 2047 2048 CONECT 2043 2042 2044 2045 2046 CONECT 2044 2043 CONECT 2045 2043 CONECT 2046 2043 CONECT 2047 2042 CONECT 2048 2042 CONECT 2049 2041 CONECT 2050 2041 CONECT 2051 2040 CONECT 2052 2040 CONECT 2053 2039 CONECT 2054 2039 CONECT 2055 2035 CONECT 2056 2034 CONECT 2057 2031 2058 2064 2065 CONECT 2058 2057 2059 2062 2063 CONECT 2059 2030 2058 2060 2061 CONECT 2060 2059 CONECT 2061 2059 CONECT 2062 2058 CONECT 2063 2058 CONECT 2064 2057 CONECT 2065 2057 CONECT 2066 2031 CONECT 2067 2027 2068 2083 2084 CONECT 2068 2067 2069 2081 2082 CONECT 2069 2068 2070 2079 2080 CONECT 2070 2069 2071 2078 CONECT 2071 2070 2072 2075 CONECT 2072 2071 2073 2074 CONECT 2073 2072 CONECT 2074 2072 CONECT 2075 2071 2076 2077 CONECT 2076 2075 CONECT 2077 2075 CONECT 2078 2070 CONECT 2079 2069 CONECT 2080 2069 CONECT 2081 2068 CONECT 2082 2068 CONECT 2083 2067 CONECT 2084 2067 CONECT 2085 2027 CONECT 2086 2026 CONECT 2087 2023 2088 2100 2101 CONECT 2088 2087 2089 2093 CONECT 2089 2088 2090 2099 CONECT 2090 2089 2091 2098 CONECT 2091 2090 2092 2096 CONECT 2092 2091 2093 2095 CONECT 2093 2088 2092 2094 CONECT 2094 2093 CONECT 2095 2092 CONECT 2096 2091 2097 CONECT 2097 2096 CONECT 2098 2090 CONECT 2099 2089 CONECT 2100 2087 CONECT 2101 2087 CONECT 2102 2023 CONECT 2103 2022 CONECT 2104 2019 2105 2111 2112 CONECT 2105 2104 2106 2109 2110 CONECT 2106 2018 2105 2107 2108 CONECT 2107 2106 CONECT 2108 2106 CONECT 2109 2105 CONECT 2110 2105 CONECT 2111 2104 CONECT 2112 2104 CONECT 2113 2019 CONECT 2114 2015 2115 2119 2123 CONECT 2115 2114 2116 2117 2118 CONECT 2116 2115 CONECT 2117 2115 CONECT 2118 2115 CONECT 2119 2114 2120 2121 2122 CONECT 2120 2119 CONECT 2121 2119 CONECT 2122 2119 CONECT 2123 2114 CONECT 2124 2015 CONECT 2125 2014 CONECT 2126 2011 2127 2129 2130 CONECT 2127 2126 2128 CONECT 2128 2127 CONECT 2129 2126 CONECT 2130 2126 CONECT 2131 2011 CONECT 2132 2010 CONECT 2133 2007 2134 2137 2138 CONECT 2134 2133 2135 2136 CONECT 2135 2134 CONECT 2136 2134 CONECT 2137 2133 CONECT 2138 2133 CONECT 2139 2007 CONECT 2140 2006 CONECT 2141 2003 2142 2148 2149 CONECT 2142 2141 2143 2146 2147 CONECT 2143 2002 2142 2144 2145 CONECT 2144 2143 CONECT 2145 2143 CONECT 2146 2142 CONECT 2147 2142 CONECT 2148 2141 CONECT 2149 2141 CONECT 2150 2003 CONECT 2151 1999 2152 2164 2165 CONECT 2152 2151 2153 2157 CONECT 2153 2152 2154 2163 CONECT 2154 2153 2155 2162 CONECT 2155 2154 2156 2160 CONECT 2156 2155 2157 2159 CONECT 2157 2152 2156 2158 CONECT 2158 2157 CONECT 2159 2156 CONECT 2160 2155 2161 CONECT 2161 2160 CONECT 2162 2154 CONECT 2163 2153 CONECT 2164 2151 CONECT 2165 2151 CONECT 2166 1999 CONECT 2167 1998 CONECT 2168 1995 2169 2170 2171 CONECT 2169 2168 CONECT 2170 2168 CONECT 2171 2168 CONECT 2172 1995 CONECT 2173 1994 CONECT 2174 1991 2175 2185 2186 CONECT 2175 2174 2176 2180 2184 CONECT 2176 2175 2177 2178 2179 CONECT 2177 2176 CONECT 2178 2176 CONECT 2179 2176 CONECT 2180 2175 2181 2182 2183 CONECT 2181 2180 CONECT 2182 2180 CONECT 2183 2180 CONECT 2184 2175 CONECT 2185 2174 CONECT 2186 2174 CONECT 2187 1991 CONECT 2188 1990 CONECT 2189 1987 2190 2205 2206 CONECT 2190 2189 2191 2194 CONECT 2191 2190 2192 2204 CONECT 2192 2191 2193 2203 CONECT 2193 2192 2194 2198 CONECT 2194 2190 2193 2195 CONECT 2195 2194 2196 2202 CONECT 2196 2195 2197 2201 CONECT 2197 2196 2198 2200 CONECT 2198 2193 2197 2199 CONECT 2199 2198 CONECT 2200 2197 CONECT 2201 2196 CONECT 2202 2195 CONECT 2203 2192 CONECT 2204 2191 CONECT 2205 2189 CONECT 2206 2189 CONECT 2207 1987 CONECT 2208 1986 CONECT 2209 1983 CONECT 2210 1983 CONECT 2211 1982 CONECT 2212 1982 CONECT 2213 1981 CONECT 2214 1981 CONECT 2215 1981 MASTER 0 0 0 0 0 0 0 0 2214 1 243 14 END
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6nk0
RCSB PDB
PDBbind
12aa, >6NK0_2|Chains... at 91%
Complexes with the same small molecule ligand
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2n8t
RCSB PDB
PDBbind
14-mer
2oi3
RCSB PDB
PDBbind
14-mer
2w2u
RCSB PDB
PDBbind
14-mer
2xl2
RCSB PDB
PDBbind
14-mer
2xl3
RCSB PDB
PDBbind
14-mer
2xrw
RCSB PDB
PDBbind
14-mer
2xs0
RCSB PDB
PDBbind
14-mer
2y8o
RCSB PDB
PDBbind
14-mer
3d9k
RCSB PDB
PDBbind
14-mer
3d9l
RCSB PDB
PDBbind
14-mer
3d9m
RCSB PDB
PDBbind
14-mer
3d9n
RCSB PDB
PDBbind
14-mer
3d9o
RCSB PDB
PDBbind
14-mer
3d9p
RCSB PDB
PDBbind
14-mer
3g2w
RCSB PDB
PDBbind
14-mer
3lrh
RCSB PDB
PDBbind
14-mer
3meu
RCSB PDB
PDBbind
14-mer
3pkn
RCSB PDB
PDBbind
14-mer
3rqe
RCSB PDB
PDBbind
14-mer
3so6
RCSB PDB
PDBbind
14-mer
3ual
RCSB PDB
PDBbind
14-mer
3wdz
RCSB PDB
PDBbind
14-mer
3wut
RCSB PDB
PDBbind
14-mer
3wuu
RCSB PDB
PDBbind
14-mer
3wuv
RCSB PDB
PDBbind
14-mer
4aza
RCSB PDB
PDBbind
14-mer
4ch2
RCSB PDB
PDBbind
14-mer
4ch8
RCSB PDB
PDBbind
14-mer
4erq
RCSB PDB
PDBbind
14-mer
4ery
RCSB PDB
PDBbind
14-mer
4erz
RCSB PDB
PDBbind
14-mer
4es0
RCSB PDB
PDBbind
14-mer
4ewr
RCSB PDB
PDBbind
14-mer
4fi9
RCSB PDB
PDBbind
14-mer
4gly
RCSB PDB
PDBbind
14-mer
4gxl
RCSB PDB
PDBbind
14-mer
4hgc
RCSB PDB
PDBbind
14-mer
4i7b
RCSB PDB
PDBbind
14-mer
4i7c
RCSB PDB
PDBbind
14-mer
4i7d
RCSB PDB
PDBbind
14-mer
4k1e
RCSB PDB
PDBbind
14-mer
4ktu
RCSB PDB
PDBbind
14-mer
4m1d
RCSB PDB
PDBbind
14-mer
4mnv
RCSB PDB
PDBbind
14-mer
4mnw
RCSB PDB
PDBbind
14-mer
4mnx
RCSB PDB
PDBbind
14-mer
4mny
RCSB PDB
PDBbind
14-mer
4o4y
RCSB PDB
PDBbind
14-mer
4ofb
RCSB PDB
PDBbind
14-mer
4os2
RCSB PDB
PDBbind
14-mer
4os6
RCSB PDB
PDBbind
14-mer
4ov5
RCSB PDB
PDBbind
14-mer
4wv6
RCSB PDB
PDBbind
14-mer
5aer
RCSB PDB
PDBbind
14-mer
5dpw
RCSB PDB
PDBbind
14-mer
5e0l
RCSB PDB
PDBbind
14-mer
5eoc
RCSB PDB
PDBbind
14-mer
5h5s
RCSB PDB
PDBbind
14-mer
5ixf
RCSB PDB
PDBbind
14-mer
5ly1
RCSB PDB
PDBbind
14-mer
5ly2
RCSB PDB
PDBbind
14-mer
5n8w
RCSB PDB
PDBbind
14-mer
5unj
RCSB PDB
PDBbind
14-mer
5vlh
RCSB PDB
PDBbind
14-mer
5vll
RCSB PDB
PDBbind
14-mer
5wbk
RCSB PDB
PDBbind
14-mer
5zoo
RCSB PDB
PDBbind
14-mer
6axk
RCSB PDB
PDBbind
14-mer
6axl
RCSB PDB
PDBbind
14-mer
6b27
RCSB PDB
PDBbind
14-mer
6co4
RCSB PDB
PDBbind
14-mer
6qcg
RCSB PDB
PDBbind
14-mer
6qc0
RCSB PDB
PDBbind
14-mer
6pxc
RCSB PDB
PDBbind
14-mer
6o3w
RCSB PDB
PDBbind
14-mer
6o21
RCSB PDB
PDBbind
14-mer
6fzp
RCSB PDB
PDBbind
14-mer
6fzj
RCSB PDB
PDBbind
14-mer
6fzf
RCSB PDB
PDBbind
14-mer
6d3x
RCSB PDB
PDBbind
14-mer
6bvh
RCSB PDB
PDBbind
14-mer
6bcr
RCSB PDB
PDBbind
14-mer
5zk7
RCSB PDB
PDBbind
14-mer
5zjy
RCSB PDB
PDBbind
14-mer
5y21
RCSB PDB
PDBbind
14-mer
5xvw
RCSB PDB
PDBbind
14-mer
5vk0
RCSB PDB
PDBbind
14-mer
5ok6
RCSB PDB
PDBbind
14-mer
6bd1
RCSB PDB
PDBbind
14-mer
Entry Information
PDB ID
6nk1
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Ephrin type-A receptor 2, EphA2 LBD
Ligand Name
14-mer
EC.Number
E.C.2.7.10.1
Resolution
1.55(Å)
Affinity (Kd/Ki/IC50)
Kd=220nM
Release Year
2019
Protein/NA Sequence
Check fasta file
Primary Reference
(2019) J.Biol.Chem. Vol. 294: pp. 8791-8805
Ligand Properties
Formula
C
8
0
H
1
1
8
N
1
9
O
2
0
Molecular Weight
1665.910
Exact Mass
1664.880
No. of atoms
237
No. of bonds
243
Polar Surface Area
624.3
LOGP Value
-0.61 (
Computed with XLOGP3
)
-1.00 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 16
No. of Hydrogen Bond Acceptors: 20
No. of Rotatable Bonds: 59
No. of Nitrogen and Oxygen Atoms: 39
No. of Rings: 7
Canonical SMILES
[NH3+]CCCC[C@@H](C(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)CC[NH3+])CC(C)C)C)Cc1ccc(cc1)O)CC(=O)O)CO)Cc1ccc(cc1)O)CCC[NH+]=C(N)N
InChI String
InChI=1S/C80H115N19O20/c1-43(2)36-55(91-70(109)57(88-64(103)29-31-82)39-48-41-86-52-15-7-6-14-51(48)52)68(107)87-45(5)67(106)94-59(38-47-23-27-50(102)28-24-47)77(116)98-34-12-19-62(98)74(113)93-58(40-65(104)105)71(110)95-60(42-100)72(111)96-66(44(3)4)78(117)99-35-13-20-63(99)75(114)92-56(37-46-21-25-49(101)26-22-46)69(108)89-53(17-10-32-85-80(83)84)76(115)97-33-11-18-61(97)73(112)90-54(79(118)119)16-8-9-30-81/h6-7,14-15,21-28,41,43-45,53-63,66,86,100-102H,8-13,16-20,29-40,42,81-82H2,1-5H3,(H,87,107)(H,88,103)(H,89,108)(H,90,112)(H,91,109)(H,92,114)(H,93,113)(H,94,106)(H,95,110)(H,96,111)(H,104,105)(H,118,119)(H4,83,84,85)/p+3/t45-,53-,54-,55-,56-,57-,58-,59-,60-,61-,62-,63-,66-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P29317
Entrez Gene ID
NCBI Entrez Gene ID:
1969
ASD
Information of known allosteric effects of PDB entries
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