Browse entries in the PDBbind-CN Database
HEADER 5NFB_COMPLEX COMPND 5NFB_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 138 PRO LEU ILE VAL PRO TYR ASN LEU PRO LEU PRO GLY GLY SEQRES 2 A 138 VAL VAL PRO ARG MET LEU ILE THR ILE LEU GLY THR VAL SEQRES 3 A 138 LYS PRO ASN ALA ASN ARG ILE ALA LEU ASP PHE GLN ARG SEQRES 4 A 138 GLY ASN ASP VAL ALA PHE HIS PHE ASN PRO ARG PHE ASN SEQRES 5 A 138 GLU ASN ASN ARG ARG VAL ILE VAL CYS ASN THR LYS LEU SEQRES 6 A 138 ASP ASN ASN TRP GLY ARG GLU GLU ARG GLN SER VAL PHE SEQRES 7 A 138 PRO PHE GLU SER GLY LYS PRO PHE LYS ILE GLN VAL LEU SEQRES 8 A 138 VAL GLU PRO ASP HIS PHE LYS VAL ALA VAL ASN ASP ALA SEQRES 9 A 138 HIS LEU LEU GLN TYR ASN HIS ARG VAL LYS LYS LEU ASN SEQRES 10 A 138 GLU ILE SER LYS LEU GLY ILE SER GLY ASP ILE ASP LEU SEQRES 11 A 138 THR SER ALA SER TYR THR MET ILE HET UNN A 257 85 ATOM 1 N PRO A 113 -5.290 -6.120 9.877 1.00 40.29 N ATOM 2 CA PRO A 113 -6.170 -5.255 9.157 1.00 38.19 C ATOM 3 C PRO A 113 -5.541 -4.550 7.921 1.00 34.68 C ATOM 4 O PRO A 113 -6.325 -4.009 7.200 1.00 28.67 O ATOM 5 CB PRO A 113 -6.543 -4.197 10.197 1.00 35.65 C ATOM 6 CG PRO A 113 -5.278 -4.002 10.906 1.00 41.12 C ATOM 7 CD PRO A 113 -4.792 -5.439 11.083 1.00 41.69 C ATOM 8 HN2 PRO A 113 -4.486 -6.377 9.270 1.00 0.00 H ATOM 9 HN1 PRO A 113 -5.803 -6.981 10.154 1.00 0.00 H ATOM 10 N LEU A 114 -4.211 -4.473 7.695 1.00 30.17 N ATOM 11 CA LEU A 114 -3.675 -4.018 6.334 1.00 26.68 C ATOM 12 C LEU A 114 -3.105 -5.180 5.554 1.00 25.98 C ATOM 13 O LEU A 114 -2.620 -6.119 6.141 1.00 31.82 O ATOM 14 CB LEU A 114 -2.651 -2.873 6.399 1.00 26.22 C ATOM 15 CG LEU A 114 -3.083 -1.550 7.017 1.00 27.30 C ATOM 16 CD1 LEU A 114 -1.994 -0.488 7.102 1.00 29.31 C ATOM 17 CD2 LEU A 114 -4.280 -0.961 6.223 1.00 29.18 C ATOM 18 H LEU A 114 -3.545 -4.725 8.453 1.00 0.00 H ATOM 19 N ILE A 115 -3.157 -5.133 4.239 1.00 21.50 N ATOM 20 CA ILE A 115 -2.648 -6.234 3.437 1.00 22.66 C ATOM 21 C ILE A 115 -1.126 -5.984 3.161 1.00 20.22 C ATOM 22 O ILE A 115 -0.759 -4.932 2.636 1.00 21.60 O ATOM 23 CB ILE A 115 -3.330 -6.288 2.066 1.00 27.24 C ATOM 24 CG1 ILE A 115 -4.829 -6.662 2.215 1.00 30.20 C ATOM 25 CG2 ILE A 115 -2.598 -7.270 1.127 1.00 28.04 C ATOM 26 CD1 ILE A 115 -5.175 -8.093 1.789 1.00 34.53 C ATOM 27 H ILE A 115 -3.566 -4.300 3.769 1.00 0.00 H ATOM 28 N VAL A 116 -0.334 -7.001 3.337 1.00 18.62 N ATOM 29 CA VAL A 116 1.107 -6.926 3.005 1.00 18.75 C ATOM 30 C VAL A 116 1.379 -7.768 1.740 1.00 17.74 C ATOM 31 O VAL A 116 0.946 -8.938 1.623 1.00 18.35 O ATOM 32 CB VAL A 116 1.809 -7.474 4.251 1.00 22.08 C ATOM 33 CG1 VAL A 116 3.317 -7.637 4.068 1.00 23.03 C ATOM 34 CG2 VAL A 116 1.501 -6.592 5.464 1.00 22.68 C ATOM 35 H VAL A 116 -0.722 -7.887 3.720 1.00 0.00 H ATOM 36 N PRO A 117 2.147 -7.297 0.767 1.00 18.61 N ATOM 37 CA PRO A 117 2.845 -6.045 0.846 1.00 15.83 C ATOM 38 C PRO A 117 1.946 -4.829 0.739 1.00 16.50 C ATOM 39 O PRO A 117 0.874 -4.923 0.110 1.00 19.84 O ATOM 40 CB PRO A 117 3.787 -6.091 -0.361 1.00 17.13 C ATOM 41 CG PRO A 117 3.733 -7.381 -0.930 1.00 21.64 C ATOM 42 CD PRO A 117 2.602 -8.148 -0.343 1.00 17.77 C ATOM 43 N TYR A 118 2.296 -3.717 1.379 1.00 15.15 N ATOM 44 CA TYR A 118 1.483 -2.575 1.447 1.00 15.61 C ATOM 45 C TYR A 118 2.267 -1.412 0.894 1.00 16.54 C ATOM 46 O TYR A 118 3.432 -1.215 1.183 1.00 16.73 O ATOM 47 CB TYR A 118 1.084 -2.228 2.879 1.00 14.89 C ATOM 48 CG TYR A 118 0.176 -1.108 3.107 1.00 17.07 C ATOM 49 CD1 TYR A 118 -1.202 -1.296 2.986 1.00 20.54 C ATOM 50 CD2 TYR A 118 0.622 0.144 3.431 1.00 18.25 C ATOM 51 CE1 TYR A 118 -2.076 -0.240 3.200 1.00 22.62 C ATOM 52 CE2 TYR A 118 -0.245 1.196 3.642 1.00 21.52 C ATOM 53 CZ TYR A 118 -1.620 0.981 3.527 1.00 24.38 C ATOM 54 OH TYR A 118 -2.496 2.028 3.724 1.00 25.65 O ATOM 55 HH TYR A 118 -3.425 1.706 3.606 1.00 0.00 H ATOM 56 H TYR A 118 3.221 -3.692 1.854 1.00 0.00 H ATOM 57 N ASN A 119 1.625 -0.605 0.091 1.00 16.15 N ATOM 58 CA ASN A 119 2.202 0.607 -0.399 1.00 16.48 C ATOM 59 C ASN A 119 1.543 1.829 0.218 1.00 15.84 C ATOM 60 O ASN A 119 0.264 2.038 0.177 1.00 17.60 O ATOM 61 CB ASN A 119 1.962 0.756 -1.886 1.00 18.79 C ATOM 62 CG ASN A 119 2.528 2.104 -2.426 1.00 26.65 C ATOM 63 OD1 ASN A 119 3.737 2.324 -2.353 1.00 30.62 O ATOM 64 ND2 ASN A 119 1.632 3.053 -2.904 1.00 33.17 N ATOM 65 HD22 ASN A 119 0.617 2.832 -2.952 1.00 0.00 H ATOM 66 HD21 ASN A 119 1.977 3.984 -3.214 1.00 0.00 H ATOM 67 H ASN A 119 0.659 -0.854 -0.202 1.00 0.00 H ATOM 68 N LEU A 120 2.380 2.646 0.811 1.00 13.50 N ATOM 69 CA LEU A 120 1.988 3.880 1.421 1.00 13.25 C ATOM 70 C LEU A 120 2.510 5.024 0.542 1.00 13.90 C ATOM 71 O LEU A 120 3.704 5.295 0.470 1.00 12.19 O ATOM 72 CB LEU A 120 2.567 4.028 2.772 1.00 15.60 C ATOM 73 CG LEU A 120 2.250 5.281 3.560 1.00 17.42 C ATOM 74 CD1 LEU A 120 0.768 5.404 3.940 1.00 19.78 C ATOM 75 CD2 LEU A 120 3.134 5.491 4.781 1.00 18.91 C ATOM 76 H LEU A 120 3.386 2.382 0.840 1.00 0.00 H ATOM 77 N PRO A 121 1.612 5.768 -0.143 1.00 13.50 N ATOM 78 CA PRO A 121 2.047 6.935 -0.885 1.00 13.74 C ATOM 79 C PRO A 121 2.553 7.974 -0.017 1.00 12.83 C ATOM 80 O PRO A 121 2.029 8.146 1.100 1.00 12.94 O ATOM 81 CB PRO A 121 0.715 7.442 -1.497 1.00 14.70 C ATOM 82 CG PRO A 121 -0.202 6.320 -1.470 1.00 16.90 C ATOM 83 CD PRO A 121 0.160 5.527 -0.232 1.00 16.27 C ATOM 84 N LEU A 122 3.602 8.668 -0.435 1.00 10.37 N ATOM 85 CA LEU A 122 4.228 9.798 0.263 1.00 10.80 C ATOM 86 C LEU A 122 4.084 10.991 -0.665 1.00 12.09 C ATOM 87 O LEU A 122 4.950 11.278 -1.471 1.00 13.79 O ATOM 88 CB LEU A 122 5.666 9.501 0.565 1.00 11.12 C ATOM 89 CG LEU A 122 5.922 8.151 1.336 1.00 12.83 C ATOM 90 CD1 LEU A 122 7.434 7.956 1.534 1.00 12.90 C ATOM 91 CD2 LEU A 122 5.269 8.095 2.719 1.00 14.30 C ATOM 92 H LEU A 122 4.022 8.385 -1.344 1.00 0.00 H ATOM 93 N PRO A 123 2.992 11.732 -0.482 1.00 12.67 N ATOM 94 CA PRO A 123 2.658 12.730 -1.562 1.00 13.29 C ATOM 95 C PRO A 123 3.710 13.841 -1.614 1.00 13.16 C ATOM 96 O PRO A 123 3.964 14.503 -0.684 1.00 13.13 O ATOM 97 CB PRO A 123 1.286 13.260 -1.090 1.00 13.57 C ATOM 98 CG PRO A 123 0.714 12.151 -0.270 1.00 13.70 C ATOM 99 CD PRO A 123 1.874 11.563 0.454 1.00 12.70 C ATOM 100 N GLY A 124 4.276 14.136 -2.772 1.00 12.03 N ATOM 101 CA GLY A 124 5.335 15.153 -2.824 1.00 11.58 C ATOM 102 C GLY A 124 6.682 14.745 -2.272 1.00 11.27 C ATOM 103 O GLY A 124 7.510 15.544 -2.040 1.00 12.81 O ATOM 104 H GLY A 124 3.973 13.651 -3.641 1.00 0.00 H ATOM 105 N GLY A 125 6.829 13.434 -1.949 1.00 11.82 N ATOM 106 CA GLY A 125 8.072 12.917 -1.410 1.00 12.08 C ATOM 107 C GLY A 125 8.216 13.103 0.037 1.00 13.91 C ATOM 108 O GLY A 125 7.245 13.430 0.717 1.00 13.41 O ATOM 109 H GLY A 125 6.030 12.784 -2.092 1.00 0.00 H ATOM 110 N VAL A 126 9.409 12.920 0.487 1.00 13.60 N ATOM 111 CA VAL A 126 9.759 13.115 1.877 1.00 12.34 C ATOM 112 C VAL A 126 10.457 14.431 2.012 1.00 14.38 C ATOM 113 O VAL A 126 10.917 15.104 1.016 1.00 13.12 O ATOM 114 CB VAL A 126 10.529 11.963 2.491 1.00 14.46 C ATOM 115 CG1 VAL A 126 9.748 10.671 2.328 1.00 14.87 C ATOM 116 CG2 VAL A 126 11.939 11.825 1.955 1.00 13.91 C ATOM 117 H VAL A 126 10.151 12.620 -0.177 1.00 0.00 H ATOM 118 N VAL A 127 10.542 14.898 3.236 1.00 15.87 N ATOM 119 CA VAL A 127 11.099 16.198 3.539 1.00 16.03 C ATOM 120 C VAL A 127 11.571 16.068 4.993 1.00 17.67 C ATOM 121 O VAL A 127 10.923 15.342 5.766 1.00 14.92 O ATOM 122 CB VAL A 127 10.026 17.310 3.362 1.00 18.89 C ATOM 123 CG1 VAL A 127 8.862 17.122 4.307 1.00 19.45 C ATOM 124 CG2 VAL A 127 10.672 18.686 3.388 1.00 19.96 C ATOM 125 H VAL A 127 10.195 14.309 4.020 1.00 0.00 H ATOM 126 N PRO A 128 12.596 16.849 5.381 1.00 15.59 N ATOM 127 CA PRO A 128 12.954 16.782 6.776 1.00 17.00 C ATOM 128 C PRO A 128 11.719 17.279 7.648 1.00 15.93 C ATOM 129 O PRO A 128 10.841 18.117 7.244 1.00 18.40 O ATOM 130 CB PRO A 128 14.226 17.635 6.875 1.00 18.19 C ATOM 131 CG PRO A 128 14.801 17.615 5.471 1.00 17.30 C ATOM 132 CD PRO A 128 13.601 17.627 4.604 1.00 16.02 C ATOM 133 N ARG A 129 11.597 16.610 8.801 1.00 17.38 N ATOM 134 CA ARG A 129 10.512 16.669 9.789 1.00 17.68 C ATOM 135 C ARG A 129 9.372 15.739 9.563 1.00 16.37 C ATOM 136 O ARG A 129 8.430 15.673 10.385 1.00 18.20 O ATOM 137 CB ARG A 129 9.989 18.100 10.042 1.00 20.73 C ATOM 138 CG ARG A 129 11.169 18.983 10.343 1.00 23.93 C ATOM 139 CD ARG A 129 10.799 20.321 10.951 1.00 30.73 C ATOM 140 NE ARG A 129 10.274 20.071 12.292 1.00 34.18 N ATOM 141 CZ ARG A 129 11.027 19.717 13.344 1.00 37.87 C ATOM 142 NH1 ARG A 129 12.338 19.642 13.229 1.00 34.61 N ATOM 143 NH2 ARG A 129 10.466 19.438 14.520 1.00 39.24 N ATOM 144 HE ARG A 129 9.250 20.174 12.440 1.00 0.00 H ATOM 145 HH12 ARG A 129 12.917 19.367 14.048 1.00 0.00 H ATOM 146 HH11 ARG A 129 12.793 19.858 12.319 1.00 0.00 H ATOM 147 HH22 ARG A 129 11.061 19.165 15.328 1.00 0.00 H ATOM 148 HH21 ARG A 129 9.433 19.494 14.630 1.00 0.00 H ATOM 149 H ARG A 129 12.377 15.960 9.028 1.00 0.00 H ATOM 150 N MET A 130 9.436 14.932 8.510 1.00 12.55 N ATOM 151 CA MET A 130 8.405 13.975 8.261 1.00 13.90 C ATOM 152 C MET A 130 8.749 12.712 9.039 1.00 13.41 C ATOM 153 O MET A 130 9.857 12.221 8.936 1.00 14.01 O ATOM 154 CB MET A 130 8.274 13.679 6.775 1.00 14.06 C ATOM 155 CG MET A 130 7.124 12.820 6.379 1.00 15.39 C ATOM 156 SD MET A 130 7.067 12.778 4.517 1.00 18.98 S ATOM 157 CE MET A 130 5.647 11.781 4.170 1.00 20.63 C ATOM 158 H MET A 130 10.245 14.997 7.860 1.00 0.00 H ATOM 159 N LEU A 131 7.769 12.259 9.813 1.00 13.81 N ATOM 160 CA LEU A 131 7.874 11.092 10.662 1.00 13.71 C ATOM 161 C LEU A 131 6.923 10.037 10.159 1.00 12.98 C ATOM 162 O LEU A 131 5.728 10.271 10.107 1.00 14.81 O ATOM 163 CB LEU A 131 7.591 11.514 12.124 1.00 15.32 C ATOM 164 CG LEU A 131 7.624 10.352 13.130 1.00 17.16 C ATOM 165 CD1 LEU A 131 9.055 9.886 13.349 1.00 17.79 C ATOM 166 CD2 LEU A 131 6.976 10.830 14.407 1.00 19.02 C ATOM 167 H LEU A 131 6.867 12.777 9.808 1.00 0.00 H ATOM 168 N ILE A 132 7.433 8.849 9.764 1.00 11.58 N ATOM 169 CA ILE A 132 6.674 7.771 9.272 1.00 13.24 C ATOM 170 C ILE A 132 6.599 6.784 10.432 1.00 13.45 C ATOM 171 O ILE A 132 7.636 6.414 10.985 1.00 15.19 O ATOM 172 CB ILE A 132 7.280 7.172 8.021 1.00 15.85 C ATOM 173 CG1 ILE A 132 7.278 8.233 6.829 1.00 17.97 C ATOM 174 CG2 ILE A 132 6.499 5.960 7.623 1.00 19.19 C ATOM 175 CD1 ILE A 132 8.598 8.933 6.569 1.00 21.82 C ATOM 176 H ILE A 132 8.463 8.722 9.829 1.00 0.00 H ATOM 177 N THR A 133 5.396 6.335 10.783 1.00 13.47 N ATOM 178 CA THR A 133 5.214 5.340 11.866 1.00 14.71 C ATOM 179 C THR A 133 4.576 4.097 11.340 1.00 14.07 C ATOM 180 O THR A 133 3.480 4.149 10.741 1.00 15.01 O ATOM 181 CB THR A 133 4.291 5.917 12.997 1.00 14.93 C ATOM 182 OG1 THR A 133 4.943 7.090 13.509 1.00 15.53 O ATOM 183 CG2 THR A 133 4.134 4.860 14.173 1.00 15.04 C ATOM 184 HG1 THR A 133 4.390 7.486 14.228 1.00 0.00 H ATOM 185 H THR A 133 4.558 6.693 10.282 1.00 0.00 H ATOM 186 N ILE A 134 5.170 2.943 11.619 1.00 12.87 N ATOM 187 CA ILE A 134 4.675 1.633 11.130 1.00 11.75 C ATOM 188 C ILE A 134 4.436 0.781 12.384 1.00 13.07 C ATOM 189 O ILE A 134 5.319 0.611 13.190 1.00 13.56 O ATOM 190 CB ILE A 134 5.620 0.870 10.169 1.00 13.15 C ATOM 191 CG1 ILE A 134 5.867 1.643 8.896 1.00 17.54 C ATOM 192 CG2 ILE A 134 5.137 -0.502 9.815 1.00 14.19 C ATOM 193 CD1 ILE A 134 7.205 2.272 8.868 1.00 20.83 C ATOM 194 H ILE A 134 6.025 2.958 12.210 1.00 0.00 H ATOM 195 N LEU A 135 3.227 0.293 12.559 1.00 12.85 N ATOM 196 CA LEU A 135 2.865 -0.615 13.697 1.00 12.01 C ATOM 197 C LEU A 135 2.487 -1.947 13.148 1.00 11.63 C ATOM 198 O LEU A 135 1.728 -2.096 12.186 1.00 12.38 O ATOM 199 CB LEU A 135 1.662 -0.086 14.516 1.00 14.33 C ATOM 200 CG LEU A 135 1.881 1.234 15.215 1.00 16.09 C ATOM 201 CD1 LEU A 135 0.578 1.810 15.682 1.00 20.75 C ATOM 202 CD2 LEU A 135 2.826 1.036 16.376 1.00 19.77 C ATOM 203 H LEU A 135 2.486 0.549 11.875 1.00 0.00 H ATOM 204 N GLY A 136 3.044 -3.020 13.729 1.00 11.41 N ATOM 205 CA GLY A 136 2.654 -4.356 13.246 1.00 12.69 C ATOM 206 C GLY A 136 3.153 -5.386 14.257 1.00 12.53 C ATOM 207 O GLY A 136 3.677 -5.015 15.327 1.00 13.63 O ATOM 208 H GLY A 136 3.733 -2.912 14.500 1.00 0.00 H ATOM 209 N THR A 137 3.016 -6.628 13.855 1.00 12.52 N ATOM 210 CA THR A 137 3.512 -7.744 14.685 1.00 11.81 C ATOM 211 C THR A 137 4.289 -8.634 13.796 1.00 11.55 C ATOM 212 O THR A 137 3.883 -8.995 12.667 1.00 12.07 O ATOM 213 CB THR A 137 2.293 -8.469 15.347 1.00 13.27 C ATOM 214 OG1 THR A 137 1.550 -7.569 16.176 1.00 17.77 O ATOM 215 CG2 THR A 137 2.759 -9.602 16.269 1.00 14.55 C ATOM 216 HG1 THR A 137 0.786 -8.051 16.582 1.00 0.00 H ATOM 217 H THR A 137 2.554 -6.828 12.945 1.00 0.00 H ATOM 218 N VAL A 138 5.402 -9.167 14.286 1.00 10.66 N ATOM 219 CA VAL A 138 6.196 -10.094 13.497 1.00 11.21 C ATOM 220 C VAL A 138 5.559 -11.443 13.592 1.00 13.67 C ATOM 221 O VAL A 138 5.138 -11.815 14.711 1.00 15.72 O ATOM 222 CB VAL A 138 7.631 -10.173 14.066 1.00 12.80 C ATOM 223 CG1 VAL A 138 8.463 -11.125 13.206 1.00 13.85 C ATOM 224 CG2 VAL A 138 8.315 -8.809 14.021 1.00 13.27 C ATOM 225 H VAL A 138 5.710 -8.918 15.248 1.00 0.00 H ATOM 226 N LYS A 139 5.453 -12.126 12.450 1.00 14.37 N ATOM 227 CA LYS A 139 4.886 -13.492 12.419 1.00 15.77 C ATOM 228 C LYS A 139 5.784 -14.451 13.190 1.00 17.55 C ATOM 229 O LYS A 139 6.962 -14.246 13.336 1.00 16.03 O ATOM 230 CB LYS A 139 4.755 -13.911 10.978 1.00 18.71 C ATOM 231 CG LYS A 139 3.635 -13.176 10.304 1.00 21.18 C ATOM 232 CD LYS A 139 3.464 -13.644 8.885 1.00 28.40 C ATOM 233 CE LYS A 139 2.106 -13.232 8.370 1.00 35.98 C ATOM 234 NZ LYS A 139 2.123 -13.386 6.912 1.00 43.29 N ATOM 235 HZ1 LYS A 139 2.865 -12.779 6.509 1.00 0.00 H ATOM 236 HZ2 LYS A 139 2.318 -14.379 6.672 1.00 0.00 H ATOM 237 HZ3 LYS A 139 1.198 -13.109 6.525 1.00 0.00 H ATOM 238 H LYS A 139 5.776 -11.689 11.563 1.00 0.00 H ATOM 239 N PRO A 140 5.195 -15.568 13.625 1.00 20.59 N ATOM 240 CA PRO A 140 6.020 -16.662 14.086 1.00 20.51 C ATOM 241 C PRO A 140 6.984 -17.146 12.998 1.00 19.96 C ATOM 242 O PRO A 140 6.695 -17.140 11.794 1.00 28.07 O ATOM 243 CB PRO A 140 4.961 -17.743 14.410 1.00 24.76 C ATOM 244 CG PRO A 140 3.722 -16.960 14.703 1.00 26.99 C ATOM 245 CD PRO A 140 3.765 -15.828 13.742 1.00 24.32 C ATOM 246 N ASN A 141 8.162 -17.544 13.431 1.00 23.89 N ATOM 247 CA ASN A 141 9.171 -18.056 12.512 1.00 25.73 C ATOM 248 C ASN A 141 9.433 -17.104 11.314 1.00 23.47 C ATOM 249 O ASN A 141 9.636 -17.507 10.180 1.00 22.18 O ATOM 250 CB ASN A 141 8.761 -19.460 11.954 1.00 26.94 C ATOM 251 CG ASN A 141 8.331 -20.425 13.069 1.00 29.86 C ATOM 252 OD1 ASN A 141 7.188 -20.836 13.110 1.00 38.28 O ATOM 253 ND2 ASN A 141 9.204 -20.706 13.998 1.00 33.11 N ATOM 254 HD22 ASN A 141 10.174 -20.336 13.929 1.00 0.00 H ATOM 255 HD21 ASN A 141 8.930 -21.300 14.807 1.00 0.00 H ATOM 256 H ASN A 141 8.377 -17.492 14.447 1.00 0.00 H ATOM 257 N ALA A 142 9.409 -15.809 11.594 1.00 21.46 N ATOM 258 CA ALA A 142 9.770 -14.883 10.551 1.00 18.27 C ATOM 259 C ALA A 142 11.152 -15.109 9.997 1.00 15.21 C ATOM 260 O ALA A 142 12.104 -15.524 10.680 1.00 17.87 O ATOM 261 CB ALA A 142 9.666 -13.447 11.115 1.00 17.09 C ATOM 262 H ALA A 142 9.137 -15.471 12.539 1.00 0.00 H ATOM 263 N ASN A 143 11.293 -14.785 8.687 1.00 15.79 N ATOM 264 CA ASN A 143 12.602 -14.762 8.084 1.00 15.99 C ATOM 265 C ASN A 143 13.064 -13.337 7.753 1.00 14.72 C ATOM 266 O ASN A 143 14.209 -13.076 7.818 1.00 15.00 O ATOM 267 CB ASN A 143 12.550 -15.661 6.861 1.00 17.23 C ATOM 268 CG ASN A 143 13.895 -15.823 6.191 1.00 18.45 C ATOM 269 OD1 ASN A 143 14.082 -15.331 5.086 1.00 23.05 O ATOM 270 ND2 ASN A 143 14.836 -16.470 6.854 1.00 21.67 N ATOM 271 HD22 ASN A 143 14.630 -16.871 7.791 1.00 0.00 H ATOM 272 HD21 ASN A 143 15.784 -16.578 6.439 1.00 0.00 H ATOM 273 H ASN A 143 10.455 -14.553 8.117 1.00 0.00 H ATOM 274 N ARG A 144 12.147 -12.478 7.324 1.00 14.92 N ATOM 275 CA ARG A 144 12.549 -11.123 6.929 1.00 14.68 C ATOM 276 C ARG A 144 11.428 -10.098 7.062 1.00 14.88 C ATOM 277 O ARG A 144 10.244 -10.415 7.061 1.00 15.57 O ATOM 278 CB ARG A 144 13.052 -11.105 5.501 1.00 16.76 C ATOM 279 CG ARG A 144 11.905 -11.390 4.487 1.00 17.17 C ATOM 280 CD ARG A 144 12.450 -11.505 3.098 1.00 20.24 C ATOM 281 NE ARG A 144 13.070 -10.263 2.551 1.00 18.03 N ATOM 282 CZ ARG A 144 12.425 -9.305 1.886 1.00 17.78 C ATOM 283 NH1 ARG A 144 11.104 -9.316 1.796 1.00 22.16 N ATOM 284 NH2 ARG A 144 13.101 -8.300 1.363 1.00 17.20 N ATOM 285 HE ARG A 144 14.091 -10.134 2.701 1.00 0.00 H ATOM 286 HH12 ARG A 144 10.612 -8.563 1.274 1.00 0.00 H ATOM 287 HH11 ARG A 144 10.558 -10.078 2.247 1.00 0.00 H ATOM 288 HH22 ARG A 144 12.600 -7.551 0.844 1.00 0.00 H ATOM 289 HH21 ARG A 144 14.135 -8.257 1.470 1.00 0.00 H ATOM 290 H ARG A 144 11.149 -12.764 7.268 1.00 0.00 H ATOM 291 N ILE A 145 11.803 -8.844 7.189 1.00 12.85 N ATOM 292 CA ILE A 145 10.899 -7.695 7.029 1.00 13.62 C ATOM 293 C ILE A 145 11.599 -6.749 6.077 1.00 12.22 C ATOM 294 O ILE A 145 12.846 -6.674 6.092 1.00 10.81 O ATOM 295 CB ILE A 145 10.785 -6.945 8.386 1.00 15.47 C ATOM 296 CG1 ILE A 145 10.151 -7.885 9.407 1.00 18.07 C ATOM 297 CG2 ILE A 145 9.992 -5.649 8.260 1.00 15.56 C ATOM 298 CD1 ILE A 145 10.276 -7.395 10.787 1.00 17.98 C ATOM 299 H ILE A 145 12.800 -8.653 7.416 1.00 0.00 H ATOM 300 N ALA A 146 10.819 -5.940 5.331 1.00 12.54 N ATOM 301 CA ALA A 146 11.456 -4.910 4.540 1.00 12.30 C ATOM 302 C ALA A 146 10.625 -3.678 4.453 1.00 12.20 C ATOM 303 O ALA A 146 9.384 -3.685 4.263 1.00 12.47 O ATOM 304 CB ALA A 146 11.792 -5.397 3.138 1.00 12.29 C ATOM 305 H ALA A 146 9.785 -6.054 5.325 1.00 0.00 H ATOM 306 N LEU A 147 11.324 -2.562 4.566 1.00 9.61 N ATOM 307 CA LEU A 147 10.782 -1.245 4.233 1.00 10.69 C ATOM 308 C LEU A 147 11.571 -0.742 3.061 1.00 12.67 C ATOM 309 O LEU A 147 12.818 -0.732 3.055 1.00 13.35 O ATOM 310 CB LEU A 147 10.857 -0.201 5.337 1.00 11.80 C ATOM 311 CG LEU A 147 10.289 -0.445 6.694 1.00 16.38 C ATOM 312 CD1 LEU A 147 10.404 0.785 7.579 1.00 16.46 C ATOM 313 CD2 LEU A 147 8.950 -0.976 6.608 1.00 19.14 C ATOM 314 H LEU A 147 12.304 -2.623 4.907 1.00 0.00 H ATOM 315 N ASP A 148 10.874 -0.270 2.020 1.00 10.20 N ATOM 316 CA ASP A 148 11.518 0.241 0.782 1.00 10.26 C ATOM 317 C ASP A 148 10.932 1.606 0.428 1.00 9.31 C ATOM 318 O ASP A 148 9.782 1.766 -0.039 1.00 9.29 O ATOM 319 CB ASP A 148 11.310 -0.706 -0.387 1.00 10.59 C ATOM 320 CG ASP A 148 12.078 -2.019 -0.173 1.00 14.05 C ATOM 321 OD1 ASP A 148 13.248 -1.992 -0.545 1.00 17.52 O ATOM 322 OD2 ASP A 148 11.460 -3.057 0.277 1.00 17.40 O ATOM 323 H ASP A 148 9.836 -0.261 2.080 1.00 0.00 H ATOM 324 N PHE A 149 11.763 2.618 0.698 1.00 8.59 N ATOM 325 CA PHE A 149 11.414 4.006 0.284 1.00 9.32 C ATOM 326 C PHE A 149 11.852 4.193 -1.160 1.00 10.01 C ATOM 327 O PHE A 149 13.074 4.078 -1.401 1.00 9.46 O ATOM 328 CB PHE A 149 12.141 4.998 1.186 1.00 9.50 C ATOM 329 CG PHE A 149 11.618 5.133 2.580 1.00 10.63 C ATOM 330 CD1 PHE A 149 10.617 6.065 2.868 1.00 12.59 C ATOM 331 CD2 PHE A 149 12.037 4.305 3.593 1.00 11.08 C ATOM 332 CE1 PHE A 149 10.131 6.246 4.165 1.00 12.56 C ATOM 333 CE2 PHE A 149 11.501 4.406 4.872 1.00 11.95 C ATOM 334 CZ PHE A 149 10.543 5.374 5.154 1.00 11.69 C ATOM 335 H PHE A 149 12.656 2.436 1.199 1.00 0.00 H ATOM 336 N GLN A 150 10.880 4.375 -2.078 1.00 8.87 N ATOM 337 CA GLN A 150 11.137 4.315 -3.492 1.00 10.19 C ATOM 338 C GLN A 150 11.096 5.665 -4.140 1.00 10.06 C ATOM 339 O GLN A 150 10.254 6.492 -3.835 1.00 10.41 O ATOM 340 CB GLN A 150 10.092 3.462 -4.181 1.00 12.83 C ATOM 341 CG GLN A 150 9.783 2.054 -3.721 1.00 15.32 C ATOM 342 CD GLN A 150 10.544 0.936 -4.440 1.00 16.52 C ATOM 343 OE1 GLN A 150 10.633 -0.148 -3.861 1.00 18.75 O ATOM 344 NE2 GLN A 150 11.081 1.159 -5.651 1.00 15.88 N ATOM 345 HE22 GLN A 150 10.980 2.091 -6.101 1.00 0.00 H ATOM 346 HE21 GLN A 150 11.598 0.399 -6.139 1.00 0.00 H ATOM 347 H GLN A 150 9.911 4.565 -1.752 1.00 0.00 H ATOM 348 N ARG A 151 12.028 5.818 -5.081 1.00 9.06 N ATOM 349 CA ARG A 151 11.952 6.918 -6.041 1.00 9.35 C ATOM 350 C ARG A 151 11.788 6.279 -7.426 1.00 9.38 C ATOM 351 O ARG A 151 12.742 5.835 -8.040 1.00 9.94 O ATOM 352 CB ARG A 151 13.225 7.697 -6.026 1.00 9.90 C ATOM 353 CG ARG A 151 13.364 8.807 -7.095 1.00 10.12 C ATOM 354 CD ARG A 151 14.583 9.694 -6.937 1.00 11.83 C ATOM 355 NE ARG A 151 14.683 10.601 -8.097 1.00 11.56 N ATOM 356 CZ ARG A 151 15.535 10.504 -9.129 1.00 13.81 C ATOM 357 NH1 ARG A 151 16.481 9.566 -9.225 1.00 14.78 N ATOM 358 NH2 ARG A 151 15.374 11.352 -10.154 1.00 14.39 N ATOM 359 HE ARG A 151 14.021 11.403 -8.117 1.00 0.00 H ATOM 360 HH12 ARG A 151 17.111 9.545 -10.052 1.00 0.00 H ATOM 361 HH11 ARG A 151 16.588 8.856 -8.472 1.00 0.00 H ATOM 362 HH22 ARG A 151 16.015 11.307 -10.972 1.00 0.00 H ATOM 363 HH21 ARG A 151 14.608 12.055 -10.132 1.00 0.00 H ATOM 364 H ARG A 151 12.820 5.146 -5.133 1.00 0.00 H ATOM 365 N GLY A 152 10.558 6.168 -7.866 1.00 9.21 N ATOM 366 CA GLY A 152 10.313 5.352 -9.039 1.00 9.03 C ATOM 367 C GLY A 152 10.803 3.915 -8.832 1.00 10.13 C ATOM 368 O GLY A 152 10.491 3.300 -7.835 1.00 12.27 O ATOM 369 H GLY A 152 9.775 6.655 -7.384 1.00 0.00 H ATOM 370 N ASN A 153 11.537 3.382 -9.773 1.00 9.48 N ATOM 371 CA ASN A 153 12.101 2.030 -9.627 1.00 10.80 C ATOM 372 C ASN A 153 13.314 1.952 -8.702 1.00 11.38 C ATOM 373 O ASN A 153 13.717 0.840 -8.314 1.00 13.44 O ATOM 374 CB ASN A 153 12.520 1.499 -11.015 1.00 11.35 C ATOM 375 CG ASN A 153 13.009 0.079 -10.974 1.00 13.03 C ATOM 376 OD1 ASN A 153 12.209 -0.808 -10.566 1.00 15.46 O ATOM 377 ND2 ASN A 153 14.266 -0.119 -11.306 1.00 14.84 N ATOM 378 HD22 ASN A 153 14.849 0.678 -11.633 1.00 0.00 H ATOM 379 HD21 ASN A 153 14.677 -1.072 -11.242 1.00 0.00 H ATOM 380 H ASN A 153 11.726 3.923 -10.641 1.00 0.00 H ATOM 381 N ASP A 154 13.939 3.091 -8.397 1.00 10.24 N ATOM 382 CA ASP A 154 14.999 3.187 -7.425 1.00 10.17 C ATOM 383 C ASP A 154 14.515 3.033 -6.024 1.00 10.79 C ATOM 384 O ASP A 154 13.391 3.416 -5.687 1.00 10.99 O ATOM 385 CB ASP A 154 15.792 4.448 -7.592 1.00 10.64 C ATOM 386 CG ASP A 154 16.723 4.399 -8.833 1.00 12.49 C ATOM 387 OD1 ASP A 154 16.816 3.365 -9.542 1.00 14.25 O ATOM 388 OD2 ASP A 154 17.408 5.424 -9.053 1.00 15.12 O ATOM 389 H ASP A 154 13.644 3.959 -8.889 1.00 0.00 H ATOM 390 N VAL A 155 15.374 2.432 -5.186 1.00 9.74 N ATOM 391 CA VAL A 155 15.123 2.273 -3.767 1.00 9.94 C ATOM 392 C VAL A 155 16.043 3.175 -3.022 1.00 10.76 C ATOM 393 O VAL A 155 17.232 2.888 -2.937 1.00 10.45 O ATOM 394 CB VAL A 155 15.211 0.835 -3.227 1.00 10.33 C ATOM 395 CG1 VAL A 155 14.833 0.825 -1.767 1.00 11.14 C ATOM 396 CG2 VAL A 155 14.260 -0.048 -3.964 1.00 11.73 C ATOM 397 H VAL A 155 16.265 2.062 -5.574 1.00 0.00 H ATOM 398 N ALA A 156 15.541 4.298 -2.534 1.00 8.93 N ATOM 399 CA ALA A 156 16.351 5.231 -1.814 1.00 8.61 C ATOM 400 C ALA A 156 16.870 4.715 -0.521 1.00 8.98 C ATOM 401 O ALA A 156 18.032 4.970 -0.138 1.00 8.83 O ATOM 402 CB ALA A 156 15.560 6.533 -1.571 1.00 9.31 C ATOM 403 H ALA A 156 14.532 4.507 -2.678 1.00 0.00 H ATOM 404 N PHE A 157 16.019 3.973 0.171 1.00 8.08 N ATOM 405 CA PHE A 157 16.355 3.415 1.515 1.00 7.97 C ATOM 406 C PHE A 157 15.577 2.151 1.627 1.00 9.12 C ATOM 407 O PHE A 157 14.356 2.175 1.780 1.00 8.59 O ATOM 408 CB PHE A 157 16.011 4.438 2.642 1.00 8.42 C ATOM 409 CG PHE A 157 16.232 3.962 4.018 1.00 8.37 C ATOM 410 CD1 PHE A 157 17.299 3.163 4.353 1.00 8.12 C ATOM 411 CD2 PHE A 157 15.396 4.404 5.002 1.00 7.58 C ATOM 412 CE1 PHE A 157 17.415 2.733 5.656 1.00 8.22 C ATOM 413 CE2 PHE A 157 15.546 4.000 6.295 1.00 8.31 C ATOM 414 CZ PHE A 157 16.584 3.183 6.659 1.00 8.29 C ATOM 415 H PHE A 157 15.083 3.772 -0.236 1.00 0.00 H ATOM 416 N HIS A 158 16.357 1.059 1.663 1.00 8.31 N ATOM 417 CA HIS A 158 15.878 -0.267 1.953 1.00 8.70 C ATOM 418 C HIS A 158 16.325 -0.572 3.348 1.00 9.89 C ATOM 419 O HIS A 158 17.561 -0.476 3.600 1.00 9.55 O ATOM 420 CB HIS A 158 16.550 -1.222 0.950 1.00 9.45 C ATOM 421 CG HIS A 158 16.372 -2.685 1.133 1.00 9.32 C ATOM 422 ND1 HIS A 158 15.215 -3.354 0.828 1.00 11.53 N ATOM 423 CD2 HIS A 158 17.302 -3.657 1.357 1.00 11.43 C ATOM 424 CE1 HIS A 158 15.404 -4.671 0.950 1.00 13.00 C ATOM 425 NE2 HIS A 158 16.669 -4.875 1.234 1.00 12.79 N ATOM 426 H HIS A 158 17.372 1.179 1.469 1.00 0.00 H ATOM 427 N PHE A 159 15.384 -0.945 4.226 1.00 8.82 N ATOM 428 CA PHE A 159 15.649 -1.313 5.633 1.00 8.27 C ATOM 429 C PHE A 159 15.129 -2.739 5.808 1.00 9.36 C ATOM 430 O PHE A 159 13.961 -3.016 5.702 1.00 9.65 O ATOM 431 CB PHE A 159 14.908 -0.325 6.523 1.00 8.73 C ATOM 432 CG PHE A 159 14.870 -0.682 8.007 1.00 8.81 C ATOM 433 CD1 PHE A 159 15.871 -0.273 8.850 1.00 9.61 C ATOM 434 CD2 PHE A 159 13.792 -1.417 8.545 1.00 9.49 C ATOM 435 CE1 PHE A 159 15.812 -0.621 10.184 1.00 9.08 C ATOM 436 CE2 PHE A 159 13.763 -1.766 9.889 1.00 9.31 C ATOM 437 CZ PHE A 159 14.762 -1.358 10.706 1.00 8.38 C ATOM 438 H PHE A 159 14.399 -0.978 3.895 1.00 0.00 H ATOM 439 N ASN A 160 16.079 -3.686 6.014 1.00 9.41 N ATOM 440 CA ASN A 160 15.768 -5.142 5.836 1.00 9.24 C ATOM 441 C ASN A 160 16.298 -5.966 7.036 1.00 11.31 C ATOM 442 O ASN A 160 17.380 -6.534 6.954 1.00 11.26 O ATOM 443 CB ASN A 160 16.389 -5.629 4.532 1.00 10.83 C ATOM 444 CG ASN A 160 16.225 -7.092 4.265 1.00 10.41 C ATOM 445 OD1 ASN A 160 15.227 -7.696 4.672 1.00 14.56 O ATOM 446 ND2 ASN A 160 17.080 -7.614 3.544 1.00 10.55 N ATOM 447 HD22 ASN A 160 17.902 -7.061 3.229 1.00 0.00 H ATOM 448 HD21 ASN A 160 16.978 -8.607 3.252 1.00 0.00 H ATOM 449 H ASN A 160 17.037 -3.398 6.299 1.00 0.00 H ATOM 450 N PRO A 161 15.512 -6.048 8.079 1.00 11.01 N ATOM 451 CA PRO A 161 15.768 -7.081 9.131 1.00 10.89 C ATOM 452 C PRO A 161 15.728 -8.473 8.571 1.00 10.75 C ATOM 453 O PRO A 161 14.780 -8.842 7.928 1.00 11.85 O ATOM 454 CB PRO A 161 14.629 -6.844 10.167 1.00 11.42 C ATOM 455 CG PRO A 161 14.278 -5.379 9.998 1.00 10.99 C ATOM 456 CD PRO A 161 14.355 -5.178 8.493 1.00 11.70 C ATOM 457 N ARG A 162 16.790 -9.252 8.846 1.00 11.24 N ATOM 458 CA ARG A 162 16.931 -10.632 8.424 1.00 12.36 C ATOM 459 C ARG A 162 17.073 -11.477 9.692 1.00 12.19 C ATOM 460 O ARG A 162 17.968 -11.259 10.484 1.00 13.11 O ATOM 461 CB ARG A 162 18.158 -10.739 7.609 1.00 12.79 C ATOM 462 CG ARG A 162 18.072 -10.002 6.305 1.00 11.98 C ATOM 463 CD ARG A 162 19.290 -10.263 5.429 1.00 13.59 C ATOM 464 NE ARG A 162 19.199 -9.410 4.239 1.00 14.07 N ATOM 465 CZ ARG A 162 20.111 -9.378 3.310 1.00 13.90 C ATOM 466 NH1 ARG A 162 21.226 -10.081 3.418 1.00 15.78 N ATOM 467 NH2 ARG A 162 19.970 -8.533 2.292 1.00 13.91 N ATOM 468 HE ARG A 162 18.364 -8.800 4.132 1.00 0.00 H ATOM 469 HH12 ARG A 162 21.941 -10.041 2.664 1.00 0.00 H ATOM 470 HH11 ARG A 162 21.388 -10.674 4.257 1.00 0.00 H ATOM 471 HH22 ARG A 162 20.690 -8.497 1.543 1.00 0.00 H ATOM 472 HH21 ARG A 162 19.139 -7.909 2.245 1.00 0.00 H ATOM 473 H ARG A 162 17.565 -8.835 9.401 1.00 0.00 H ATOM 474 N PHE A 163 16.173 -12.427 9.845 1.00 13.53 N ATOM 475 CA PHE A 163 16.072 -13.250 11.082 1.00 14.52 C ATOM 476 C PHE A 163 17.005 -14.458 11.088 1.00 15.23 C ATOM 477 O PHE A 163 17.341 -14.988 12.153 1.00 15.07 O ATOM 478 CB PHE A 163 14.632 -13.670 11.335 1.00 12.78 C ATOM 479 CG PHE A 163 13.757 -12.557 11.804 1.00 14.63 C ATOM 480 CD1 PHE A 163 13.308 -11.631 10.928 1.00 12.78 C ATOM 481 CD2 PHE A 163 13.405 -12.397 13.135 1.00 14.12 C ATOM 482 CE1 PHE A 163 12.528 -10.557 11.348 1.00 13.90 C ATOM 483 CE2 PHE A 163 12.623 -11.315 13.558 1.00 14.19 C ATOM 484 CZ PHE A 163 12.175 -10.411 12.647 1.00 15.29 C ATOM 485 H PHE A 163 15.505 -12.610 9.069 1.00 0.00 H ATOM 486 N ASN A 164 17.464 -14.886 9.930 1.00 15.03 N ATOM 487 CA ASN A 164 18.416 -16.022 9.815 1.00 16.90 C ATOM 488 C ASN A 164 19.325 -15.934 8.621 1.00 15.97 C ATOM 489 O ASN A 164 19.021 -16.510 7.563 1.00 19.53 O ATOM 490 CB ASN A 164 17.639 -17.317 9.874 1.00 17.86 C ATOM 491 CG ASN A 164 18.582 -18.543 9.851 1.00 21.23 C ATOM 492 OD1 ASN A 164 19.782 -18.420 9.662 1.00 24.04 O ATOM 493 ND2 ASN A 164 18.012 -19.703 9.925 1.00 30.19 N ATOM 494 HD22 ASN A 164 16.987 -19.769 10.087 1.00 0.00 H ATOM 495 HD21 ASN A 164 18.579 -20.569 9.822 1.00 0.00 H ATOM 496 H ASN A 164 17.148 -14.410 9.061 1.00 0.00 H ATOM 497 N GLU A 165 20.312 -15.076 8.681 1.00 15.41 N ATOM 498 CA GLU A 165 21.391 -15.040 7.738 1.00 16.64 C ATOM 499 C GLU A 165 22.569 -15.791 8.327 1.00 18.63 C ATOM 500 O GLU A 165 23.290 -15.298 9.155 1.00 19.53 O ATOM 501 CB GLU A 165 21.795 -13.587 7.431 1.00 17.30 C ATOM 502 CG GLU A 165 22.665 -13.498 6.223 1.00 20.22 C ATOM 503 CD GLU A 165 23.281 -12.147 6.038 1.00 19.62 C ATOM 504 OE1 GLU A 165 23.952 -11.622 6.972 1.00 21.19 O ATOM 505 OE2 GLU A 165 23.054 -11.624 4.926 1.00 21.36 O ATOM 506 H GLU A 165 20.313 -14.382 9.456 1.00 0.00 H ATOM 507 N ASN A 166 22.787 -17.003 7.846 1.00 17.76 N ATOM 508 CA ASN A 166 23.839 -17.840 8.425 1.00 19.14 C ATOM 509 C ASN A 166 23.688 -17.931 9.999 1.00 15.05 C ATOM 510 O ASN A 166 24.716 -17.915 10.718 1.00 14.87 O ATOM 511 CB ASN A 166 25.261 -17.386 8.004 1.00 23.53 C ATOM 512 CG ASN A 166 25.434 -17.386 6.451 1.00 27.93 C ATOM 513 OD1 ASN A 166 25.042 -18.347 5.747 1.00 33.26 O ATOM 514 ND2 ASN A 166 25.977 -16.293 5.908 1.00 39.81 N ATOM 515 HD22 ASN A 166 26.293 -15.512 6.517 1.00 0.00 H ATOM 516 HD21 ASN A 166 26.084 -16.223 4.876 1.00 0.00 H ATOM 517 H ASN A 166 22.212 -17.361 7.057 1.00 0.00 H ATOM 518 N ASN A 167 22.430 -18.091 10.434 1.00 15.89 N ATOM 519 CA ASN A 167 22.074 -18.266 11.838 1.00 16.64 C ATOM 520 C ASN A 167 22.417 -17.081 12.673 1.00 17.25 C ATOM 521 O ASN A 167 22.572 -17.233 13.873 1.00 18.07 O ATOM 522 CB ASN A 167 22.728 -19.572 12.355 1.00 17.77 C ATOM 523 CG ASN A 167 22.270 -20.791 11.564 1.00 17.51 C ATOM 524 OD1 ASN A 167 23.088 -21.546 11.026 1.00 22.70 O ATOM 525 ND2 ASN A 167 21.034 -21.008 11.546 1.00 17.70 N ATOM 526 HD22 ASN A 167 20.383 -20.345 12.012 1.00 0.00 H ATOM 527 HD21 ASN A 167 20.661 -21.851 11.065 1.00 0.00 H ATOM 528 H ASN A 167 21.664 -18.090 9.730 1.00 0.00 H ATOM 529 N ARG A 168 22.419 -15.886 12.045 1.00 16.40 N ATOM 530 CA ARG A 168 22.600 -14.638 12.753 1.00 16.80 C ATOM 531 C ARG A 168 21.376 -13.763 12.361 1.00 17.20 C ATOM 532 O ARG A 168 20.792 -13.934 11.293 1.00 15.67 O ATOM 533 CB ARG A 168 23.876 -13.903 12.341 1.00 17.65 C ATOM 534 CG ARG A 168 25.110 -14.767 12.290 1.00 22.05 C ATOM 535 CD ARG A 168 25.769 -14.821 13.599 1.00 28.69 C ATOM 536 NE ARG A 168 26.893 -15.766 13.609 1.00 32.98 N ATOM 537 CZ ARG A 168 28.182 -15.499 13.366 1.00 32.75 C ATOM 538 NH1 ARG A 168 28.639 -14.298 13.020 1.00 32.39 N ATOM 539 NH2 ARG A 168 29.044 -16.512 13.476 1.00 37.67 N ATOM 540 HE ARG A 168 26.661 -16.755 13.830 1.00 0.00 H ATOM 541 HH12 ARG A 168 29.655 -14.159 12.845 1.00 0.00 H ATOM 542 HH11 ARG A 168 27.980 -13.499 12.924 1.00 0.00 H ATOM 543 HH22 ARG A 168 30.056 -16.355 13.297 1.00 0.00 H ATOM 544 HH21 ARG A 168 28.703 -17.458 13.741 1.00 0.00 H ATOM 545 H ARG A 168 22.285 -15.862 11.014 1.00 0.00 H ATOM 546 N ARG A 169 21.015 -12.845 13.258 1.00 16.16 N ATOM 547 CA ARG A 169 19.961 -11.802 12.989 1.00 13.04 C ATOM 548 C ARG A 169 20.697 -10.547 12.717 1.00 13.17 C ATOM 549 O ARG A 169 21.589 -10.194 13.438 1.00 13.19 O ATOM 550 CB ARG A 169 19.080 -11.670 14.199 1.00 13.34 C ATOM 551 CG ARG A 169 18.498 -13.015 14.585 1.00 15.65 C ATOM 552 CD ARG A 169 17.387 -13.012 15.593 1.00 20.59 C ATOM 553 NE ARG A 169 17.647 -12.184 16.790 1.00 20.15 N ATOM 554 CZ ARG A 169 16.710 -11.896 17.696 1.00 24.80 C ATOM 555 NH1 ARG A 169 15.445 -12.346 17.539 1.00 28.48 N ATOM 556 NH2 ARG A 169 17.016 -11.183 18.742 1.00 24.98 N ATOM 557 HE ARG A 169 18.606 -11.808 16.933 1.00 0.00 H ATOM 558 HH12 ARG A 169 14.720 -12.118 18.249 1.00 0.00 H ATOM 559 HH11 ARG A 169 15.197 -12.920 16.708 1.00 0.00 H ATOM 560 HH22 ARG A 169 16.287 -10.958 19.449 1.00 0.00 H ATOM 561 HH21 ARG A 169 17.989 -10.839 18.870 1.00 0.00 H ATOM 562 H ARG A 169 21.483 -12.849 14.187 1.00 0.00 H ATOM 563 N VAL A 170 20.375 -9.855 11.612 1.00 12.59 N ATOM 564 CA VAL A 170 21.108 -8.688 11.194 1.00 12.45 C ATOM 565 C VAL A 170 20.037 -7.762 10.519 1.00 13.18 C ATOM 566 O VAL A 170 19.116 -8.218 9.948 1.00 13.98 O ATOM 567 CB VAL A 170 22.257 -9.004 10.202 1.00 15.49 C ATOM 568 CG1 VAL A 170 21.748 -9.743 8.974 1.00 15.64 C ATOM 569 CG2 VAL A 170 23.137 -7.804 9.928 1.00 19.86 C ATOM 570 H VAL A 170 19.568 -10.173 11.038 1.00 0.00 H ATOM 571 N ILE A 171 20.330 -6.460 10.564 1.00 13.80 N ATOM 572 CA ILE A 171 19.558 -5.514 9.775 1.00 13.96 C ATOM 573 C ILE A 171 20.440 -4.982 8.654 1.00 12.13 C ATOM 574 O ILE A 171 21.585 -4.512 8.905 1.00 12.76 O ATOM 575 CB ILE A 171 19.050 -4.353 10.671 1.00 15.21 C ATOM 576 CG1 ILE A 171 18.072 -5.016 11.716 1.00 18.13 C ATOM 577 CG2 ILE A 171 18.389 -3.293 9.770 1.00 14.04 C ATOM 578 CD1 ILE A 171 17.399 -4.075 12.621 1.00 21.27 C ATOM 579 H ILE A 171 21.110 -6.123 11.163 1.00 0.00 H ATOM 580 N VAL A 172 19.974 -5.165 7.410 1.00 11.07 N ATOM 581 CA VAL A 172 20.717 -4.759 6.268 1.00 11.92 C ATOM 582 C VAL A 172 20.062 -3.495 5.694 1.00 12.52 C ATOM 583 O VAL A 172 18.840 -3.528 5.458 1.00 11.49 O ATOM 584 CB VAL A 172 20.807 -5.850 5.208 1.00 13.75 C ATOM 585 CG1 VAL A 172 21.466 -5.327 3.972 1.00 14.28 C ATOM 586 CG2 VAL A 172 21.495 -7.075 5.793 1.00 13.72 C ATOM 587 H VAL A 172 19.046 -5.615 7.277 1.00 0.00 H ATOM 588 N CYS A 173 20.832 -2.434 5.431 1.00 11.44 N ATOM 589 CA CYS A 173 20.294 -1.229 4.763 1.00 11.05 C ATOM 590 C CYS A 173 21.042 -0.947 3.509 1.00 11.55 C ATOM 591 O CYS A 173 22.276 -1.185 3.413 1.00 11.30 O ATOM 592 CB CYS A 173 20.393 -0.036 5.652 1.00 11.70 C ATOM 593 SG CYS A 173 19.343 -0.164 7.178 1.00 12.92 S ATOM 594 H CYS A 173 21.835 -2.457 5.703 1.00 0.00 H ATOM 595 N ASN A 174 20.399 -0.519 2.465 1.00 9.29 N ATOM 596 CA ASN A 174 21.011 -0.242 1.170 1.00 9.55 C ATOM 597 C ASN A 174 20.117 0.631 0.308 1.00 10.49 C ATOM 598 O ASN A 174 19.036 1.043 0.731 1.00 10.61 O ATOM 599 CB ASN A 174 21.376 -1.594 0.471 1.00 10.52 C ATOM 600 CG ASN A 174 22.565 -1.493 -0.478 1.00 10.77 C ATOM 601 OD1 ASN A 174 23.067 -0.445 -0.794 1.00 12.05 O ATOM 602 ND2 ASN A 174 23.015 -2.676 -0.876 1.00 12.34 N ATOM 603 HD22 ASN A 174 22.535 -3.546 -0.567 1.00 0.00 H ATOM 604 HD21 ASN A 174 23.847 -2.734 -1.497 1.00 0.00 H ATOM 605 H ASN A 174 19.375 -0.363 2.559 1.00 0.00 H ATOM 606 N THR A 175 20.643 0.969 -0.885 1.00 9.94 N ATOM 607 CA THR A 175 20.025 1.754 -1.918 1.00 9.23 C ATOM 608 C THR A 175 20.146 0.968 -3.209 1.00 10.80 C ATOM 609 O THR A 175 21.229 0.360 -3.476 1.00 12.15 O ATOM 610 CB THR A 175 20.763 3.108 -2.038 1.00 9.39 C ATOM 611 OG1 THR A 175 20.494 3.850 -0.837 1.00 9.90 O ATOM 612 CG2 THR A 175 20.356 3.970 -3.209 1.00 9.83 C ATOM 613 HG1 THR A 175 20.825 3.341 -0.055 1.00 0.00 H ATOM 614 H THR A 175 21.604 0.623 -1.081 1.00 0.00 H ATOM 615 N LYS A 176 19.103 1.043 -4.032 1.00 9.86 N ATOM 616 CA LYS A 176 19.117 0.383 -5.356 1.00 10.36 C ATOM 617 C LYS A 176 18.967 1.436 -6.408 1.00 11.30 C ATOM 618 O LYS A 176 17.971 2.152 -6.389 1.00 12.30 O ATOM 619 CB LYS A 176 18.059 -0.673 -5.413 1.00 11.67 C ATOM 620 CG LYS A 176 18.287 -1.607 -6.614 1.00 13.33 C ATOM 621 CD LYS A 176 17.284 -2.739 -6.666 1.00 16.93 C ATOM 622 CE LYS A 176 15.918 -2.232 -7.066 1.00 20.24 C ATOM 623 NZ LYS A 176 14.901 -3.377 -7.197 1.00 25.13 N ATOM 624 HZ1 LYS A 176 15.227 -4.047 -7.922 1.00 0.00 H ATOM 625 HZ2 LYS A 176 14.814 -3.868 -6.284 1.00 0.00 H ATOM 626 HZ3 LYS A 176 13.977 -2.988 -7.473 1.00 0.00 H ATOM 627 H LYS A 176 18.260 1.577 -3.738 1.00 0.00 H ATOM 628 N LEU A 177 19.968 1.566 -7.293 1.00 12.51 N ATOM 629 CA LEU A 177 19.996 2.576 -8.388 1.00 13.16 C ATOM 630 C LEU A 177 20.130 1.829 -9.711 1.00 13.54 C ATOM 631 O LEU A 177 21.008 0.968 -9.864 1.00 14.24 O ATOM 632 CB LEU A 177 21.151 3.498 -8.220 1.00 13.88 C ATOM 633 CG LEU A 177 21.229 4.264 -6.947 1.00 14.51 C ATOM 634 CD1 LEU A 177 22.488 5.077 -6.906 1.00 17.96 C ATOM 635 CD2 LEU A 177 20.007 5.134 -6.823 1.00 15.69 C ATOM 636 H LEU A 177 20.778 0.919 -7.209 1.00 0.00 H ATOM 637 N ASP A 178 19.219 2.141 -10.650 1.00 15.21 N ATOM 638 CA ASP A 178 19.209 1.483 -11.968 1.00 19.99 C ATOM 639 C ASP A 178 19.300 -0.078 -11.805 1.00 19.01 C ATOM 640 O ASP A 178 20.004 -0.770 -12.550 1.00 18.76 O ATOM 641 CB ASP A 178 20.315 2.037 -12.869 1.00 21.07 C ATOM 642 CG ASP A 178 20.146 3.493 -13.228 1.00 24.49 C ATOM 643 OD1 ASP A 178 18.987 3.991 -13.235 1.00 27.40 O ATOM 644 OD2 ASP A 178 21.123 4.174 -13.571 1.00 30.15 O ATOM 645 H ASP A 178 18.503 2.866 -10.440 1.00 0.00 H ATOM 646 N ASN A 179 18.536 -0.663 -10.858 1.00 17.22 N ATOM 647 CA ASN A 179 18.498 -2.094 -10.585 1.00 19.82 C ATOM 648 C ASN A 179 19.734 -2.709 -9.910 1.00 20.50 C ATOM 649 O ASN A 179 19.779 -3.884 -9.728 1.00 26.96 O ATOM 650 CB ASN A 179 18.075 -2.879 -11.851 1.00 21.17 C ATOM 651 CG ASN A 179 16.679 -3.462 -11.746 1.00 24.60 C ATOM 652 OD1 ASN A 179 15.776 -2.938 -11.026 1.00 24.64 O ATOM 653 ND2 ASN A 179 16.445 -4.549 -12.502 1.00 22.86 N ATOM 654 HD22 ASN A 179 17.208 -4.954 -13.081 1.00 0.00 H ATOM 655 HD21 ASN A 179 15.501 -4.985 -12.508 1.00 0.00 H ATOM 656 H ASN A 179 17.929 -0.047 -10.280 1.00 0.00 H ATOM 657 N ASN A 180 20.678 -1.886 -9.489 1.00 17.22 N ATOM 658 CA ASN A 180 21.916 -2.323 -8.819 1.00 18.41 C ATOM 659 C ASN A 180 21.925 -1.900 -7.346 1.00 16.67 C ATOM 660 O ASN A 180 21.877 -0.717 -7.023 1.00 16.97 O ATOM 661 CB ASN A 180 23.140 -1.673 -9.421 1.00 22.82 C ATOM 662 CG ASN A 180 23.284 -1.940 -10.902 1.00 29.22 C ATOM 663 OD1 ASN A 180 23.556 -1.026 -11.696 1.00 36.82 O ATOM 664 ND2 ASN A 180 23.035 -3.151 -11.282 1.00 29.03 N ATOM 665 HD22 ASN A 180 22.812 -3.882 -10.577 1.00 0.00 H ATOM 666 HD21 ASN A 180 23.058 -3.394 -12.293 1.00 0.00 H ATOM 667 H ASN A 180 20.539 -0.866 -9.640 1.00 0.00 H ATOM 668 N TRP A 181 22.131 -2.906 -6.491 1.00 16.46 N ATOM 669 CA TRP A 181 22.380 -2.646 -5.077 1.00 15.16 C ATOM 670 C TRP A 181 23.741 -2.079 -4.838 1.00 18.55 C ATOM 671 O TRP A 181 24.740 -2.473 -5.487 1.00 16.81 O ATOM 672 CB TRP A 181 22.163 -3.897 -4.233 1.00 15.99 C ATOM 673 CG TRP A 181 20.760 -4.344 -4.178 1.00 12.49 C ATOM 674 CD1 TRP A 181 20.209 -5.395 -4.806 1.00 15.06 C ATOM 675 CD2 TRP A 181 19.643 -3.683 -3.454 1.00 12.08 C ATOM 676 NE1 TRP A 181 18.853 -5.462 -4.512 1.00 14.45 N ATOM 677 CE2 TRP A 181 18.492 -4.401 -3.693 1.00 12.79 C ATOM 678 CE3 TRP A 181 19.572 -2.568 -2.596 1.00 13.19 C ATOM 679 CZ2 TRP A 181 17.256 -4.042 -3.117 1.00 13.47 C ATOM 680 CZ3 TRP A 181 18.354 -2.191 -2.076 1.00 12.20 C ATOM 681 CH2 TRP A 181 17.216 -2.895 -2.316 1.00 13.01 C ATOM 682 HE1 TRP A 181 18.204 -6.199 -4.855 1.00 0.00 H ATOM 683 H TRP A 181 22.114 -3.886 -6.838 1.00 0.00 H ATOM 684 N GLY A 182 23.832 -1.109 -3.944 1.00 15.15 N ATOM 685 CA GLY A 182 25.099 -0.513 -3.560 1.00 16.47 C ATOM 686 C GLY A 182 25.748 -1.164 -2.381 1.00 12.28 C ATOM 687 O GLY A 182 25.554 -2.331 -2.136 1.00 17.14 O ATOM 688 H GLY A 182 22.960 -0.759 -3.498 1.00 0.00 H ATOM 689 N ARG A 183 26.471 -0.332 -1.676 1.00 16.91 N ATOM 690 CA ARG A 183 27.237 -0.819 -0.462 1.00 19.28 C ATOM 691 C ARG A 183 26.286 -1.003 0.686 1.00 16.43 C ATOM 692 O ARG A 183 25.585 -0.070 1.069 1.00 17.79 O ATOM 693 CB ARG A 183 28.311 0.166 -0.036 1.00 23.66 C ATOM 694 CG ARG A 183 29.058 -0.107 1.261 1.00 32.40 C ATOM 695 CD ARG A 183 30.055 1.044 1.590 1.00 42.59 C ATOM 696 NE ARG A 183 29.411 2.380 1.497 1.00 46.23 N ATOM 697 CZ ARG A 183 28.646 2.961 2.448 1.00 55.00 C ATOM 698 NH1 ARG A 183 28.404 2.361 3.621 1.00 58.64 N ATOM 699 NH2 ARG A 183 28.091 4.156 2.224 1.00 54.48 N ATOM 700 HE ARG A 183 29.563 2.917 0.620 1.00 0.00 H ATOM 701 HH12 ARG A 183 27.811 2.833 4.334 1.00 0.00 H ATOM 702 HH11 ARG A 183 28.809 1.424 3.819 1.00 0.00 H ATOM 703 HH22 ARG A 183 27.503 4.602 2.957 1.00 0.00 H ATOM 704 HH21 ARG A 183 28.247 4.640 1.317 1.00 0.00 H ATOM 705 H ARG A 183 26.520 0.670 -1.950 1.00 0.00 H ATOM 706 N GLU A 184 26.244 -2.185 1.257 1.00 15.34 N ATOM 707 CA GLU A 184 25.330 -2.468 2.375 1.00 15.09 C ATOM 708 C GLU A 184 25.844 -1.841 3.648 1.00 15.39 C ATOM 709 O GLU A 184 27.108 -1.731 3.853 1.00 17.10 O ATOM 710 CB GLU A 184 25.161 -3.934 2.660 1.00 15.51 C ATOM 711 CG GLU A 184 24.515 -4.723 1.554 1.00 16.68 C ATOM 712 CD GLU A 184 24.277 -6.227 1.768 1.00 17.08 C ATOM 713 OE1 GLU A 184 24.924 -6.818 2.666 1.00 20.73 O ATOM 714 OE2 GLU A 184 23.444 -6.801 1.047 1.00 18.06 O ATOM 715 H GLU A 184 26.871 -2.939 0.911 1.00 0.00 H ATOM 716 N GLU A 185 24.907 -1.315 4.444 1.00 13.06 N ATOM 717 CA GLU A 185 25.196 -0.862 5.826 1.00 13.34 C ATOM 718 C GLU A 185 24.543 -1.836 6.772 1.00 13.93 C ATOM 719 O GLU A 185 23.332 -2.065 6.726 1.00 14.67 O ATOM 720 CB GLU A 185 24.752 0.540 6.060 1.00 14.35 C ATOM 721 CG GLU A 185 25.455 1.533 5.166 1.00 15.91 C ATOM 722 CD GLU A 185 25.087 2.986 5.377 1.00 17.45 C ATOM 723 OE1 GLU A 185 24.660 3.438 6.473 1.00 19.35 O ATOM 724 OE2 GLU A 185 25.245 3.734 4.376 1.00 18.77 O ATOM 725 H GLU A 185 23.938 -1.220 4.079 1.00 0.00 H ATOM 726 N ARG A 186 25.323 -2.528 7.635 1.00 12.72 N ATOM 727 CA ARG A 186 24.819 -3.589 8.454 1.00 13.78 C ATOM 728 C ARG A 186 24.858 -3.200 9.953 1.00 18.52 C ATOM 729 O ARG A 186 25.753 -2.531 10.377 1.00 21.61 O ATOM 730 CB ARG A 186 25.629 -4.879 8.231 1.00 16.04 C ATOM 731 CG ARG A 186 25.236 -5.540 6.924 1.00 15.54 C ATOM 732 CD ARG A 186 26.218 -6.576 6.389 1.00 15.17 C ATOM 733 NE ARG A 186 25.542 -7.350 5.321 1.00 16.56 N ATOM 734 CZ ARG A 186 24.928 -8.502 5.472 1.00 14.32 C ATOM 735 NH1 ARG A 186 24.976 -9.216 6.619 1.00 16.98 N ATOM 736 NH2 ARG A 186 24.337 -9.059 4.459 1.00 15.68 N ATOM 737 HE ARG A 186 25.555 -6.944 4.364 1.00 0.00 H ATOM 738 HH12 ARG A 186 24.472 -10.123 6.688 1.00 0.00 H ATOM 739 HH11 ARG A 186 25.517 -8.858 7.432 1.00 0.00 H ATOM 740 HH22 ARG A 186 23.851 -9.971 4.577 1.00 0.00 H ATOM 741 HH21 ARG A 186 24.350 -8.593 3.529 1.00 0.00 H ATOM 742 H ARG A 186 26.330 -2.279 7.706 1.00 0.00 H ATOM 743 N GLN A 187 23.826 -3.610 10.666 1.00 18.72 N ATOM 744 CA GLN A 187 23.668 -3.321 12.093 1.00 21.18 C ATOM 745 C GLN A 187 23.299 -4.702 12.714 1.00 18.48 C ATOM 746 O GLN A 187 22.266 -5.320 12.395 1.00 20.01 O ATOM 747 CB GLN A 187 22.587 -2.226 12.276 1.00 22.31 C ATOM 748 CG GLN A 187 21.896 -2.035 13.599 1.00 23.97 C ATOM 749 CD GLN A 187 22.870 -1.560 14.622 1.00 25.71 C ATOM 750 OE1 GLN A 187 23.793 -2.264 15.022 1.00 29.13 O ATOM 751 NE2 GLN A 187 22.682 -0.342 15.057 1.00 33.64 N ATOM 752 HE22 GLN A 187 21.888 0.223 14.694 1.00 0.00 H ATOM 753 HE21 GLN A 187 23.326 0.062 15.766 1.00 0.00 H ATOM 754 H GLN A 187 23.087 -4.167 10.190 1.00 0.00 H ATOM 755 N SER A 188 24.073 -5.092 13.744 1.00 20.21 N ATOM 756 CA SER A 188 23.753 -6.287 14.472 1.00 19.82 C ATOM 757 C SER A 188 22.836 -6.036 15.732 1.00 16.38 C ATOM 758 O SER A 188 22.291 -6.972 16.237 1.00 18.26 O ATOM 759 CB SER A 188 25.000 -6.909 15.015 1.00 22.45 C ATOM 760 OG SER A 188 25.645 -5.929 15.888 1.00 27.89 O ATOM 761 HG SER A 188 26.476 -6.318 16.261 1.00 0.00 H ATOM 762 H SER A 188 24.904 -4.527 14.013 1.00 0.00 H ATOM 763 N VAL A 189 22.602 -4.804 16.136 1.00 17.17 N ATOM 764 CA VAL A 189 21.534 -4.561 17.089 1.00 15.81 C ATOM 765 C VAL A 189 20.206 -4.877 16.417 1.00 14.94 C ATOM 766 O VAL A 189 19.906 -4.357 15.324 1.00 15.45 O ATOM 767 CB VAL A 189 21.578 -3.125 17.662 1.00 17.71 C ATOM 768 CG1 VAL A 189 20.366 -2.785 18.538 1.00 20.13 C ATOM 769 CG2 VAL A 189 22.889 -2.892 18.441 1.00 20.19 C ATOM 770 H VAL A 189 23.176 -4.015 15.776 1.00 0.00 H ATOM 771 N PHE A 190 19.476 -5.785 17.048 1.00 14.02 N ATOM 772 CA PHE A 190 18.323 -6.412 16.395 1.00 13.93 C ATOM 773 C PHE A 190 17.179 -6.415 17.351 1.00 14.41 C ATOM 774 O PHE A 190 17.004 -7.346 18.152 1.00 17.55 O ATOM 775 CB PHE A 190 18.635 -7.819 15.977 1.00 12.83 C ATOM 776 CG PHE A 190 17.660 -8.363 14.998 1.00 10.76 C ATOM 777 CD1 PHE A 190 17.853 -8.178 13.616 1.00 10.97 C ATOM 778 CD2 PHE A 190 16.547 -9.042 15.378 1.00 11.21 C ATOM 779 CE1 PHE A 190 16.953 -8.742 12.692 1.00 11.10 C ATOM 780 CE2 PHE A 190 15.657 -9.622 14.497 1.00 12.57 C ATOM 781 CZ PHE A 190 15.838 -9.441 13.149 1.00 11.89 C ATOM 782 H PHE A 190 19.725 -6.057 18.021 1.00 0.00 H ATOM 783 N PRO A 191 16.291 -5.391 17.287 1.00 13.37 N ATOM 784 CA PRO A 191 15.276 -5.267 18.308 1.00 14.51 C ATOM 785 C PRO A 191 13.988 -6.074 18.127 1.00 15.46 C ATOM 786 O PRO A 191 13.128 -6.133 19.059 1.00 22.01 O ATOM 787 CB PRO A 191 14.923 -3.719 18.282 1.00 15.19 C ATOM 788 CG PRO A 191 15.261 -3.324 16.912 1.00 15.66 C ATOM 789 CD PRO A 191 16.495 -4.129 16.558 1.00 15.26 C ATOM 790 N PHE A 192 13.834 -6.687 16.979 1.00 12.13 N ATOM 791 CA PHE A 192 12.637 -7.428 16.586 1.00 12.66 C ATOM 792 C PHE A 192 12.703 -8.797 17.137 1.00 13.11 C ATOM 793 O PHE A 192 13.783 -9.365 17.349 1.00 14.77 O ATOM 794 CB PHE A 192 12.459 -7.507 15.070 1.00 13.48 C ATOM 795 CG PHE A 192 12.403 -6.179 14.402 1.00 13.08 C ATOM 796 CD1 PHE A 192 11.211 -5.450 14.379 1.00 12.68 C ATOM 797 CD2 PHE A 192 13.553 -5.557 13.853 1.00 12.34 C ATOM 798 CE1 PHE A 192 11.141 -4.213 13.723 1.00 10.95 C ATOM 799 CE2 PHE A 192 13.489 -4.334 13.274 1.00 11.69 C ATOM 800 CZ PHE A 192 12.301 -3.621 13.210 1.00 11.26 C ATOM 801 H PHE A 192 14.620 -6.643 16.299 1.00 0.00 H ATOM 802 N GLU A 193 11.541 -9.353 17.428 1.00 13.96 N ATOM 803 CA GLU A 193 11.423 -10.759 17.856 1.00 14.53 C ATOM 804 C GLU A 193 10.191 -11.388 17.222 1.00 14.67 C ATOM 805 O GLU A 193 9.100 -10.786 17.165 1.00 13.68 O ATOM 806 CB GLU A 193 11.283 -10.838 19.398 1.00 16.76 C ATOM 807 CG GLU A 193 12.467 -10.409 20.248 1.00 20.30 C ATOM 808 CD GLU A 193 13.616 -11.452 20.302 1.00 24.71 C ATOM 809 OE1 GLU A 193 13.416 -12.651 19.854 1.00 27.92 O ATOM 810 OE2 GLU A 193 14.731 -11.065 20.759 1.00 26.85 O ATOM 811 H GLU A 193 10.678 -8.778 17.353 1.00 0.00 H ATOM 812 N SER A 194 10.332 -12.601 16.743 1.00 14.29 N ATOM 813 CA SER A 194 9.262 -13.348 16.165 1.00 14.99 C ATOM 814 C SER A 194 8.077 -13.429 17.152 1.00 16.07 C ATOM 815 O SER A 194 8.254 -13.716 18.349 1.00 17.57 O ATOM 816 CB SER A 194 9.718 -14.741 15.717 1.00 15.65 C ATOM 817 OG SER A 194 10.320 -14.777 14.429 1.00 14.11 O ATOM 818 HG SER A 194 10.585 -15.707 14.216 1.00 0.00 H ATOM 819 H SER A 194 11.273 -13.042 16.787 1.00 0.00 H ATOM 820 N GLY A 195 6.906 -13.153 16.644 1.00 13.18 N ATOM 821 CA GLY A 195 5.680 -13.148 17.378 1.00 13.09 C ATOM 822 C GLY A 195 5.333 -11.886 18.062 1.00 13.96 C ATOM 823 O GLY A 195 4.253 -11.820 18.638 1.00 14.93 O ATOM 824 H GLY A 195 6.863 -12.920 15.631 1.00 0.00 H ATOM 825 N LYS A 196 6.222 -10.866 18.071 1.00 10.33 N ATOM 826 CA LYS A 196 5.969 -9.757 18.970 1.00 10.68 C ATOM 827 C LYS A 196 5.618 -8.425 18.225 1.00 10.88 C ATOM 828 O LYS A 196 6.033 -8.212 17.103 1.00 11.13 O ATOM 829 CB LYS A 196 7.112 -9.434 19.885 1.00 12.67 C ATOM 830 CG LYS A 196 7.616 -10.557 20.788 1.00 12.03 C ATOM 831 CD LYS A 196 8.477 -10.019 21.929 1.00 14.26 C ATOM 832 CE LYS A 196 9.227 -11.119 22.643 1.00 15.52 C ATOM 833 NZ LYS A 196 9.909 -10.585 23.823 1.00 17.65 N ATOM 834 HZ1 LYS A 196 10.583 -9.849 23.529 1.00 0.00 H ATOM 835 HZ2 LYS A 196 9.207 -10.175 24.472 1.00 0.00 H ATOM 836 HZ3 LYS A 196 10.420 -11.353 24.303 1.00 0.00 H ATOM 837 H LYS A 196 7.059 -10.877 17.454 1.00 0.00 H ATOM 838 N PRO A 197 4.751 -7.640 18.839 1.00 10.59 N ATOM 839 CA PRO A 197 4.372 -6.330 18.236 1.00 11.24 C ATOM 840 C PRO A 197 5.542 -5.356 18.273 1.00 10.28 C ATOM 841 O PRO A 197 6.332 -5.314 19.229 1.00 10.46 O ATOM 842 CB PRO A 197 3.274 -5.811 19.156 1.00 12.79 C ATOM 843 CG PRO A 197 3.421 -6.612 20.379 1.00 13.62 C ATOM 844 CD PRO A 197 4.105 -7.864 20.147 1.00 11.67 C ATOM 845 N PHE A 198 5.615 -4.538 17.228 1.00 10.56 N ATOM 846 CA PHE A 198 6.695 -3.580 17.110 1.00 10.19 C ATOM 847 C PHE A 198 6.111 -2.221 16.626 1.00 9.33 C ATOM 848 O PHE A 198 5.036 -2.145 16.001 1.00 9.33 O ATOM 849 CB PHE A 198 7.760 -4.024 16.092 1.00 9.90 C ATOM 850 CG PHE A 198 7.269 -4.213 14.718 1.00 11.17 C ATOM 851 CD1 PHE A 198 7.196 -3.131 13.849 1.00 11.57 C ATOM 852 CD2 PHE A 198 6.834 -5.445 14.252 1.00 14.37 C ATOM 853 CE1 PHE A 198 6.665 -3.250 12.596 1.00 13.41 C ATOM 854 CE2 PHE A 198 6.344 -5.588 12.929 1.00 14.86 C ATOM 855 CZ PHE A 198 6.239 -4.504 12.118 1.00 13.64 C ATOM 856 H PHE A 198 4.888 -4.586 16.486 1.00 0.00 H ATOM 857 N LYS A 199 6.937 -1.234 16.789 1.00 9.60 N ATOM 858 CA LYS A 199 6.697 0.112 16.193 1.00 11.46 C ATOM 859 C LYS A 199 8.041 0.525 15.582 1.00 10.59 C ATOM 860 O LYS A 199 9.082 0.508 16.233 1.00 11.06 O ATOM 861 CB LYS A 199 6.317 1.105 17.246 1.00 12.25 C ATOM 862 CG LYS A 199 6.125 2.516 16.704 1.00 12.85 C ATOM 863 CD LYS A 199 5.519 3.429 17.786 1.00 14.09 C ATOM 864 CE LYS A 199 6.551 3.775 18.829 1.00 16.02 C ATOM 865 NZ LYS A 199 6.008 4.684 19.874 1.00 19.19 N ATOM 866 HZ1 LYS A 199 5.687 5.568 19.430 1.00 0.00 H ATOM 867 HZ2 LYS A 199 5.207 4.223 20.351 1.00 0.00 H ATOM 868 HZ3 LYS A 199 6.752 4.895 20.569 1.00 0.00 H ATOM 869 H LYS A 199 7.796 -1.387 17.355 1.00 0.00 H ATOM 870 N ILE A 200 7.991 0.850 14.257 1.00 9.07 N ATOM 871 CA ILE A 200 9.129 1.403 13.612 1.00 9.32 C ATOM 872 C ILE A 200 8.815 2.865 13.328 1.00 9.53 C ATOM 873 O ILE A 200 7.740 3.155 12.744 1.00 11.21 O ATOM 874 CB ILE A 200 9.479 0.708 12.293 1.00 10.86 C ATOM 875 CG1 ILE A 200 9.744 -0.790 12.459 1.00 11.95 C ATOM 876 CG2 ILE A 200 10.620 1.412 11.614 1.00 11.01 C ATOM 877 CD1 ILE A 200 9.771 -1.639 11.203 1.00 13.33 C ATOM 878 H ILE A 200 7.116 0.692 13.718 1.00 0.00 H ATOM 879 N GLN A 201 9.680 3.792 13.719 1.00 9.20 N ATOM 880 CA GLN A 201 9.504 5.197 13.382 1.00 11.45 C ATOM 881 C GLN A 201 10.730 5.597 12.533 1.00 9.96 C ATOM 882 O GLN A 201 11.883 5.308 12.865 1.00 12.39 O ATOM 883 CB GLN A 201 9.443 6.063 14.614 1.00 13.99 C ATOM 884 CG GLN A 201 8.200 5.864 15.432 1.00 16.41 C ATOM 885 CD GLN A 201 8.332 6.432 16.798 1.00 19.32 C ATOM 886 OE1 GLN A 201 9.300 6.164 17.578 1.00 22.84 O ATOM 887 NE2 GLN A 201 7.416 7.328 17.070 1.00 25.19 N ATOM 888 HE22 GLN A 201 6.646 7.506 16.394 1.00 0.00 H ATOM 889 HE21 GLN A 201 7.459 7.861 17.962 1.00 0.00 H ATOM 890 H GLN A 201 10.507 3.507 14.282 1.00 0.00 H ATOM 891 N VAL A 202 10.440 6.199 11.390 1.00 9.32 N ATOM 892 CA VAL A 202 11.517 6.685 10.560 1.00 8.66 C ATOM 893 C VAL A 202 11.323 8.212 10.387 1.00 8.43 C ATOM 894 O VAL A 202 10.252 8.663 9.938 1.00 10.05 O ATOM 895 CB VAL A 202 11.446 6.097 9.142 1.00 8.77 C ATOM 896 CG1 VAL A 202 12.535 6.545 8.271 1.00 10.03 C ATOM 897 CG2 VAL A 202 11.388 4.577 9.076 1.00 9.31 C ATOM 898 H VAL A 202 9.450 6.320 11.094 1.00 0.00 H ATOM 899 N LEU A 203 12.298 8.919 10.910 1.00 9.24 N ATOM 900 CA LEU A 203 12.238 10.402 10.912 1.00 10.85 C ATOM 901 C LEU A 203 13.202 10.866 9.856 1.00 12.09 C ATOM 902 O LEU A 203 14.348 10.508 9.818 1.00 11.67 O ATOM 903 CB LEU A 203 12.619 10.956 12.282 1.00 13.04 C ATOM 904 CG LEU A 203 12.579 12.495 12.366 1.00 15.20 C ATOM 905 CD1 LEU A 203 11.306 13.131 11.914 1.00 16.25 C ATOM 906 CD2 LEU A 203 12.947 12.886 13.805 1.00 17.09 C ATOM 907 H LEU A 203 13.119 8.436 11.326 1.00 0.00 H ATOM 908 N VAL A 204 12.681 11.678 8.916 1.00 10.66 N ATOM 909 CA VAL A 204 13.576 12.231 7.920 1.00 12.56 C ATOM 910 C VAL A 204 14.274 13.465 8.499 1.00 12.16 C ATOM 911 O VAL A 204 13.642 14.375 8.944 1.00 12.66 O ATOM 912 CB VAL A 204 12.781 12.594 6.684 1.00 13.51 C ATOM 913 CG1 VAL A 204 13.695 13.119 5.566 1.00 12.74 C ATOM 914 CG2 VAL A 204 12.009 11.367 6.167 1.00 14.92 C ATOM 915 H VAL A 204 11.665 11.902 8.906 1.00 0.00 H ATOM 916 N GLU A 205 15.578 13.416 8.483 1.00 11.60 N ATOM 917 CA GLU A 205 16.391 14.560 8.912 1.00 12.90 C ATOM 918 C GLU A 205 17.153 15.097 7.676 1.00 14.04 C ATOM 919 O GLU A 205 17.137 14.520 6.576 1.00 14.33 O ATOM 920 CB GLU A 205 17.305 14.135 10.078 1.00 14.22 C ATOM 921 CG GLU A 205 16.499 13.776 11.312 1.00 14.77 C ATOM 922 CD GLU A 205 17.354 13.560 12.569 1.00 16.76 C ATOM 923 OE1 GLU A 205 18.490 13.169 12.474 1.00 19.54 O ATOM 924 OE2 GLU A 205 16.889 13.780 13.684 1.00 16.22 O ATOM 925 H GLU A 205 16.051 12.548 8.159 1.00 0.00 H ATOM 926 N PRO A 206 17.806 16.224 7.810 1.00 15.40 N ATOM 927 CA PRO A 206 18.468 16.773 6.639 1.00 14.89 C ATOM 928 C PRO A 206 19.518 15.894 5.950 1.00 14.84 C ATOM 929 O PRO A 206 19.562 15.905 4.655 1.00 16.20 O ATOM 930 CB PRO A 206 19.091 18.087 7.190 1.00 15.55 C ATOM 931 CG PRO A 206 18.086 18.487 8.261 1.00 16.73 C ATOM 932 CD PRO A 206 17.782 17.183 8.965 1.00 15.26 C ATOM 933 N ASP A 207 20.239 15.109 6.698 1.00 14.46 N ATOM 934 CA ASP A 207 21.343 14.346 6.130 1.00 13.85 C ATOM 935 C ASP A 207 21.118 12.839 6.106 1.00 11.25 C ATOM 936 O ASP A 207 21.932 12.109 5.542 1.00 12.05 O ATOM 937 CB ASP A 207 22.674 14.673 6.774 1.00 19.46 C ATOM 938 CG ASP A 207 23.305 15.971 6.213 1.00 24.73 C ATOM 939 OD1 ASP A 207 22.790 16.535 5.148 1.00 25.66 O ATOM 940 OD2 ASP A 207 24.306 16.396 6.974 1.00 29.68 O ATOM 941 H ASP A 207 20.025 15.026 7.712 1.00 0.00 H ATOM 942 N HIS A 208 20.049 12.436 6.820 1.00 11.35 N ATOM 943 CA HIS A 208 19.819 10.994 6.999 1.00 11.88 C ATOM 944 C HIS A 208 18.386 10.688 7.343 1.00 10.31 C ATOM 945 O HIS A 208 17.580 11.516 7.794 1.00 10.10 O ATOM 946 CB HIS A 208 20.727 10.378 8.051 1.00 14.84 C ATOM 947 CG HIS A 208 20.805 11.135 9.323 1.00 18.59 C ATOM 948 ND1 HIS A 208 19.885 11.038 10.350 1.00 21.65 N ATOM 949 CD2 HIS A 208 21.756 12.021 9.744 1.00 19.85 C ATOM 950 CE1 HIS A 208 20.235 11.860 11.338 1.00 22.61 C ATOM 951 NE2 HIS A 208 21.359 12.465 10.986 1.00 24.65 N ATOM 952 H HIS A 208 19.398 13.132 7.237 1.00 0.00 H ATOM 953 N PHE A 209 18.045 9.416 7.111 1.00 10.05 N ATOM 954 CA PHE A 209 16.883 8.842 7.791 1.00 10.19 C ATOM 955 C PHE A 209 17.302 8.384 9.176 1.00 9.73 C ATOM 956 O PHE A 209 18.307 7.708 9.299 1.00 11.90 O ATOM 957 CB PHE A 209 16.373 7.624 7.026 1.00 11.73 C ATOM 958 CG PHE A 209 15.849 7.919 5.660 1.00 10.71 C ATOM 959 CD1 PHE A 209 14.528 8.344 5.472 1.00 11.92 C ATOM 960 CD2 PHE A 209 16.687 7.733 4.545 1.00 10.60 C ATOM 961 CE1 PHE A 209 14.043 8.564 4.166 1.00 12.49 C ATOM 962 CE2 PHE A 209 16.204 8.028 3.308 1.00 10.75 C ATOM 963 CZ PHE A 209 14.957 8.421 3.126 1.00 11.49 C ATOM 964 H PHE A 209 18.603 8.838 6.451 1.00 0.00 H ATOM 965 N LYS A 210 16.453 8.631 10.180 1.00 10.20 N ATOM 966 CA LYS A 210 16.735 8.201 11.529 1.00 12.13 C ATOM 967 C LYS A 210 15.679 7.164 11.890 1.00 11.54 C ATOM 968 O LYS A 210 14.519 7.498 11.849 1.00 12.22 O ATOM 969 CB LYS A 210 16.715 9.391 12.466 1.00 14.53 C ATOM 970 CG LYS A 210 17.300 9.061 13.845 1.00 18.23 C ATOM 971 CD LYS A 210 17.376 10.327 14.720 1.00 19.77 C ATOM 972 CE LYS A 210 16.011 10.907 14.983 1.00 23.50 C ATOM 973 NZ LYS A 210 15.094 10.020 15.655 1.00 31.10 N ATOM 974 HZ1 LYS A 210 14.951 9.168 15.076 1.00 0.00 H ATOM 975 HZ2 LYS A 210 15.488 9.751 16.579 1.00 0.00 H ATOM 976 HZ3 LYS A 210 14.184 10.504 15.793 1.00 0.00 H ATOM 977 H LYS A 210 15.570 9.144 9.984 1.00 0.00 H ATOM 978 N VAL A 211 16.098 6.008 12.327 1.00 9.60 N ATOM 979 CA VAL A 211 15.179 4.907 12.641 1.00 9.37 C ATOM 980 C VAL A 211 15.217 4.585 14.120 1.00 9.28 C ATOM 981 O VAL A 211 16.279 4.308 14.660 1.00 10.53 O ATOM 982 CB VAL A 211 15.478 3.645 11.813 1.00 10.40 C ATOM 983 CG1 VAL A 211 14.446 2.559 12.039 1.00 11.20 C ATOM 984 CG2 VAL A 211 15.542 3.949 10.320 1.00 11.60 C ATOM 985 H VAL A 211 17.119 5.861 12.457 1.00 0.00 H ATOM 986 N ALA A 212 14.018 4.563 14.695 1.00 9.52 N ATOM 987 CA ALA A 212 13.836 4.020 16.055 1.00 8.44 C ATOM 988 C ALA A 212 12.879 2.866 16.038 1.00 9.27 C ATOM 989 O ALA A 212 11.858 2.928 15.350 1.00 9.59 O ATOM 990 CB ALA A 212 13.333 5.140 16.996 1.00 10.31 C ATOM 991 H ALA A 212 13.196 4.934 14.178 1.00 0.00 H ATOM 992 N VAL A 213 13.101 1.857 16.863 1.00 8.97 N ATOM 993 CA VAL A 213 12.183 0.755 17.024 1.00 9.38 C ATOM 994 C VAL A 213 11.768 0.647 18.492 1.00 9.44 C ATOM 995 O VAL A 213 12.614 0.690 19.415 1.00 10.38 O ATOM 996 CB VAL A 213 12.811 -0.533 16.509 1.00 11.01 C ATOM 997 CG1 VAL A 213 11.860 -1.734 16.669 1.00 11.13 C ATOM 998 CG2 VAL A 213 13.147 -0.421 15.023 1.00 10.35 C ATOM 999 H VAL A 213 13.978 1.857 17.422 1.00 0.00 H ATOM 1000 N ASN A 214 10.484 0.610 18.711 1.00 10.26 N ATOM 1001 CA ASN A 214 9.945 0.515 20.124 1.00 10.32 C ATOM 1002 C ASN A 214 10.511 1.582 20.959 1.00 12.45 C ATOM 1003 O ASN A 214 10.897 1.337 22.132 1.00 13.55 O ATOM 1004 CB ASN A 214 10.161 -0.876 20.718 1.00 10.06 C ATOM 1005 CG ASN A 214 9.532 -1.986 19.836 1.00 9.41 C ATOM 1006 OD1 ASN A 214 8.676 -1.755 18.983 1.00 10.61 O ATOM 1007 ND2 ASN A 214 10.050 -3.196 19.993 1.00 11.66 N ATOM 1008 HD22 ASN A 214 10.772 -3.362 20.723 1.00 0.00 H ATOM 1009 HD21 ASN A 214 9.734 -3.980 19.387 1.00 0.00 H ATOM 1010 H ASN A 214 9.823 0.646 17.909 1.00 0.00 H ATOM 1011 N ASP A 215 10.550 2.790 20.373 1.00 13.30 N ATOM 1012 CA ASP A 215 10.967 4.066 21.030 1.00 16.11 C ATOM 1013 C ASP A 215 12.427 4.165 21.342 1.00 14.59 C ATOM 1014 O ASP A 215 12.887 5.166 21.919 1.00 18.07 O ATOM 1015 CB ASP A 215 10.166 4.347 22.311 1.00 16.32 C ATOM 1016 CG ASP A 215 8.803 4.687 22.035 1.00 22.40 C ATOM 1017 OD1 ASP A 215 8.562 5.498 21.086 1.00 23.26 O ATOM 1018 OD2 ASP A 215 7.910 4.091 22.702 1.00 28.96 O ATOM 1019 H ASP A 215 10.265 2.842 19.374 1.00 0.00 H ATOM 1020 N ALA A 216 13.231 3.195 20.874 1.00 11.77 N ATOM 1021 CA ALA A 216 14.631 3.192 21.052 1.00 12.49 C ATOM 1022 C ALA A 216 15.331 3.450 19.719 1.00 12.09 C ATOM 1023 O ALA A 216 15.180 2.687 18.751 1.00 12.40 O ATOM 1024 CB ALA A 216 15.226 1.935 21.674 1.00 13.52 C ATOM 1025 H ALA A 216 12.799 2.405 20.353 1.00 0.00 H ATOM 1026 N HIS A 217 16.270 4.391 19.720 1.00 13.15 N ATOM 1027 CA HIS A 217 17.069 4.660 18.522 1.00 14.12 C ATOM 1028 C HIS A 217 17.772 3.456 18.058 1.00 12.00 C ATOM 1029 O HIS A 217 18.428 2.740 18.837 1.00 14.80 O ATOM 1030 CB HIS A 217 18.094 5.794 18.766 1.00 13.06 C ATOM 1031 CG HIS A 217 19.012 6.019 17.600 1.00 14.47 C ATOM 1032 ND1 HIS A 217 18.538 6.535 16.419 1.00 17.09 N ATOM 1033 CD2 HIS A 217 20.307 5.683 17.370 1.00 17.52 C ATOM 1034 CE1 HIS A 217 19.525 6.591 15.529 1.00 17.12 C ATOM 1035 NE2 HIS A 217 20.603 6.061 16.068 1.00 19.54 N ATOM 1036 H HIS A 217 16.440 4.944 20.584 1.00 0.00 H ATOM 1037 N LEU A 218 17.713 3.183 16.746 1.00 10.36 N ATOM 1038 CA LEU A 218 18.368 2.026 16.176 1.00 10.30 C ATOM 1039 C LEU A 218 19.512 2.389 15.280 1.00 11.82 C ATOM 1040 O LEU A 218 20.621 1.850 15.411 1.00 13.31 O ATOM 1041 CB LEU A 218 17.348 1.200 15.392 1.00 10.70 C ATOM 1042 CG LEU A 218 17.836 -0.069 14.741 1.00 11.53 C ATOM 1043 CD1 LEU A 218 18.535 -1.028 15.711 1.00 11.91 C ATOM 1044 CD2 LEU A 218 16.757 -0.723 13.942 1.00 12.91 C ATOM 1045 H LEU A 218 17.181 3.821 16.121 1.00 0.00 H ATOM 1046 N LEU A 219 19.242 3.202 14.269 1.00 10.36 N ATOM 1047 CA LEU A 219 20.259 3.477 13.227 1.00 9.95 C ATOM 1048 C LEU A 219 19.932 4.750 12.492 1.00 9.98 C ATOM 1049 O LEU A 219 18.818 5.253 12.524 1.00 11.30 O ATOM 1050 CB LEU A 219 20.509 2.309 12.277 1.00 11.03 C ATOM 1051 CG LEU A 219 19.349 1.886 11.369 1.00 11.19 C ATOM 1052 CD1 LEU A 219 19.214 2.725 10.108 1.00 11.77 C ATOM 1053 CD2 LEU A 219 19.543 0.448 10.939 1.00 12.57 C ATOM 1054 H LEU A 219 18.306 3.652 14.206 1.00 0.00 H ATOM 1055 N GLN A 220 20.933 5.276 11.792 1.00 12.14 N ATOM 1056 CA GLN A 220 20.754 6.342 10.829 1.00 12.27 C ATOM 1057 C GLN A 220 21.303 5.893 9.509 1.00 12.27 C ATOM 1058 O GLN A 220 22.279 5.096 9.455 1.00 13.31 O ATOM 1059 CB GLN A 220 21.443 7.665 11.212 1.00 17.20 C ATOM 1060 CG GLN A 220 21.030 8.232 12.511 1.00 22.63 C ATOM 1061 CD GLN A 220 21.901 9.357 13.015 1.00 26.31 C ATOM 1062 OE1 GLN A 220 23.000 9.664 12.486 1.00 26.86 O ATOM 1063 NE2 GLN A 220 21.369 10.014 14.034 1.00 29.89 N ATOM 1064 HE22 GLN A 220 20.456 9.711 14.428 1.00 0.00 H ATOM 1065 HE21 GLN A 220 21.865 10.833 14.440 1.00 0.00 H ATOM 1066 H GLN A 220 21.892 4.903 11.944 1.00 0.00 H ATOM 1067 N TYR A 221 20.714 6.401 8.433 1.00 10.53 N ATOM 1068 CA TYR A 221 21.124 6.061 7.046 1.00 11.05 C ATOM 1069 C TYR A 221 21.225 7.358 6.241 1.00 10.26 C ATOM 1070 O TYR A 221 20.279 8.023 5.992 1.00 10.35 O ATOM 1071 CB TYR A 221 20.101 5.128 6.402 1.00 9.98 C ATOM 1072 CG TYR A 221 20.527 4.547 5.057 1.00 10.35 C ATOM 1073 CD1 TYR A 221 21.268 3.373 4.980 1.00 9.75 C ATOM 1074 CD2 TYR A 221 20.130 5.179 3.905 1.00 10.20 C ATOM 1075 CE1 TYR A 221 21.647 2.871 3.779 1.00 11.08 C ATOM 1076 CE2 TYR A 221 20.501 4.671 2.657 1.00 10.58 C ATOM 1077 CZ TYR A 221 21.229 3.497 2.628 1.00 9.96 C ATOM 1078 OH TYR A 221 21.610 2.908 1.415 1.00 10.13 O ATOM 1079 HH TYR A 221 20.801 2.689 0.888 1.00 0.00 H ATOM 1080 H TYR A 221 19.928 7.069 8.567 1.00 0.00 H ATOM 1081 N ASN A 222 22.472 7.669 5.936 1.00 11.06 N ATOM 1082 CA ASN A 222 22.809 8.895 5.146 1.00 11.72 C ATOM 1083 C ASN A 222 22.091 8.887 3.827 1.00 11.42 C ATOM 1084 O ASN A 222 22.056 7.882 3.134 1.00 12.18 O ATOM 1085 CB ASN A 222 24.347 9.010 4.801 1.00 12.17 C ATOM 1086 CG ASN A 222 24.790 10.462 4.313 1.00 13.35 C ATOM 1087 OD1 ASN A 222 24.909 11.354 5.178 1.00 16.90 O ATOM 1088 ND2 ASN A 222 25.080 10.700 2.971 1.00 15.44 N ATOM 1089 HD22 ASN A 222 24.972 9.937 2.272 1.00 0.00 H ATOM 1090 HD21 ASN A 222 25.405 11.640 2.668 1.00 0.00 H ATOM 1091 H ASN A 222 23.241 7.045 6.253 1.00 0.00 H ATOM 1092 N HIS A 223 21.533 10.057 3.437 1.00 10.95 N ATOM 1093 CA HIS A 223 20.866 10.199 2.107 1.00 10.94 C ATOM 1094 C HIS A 223 21.804 9.966 0.960 1.00 12.39 C ATOM 1095 O HIS A 223 22.791 10.706 0.781 1.00 15.35 O ATOM 1096 CB HIS A 223 20.197 11.521 1.925 1.00 11.78 C ATOM 1097 CG HIS A 223 19.084 11.784 2.884 1.00 11.86 C ATOM 1098 ND1 HIS A 223 18.039 10.913 3.058 1.00 11.50 N ATOM 1099 CD2 HIS A 223 18.880 12.772 3.798 1.00 13.11 C ATOM 1100 CE1 HIS A 223 17.205 11.370 3.968 1.00 11.89 C ATOM 1101 NE2 HIS A 223 17.687 12.533 4.412 1.00 13.77 N ATOM 1102 H HIS A 223 21.569 10.876 4.077 1.00 0.00 H ATOM 1103 N ARG A 224 21.542 8.909 0.194 1.00 10.47 N ATOM 1104 CA ARG A 224 22.226 8.685 -1.075 1.00 11.66 C ATOM 1105 C ARG A 224 21.463 9.209 -2.254 1.00 12.07 C ATOM 1106 O ARG A 224 22.074 9.822 -3.208 1.00 13.68 O ATOM 1107 CB ARG A 224 22.571 7.227 -1.291 1.00 11.40 C ATOM 1108 CG ARG A 224 23.307 6.527 -0.195 1.00 10.27 C ATOM 1109 CD ARG A 224 23.739 5.154 -0.510 1.00 12.12 C ATOM 1110 NE ARG A 224 24.263 4.451 0.667 1.00 13.30 N ATOM 1111 CZ ARG A 224 24.523 3.154 0.648 1.00 13.47 C ATOM 1112 NH1 ARG A 224 24.326 2.371 -0.419 1.00 14.88 N ATOM 1113 NH2 ARG A 224 24.937 2.507 1.753 1.00 15.38 N ATOM 1114 HE ARG A 224 24.435 4.988 1.541 1.00 0.00 H ATOM 1115 HH12 ARG A 224 24.551 1.357 -0.369 1.00 0.00 H ATOM 1116 HH11 ARG A 224 23.948 2.776 -1.299 1.00 0.00 H ATOM 1117 HH22 ARG A 224 25.136 1.487 1.715 1.00 0.00 H ATOM 1118 HH21 ARG A 224 25.058 3.027 2.645 1.00 0.00 H ATOM 1119 H ARG A 224 20.828 8.222 0.510 1.00 0.00 H ATOM 1120 N VAL A 225 20.150 8.985 -2.238 1.00 10.43 N ATOM 1121 CA VAL A 225 19.213 9.642 -3.172 1.00 11.74 C ATOM 1122 C VAL A 225 18.934 11.018 -2.608 1.00 12.85 C ATOM 1123 O VAL A 225 18.384 11.131 -1.515 1.00 15.17 O ATOM 1124 CB VAL A 225 17.937 8.786 -3.396 1.00 11.18 C ATOM 1125 CG1 VAL A 225 16.889 9.530 -4.170 1.00 11.98 C ATOM 1126 CG2 VAL A 225 18.312 7.481 -3.953 1.00 11.79 C ATOM 1127 H VAL A 225 19.768 8.318 -1.537 1.00 0.00 H ATOM 1128 N LYS A 226 19.198 12.085 -3.396 1.00 12.83 N ATOM 1129 CA LYS A 226 19.196 13.447 -2.856 1.00 13.63 C ATOM 1130 C LYS A 226 17.961 14.197 -3.197 1.00 13.16 C ATOM 1131 O LYS A 226 17.694 15.191 -2.609 1.00 13.15 O ATOM 1132 CB LYS A 226 20.440 14.170 -3.323 1.00 15.90 C ATOM 1133 CG LYS A 226 21.624 13.362 -2.717 1.00 19.68 C ATOM 1134 CD LYS A 226 22.890 14.001 -2.626 1.00 19.46 C ATOM 1135 CE LYS A 226 23.921 13.022 -2.277 1.00 16.35 C ATOM 1136 NZ LYS A 226 24.192 13.041 -0.782 1.00 16.01 N ATOM 1137 HZ1 LYS A 226 24.517 13.988 -0.502 1.00 0.00 H ATOM 1138 HZ2 LYS A 226 23.318 12.808 -0.269 1.00 0.00 H ATOM 1139 HZ3 LYS A 226 24.926 12.340 -0.555 1.00 0.00 H ATOM 1140 H LYS A 226 19.406 11.936 -4.404 1.00 0.00 H ATOM 1141 N LYS A 227 17.159 13.689 -4.142 1.00 11.27 N ATOM 1142 CA LYS A 227 15.934 14.331 -4.566 1.00 12.27 C ATOM 1143 C LYS A 227 14.845 13.799 -3.634 1.00 11.90 C ATOM 1144 O LYS A 227 14.046 12.924 -3.992 1.00 11.71 O ATOM 1145 CB LYS A 227 15.634 14.014 -6.023 1.00 15.01 C ATOM 1146 CG LYS A 227 16.629 14.745 -6.938 1.00 18.05 C ATOM 1147 CD LYS A 227 16.435 14.308 -8.379 1.00 20.92 C ATOM 1148 CE LYS A 227 17.200 15.242 -9.329 1.00 23.30 C ATOM 1149 NZ LYS A 227 17.372 14.517 -10.643 1.00 25.70 N ATOM 1150 HZ1 LYS A 227 17.909 13.640 -10.486 1.00 0.00 H ATOM 1151 HZ2 LYS A 227 16.437 14.287 -11.036 1.00 0.00 H ATOM 1152 HZ3 LYS A 227 17.888 15.127 -11.309 1.00 0.00 H ATOM 1153 H LYS A 227 17.430 12.791 -4.592 1.00 0.00 H ATOM 1154 N LEU A 228 14.876 14.284 -2.389 1.00 11.92 N ATOM 1155 CA LEU A 228 13.921 13.818 -1.335 1.00 13.49 C ATOM 1156 C LEU A 228 12.457 13.939 -1.785 1.00 12.50 C ATOM 1157 O LEU A 228 11.660 13.035 -1.514 1.00 12.68 O ATOM 1158 CB LEU A 228 14.139 14.541 0.000 1.00 17.36 C ATOM 1159 CG LEU A 228 15.544 14.411 0.630 1.00 15.20 C ATOM 1160 CD1 LEU A 228 15.627 15.180 1.931 1.00 15.47 C ATOM 1161 CD2 LEU A 228 16.062 13.008 0.719 1.00 15.27 C ATOM 1162 H LEU A 228 15.584 15.006 -2.146 1.00 0.00 H ATOM 1163 N ASN A 229 12.100 15.009 -2.523 1.00 11.55 N ATOM 1164 CA ASN A 229 10.730 15.202 -2.935 1.00 14.45 C ATOM 1165 C ASN A 229 10.298 14.285 -4.048 1.00 10.94 C ATOM 1166 O ASN A 229 9.115 14.344 -4.457 1.00 13.09 O ATOM 1167 CB ASN A 229 10.412 16.650 -3.320 1.00 15.62 C ATOM 1168 CG ASN A 229 11.168 17.149 -4.459 1.00 18.09 C ATOM 1169 OD1 ASN A 229 11.845 16.436 -5.154 1.00 18.38 O ATOM 1170 ND2 ASN A 229 11.062 18.500 -4.657 1.00 23.88 N ATOM 1171 HD22 ASN A 229 10.463 19.072 -4.028 1.00 0.00 H ATOM 1172 HD21 ASN A 229 11.580 18.954 -5.436 1.00 0.00 H ATOM 1173 H ASN A 229 12.822 15.705 -2.799 1.00 0.00 H ATOM 1174 N GLU A 230 11.203 13.384 -4.477 1.00 11.56 N ATOM 1175 CA GLU A 230 10.810 12.356 -5.472 1.00 11.37 C ATOM 1176 C GLU A 230 10.708 10.962 -4.859 1.00 11.42 C ATOM 1177 O GLU A 230 10.387 10.036 -5.585 1.00 11.03 O ATOM 1178 CB GLU A 230 11.778 12.293 -6.659 1.00 12.64 C ATOM 1179 CG GLU A 230 11.704 13.653 -7.411 1.00 14.04 C ATOM 1180 CD GLU A 230 12.503 13.711 -8.652 1.00 16.29 C ATOM 1181 OE1 GLU A 230 13.156 12.716 -9.016 1.00 16.41 O ATOM 1182 OE2 GLU A 230 12.487 14.800 -9.274 1.00 22.09 O ATOM 1183 H GLU A 230 12.176 13.409 -4.111 1.00 0.00 H ATOM 1184 N ILE A 231 10.918 10.841 -3.532 1.00 11.28 N ATOM 1185 CA ILE A 231 10.814 9.553 -2.834 1.00 10.64 C ATOM 1186 C ILE A 231 9.366 9.438 -2.400 1.00 11.02 C ATOM 1187 O ILE A 231 9.069 9.800 -1.272 1.00 12.90 O ATOM 1188 CB ILE A 231 11.836 9.473 -1.686 1.00 10.77 C ATOM 1189 CG1 ILE A 231 13.265 9.714 -2.143 1.00 11.85 C ATOM 1190 CG2 ILE A 231 11.623 8.147 -0.909 1.00 11.64 C ATOM 1191 CD1 ILE A 231 14.259 9.898 -0.974 1.00 11.35 C ATOM 1192 H ILE A 231 11.162 11.690 -2.984 1.00 0.00 H ATOM 1193 N SER A 232 8.542 8.925 -3.270 1.00 10.29 N ATOM 1194 CA SER A 232 7.101 9.161 -3.224 1.00 10.46 C ATOM 1195 C SER A 232 6.314 7.948 -2.819 1.00 10.01 C ATOM 1196 O SER A 232 5.085 8.000 -2.844 1.00 11.03 O ATOM 1197 CB SER A 232 6.617 9.740 -4.577 1.00 10.81 C ATOM 1198 OG SER A 232 7.196 11.035 -4.759 1.00 11.01 O ATOM 1199 HG SER A 232 8.183 10.957 -4.761 1.00 0.00 H ATOM 1200 H SER A 232 8.926 8.324 -4.027 1.00 0.00 H ATOM 1201 N LYS A 233 6.965 6.833 -2.485 1.00 10.28 N ATOM 1202 CA LYS A 233 6.242 5.654 -2.000 1.00 11.27 C ATOM 1203 C LYS A 233 7.075 4.942 -0.964 1.00 11.11 C ATOM 1204 O LYS A 233 8.329 4.951 -1.040 1.00 10.53 O ATOM 1205 CB LYS A 233 6.014 4.638 -3.148 1.00 14.54 C ATOM 1206 CG LYS A 233 5.176 5.133 -4.295 1.00 22.44 C ATOM 1207 CD LYS A 233 4.967 4.009 -5.315 1.00 28.58 C ATOM 1208 CE LYS A 233 4.238 4.638 -6.516 1.00 32.64 C ATOM 1209 NZ LYS A 233 2.751 4.609 -6.338 1.00 42.92 N ATOM 1210 HZ1 LYS A 233 2.434 3.623 -6.241 1.00 0.00 H ATOM 1211 HZ2 LYS A 233 2.495 5.142 -5.483 1.00 0.00 H ATOM 1212 HZ3 LYS A 233 2.295 5.041 -7.167 1.00 0.00 H ATOM 1213 H LYS A 233 8.001 6.800 -2.570 1.00 0.00 H ATOM 1214 N LEU A 234 6.365 4.360 0.003 1.00 10.69 N ATOM 1215 CA LEU A 234 6.984 3.418 0.943 1.00 9.75 C ATOM 1216 C LEU A 234 6.324 2.093 0.809 1.00 10.22 C ATOM 1217 O LEU A 234 5.095 1.912 0.958 1.00 12.85 O ATOM 1218 CB LEU A 234 6.841 3.947 2.376 1.00 11.05 C ATOM 1219 CG LEU A 234 7.236 2.911 3.463 1.00 11.24 C ATOM 1220 CD1 LEU A 234 8.736 2.523 3.333 1.00 11.51 C ATOM 1221 CD2 LEU A 234 6.933 3.418 4.886 1.00 14.11 C ATOM 1222 H LEU A 234 5.352 4.578 0.093 1.00 0.00 H ATOM 1223 N GLY A 235 7.120 1.077 0.481 1.00 9.60 N ATOM 1224 CA GLY A 235 6.655 -0.298 0.407 1.00 10.44 C ATOM 1225 C GLY A 235 6.973 -1.023 1.688 1.00 10.48 C ATOM 1226 O GLY A 235 8.106 -0.890 2.215 1.00 11.05 O ATOM 1227 H GLY A 235 8.118 1.276 0.268 1.00 0.00 H ATOM 1228 N ILE A 236 5.998 -1.714 2.262 1.00 12.36 N ATOM 1229 CA ILE A 236 6.187 -2.429 3.543 1.00 11.86 C ATOM 1230 C ILE A 236 5.934 -3.877 3.213 1.00 12.48 C ATOM 1231 O ILE A 236 4.820 -4.251 2.761 1.00 14.48 O ATOM 1232 CB ILE A 236 5.252 -1.858 4.645 1.00 12.74 C ATOM 1233 CG1 ILE A 236 5.449 -0.348 4.824 1.00 14.70 C ATOM 1234 CG2 ILE A 236 5.521 -2.670 5.893 1.00 13.91 C ATOM 1235 CD1 ILE A 236 4.374 0.339 5.648 1.00 17.16 C ATOM 1236 H ILE A 236 5.069 -1.755 1.796 1.00 0.00 H ATOM 1237 N SER A 237 6.871 -4.768 3.513 1.00 12.98 N ATOM 1238 CA SER A 237 6.728 -6.155 3.094 1.00 13.05 C ATOM 1239 C SER A 237 7.409 -7.084 4.124 1.00 13.29 C ATOM 1240 O SER A 237 8.069 -6.617 5.096 1.00 12.22 O ATOM 1241 CB SER A 237 7.277 -6.401 1.700 1.00 15.24 C ATOM 1242 OG SER A 237 8.649 -6.012 1.672 1.00 15.90 O ATOM 1243 HG SER A 237 8.723 -5.051 1.898 1.00 0.00 H ATOM 1244 H SER A 237 7.712 -4.474 4.050 1.00 0.00 H ATOM 1245 N GLY A 238 7.208 -8.370 3.874 1.00 14.92 N ATOM 1246 CA GLY A 238 7.833 -9.407 4.692 1.00 13.82 C ATOM 1247 C GLY A 238 6.893 -10.026 5.715 1.00 14.19 C ATOM 1248 O GLY A 238 5.660 -9.969 5.591 1.00 14.32 O ATOM 1249 H GLY A 238 6.594 -8.646 3.081 1.00 0.00 H ATOM 1250 N ASP A 239 7.485 -10.688 6.724 1.00 12.86 N ATOM 1251 CA ASP A 239 6.771 -11.653 7.571 1.00 13.47 C ATOM 1252 C ASP A 239 6.142 -10.984 8.770 1.00 14.99 C ATOM 1253 O ASP A 239 6.558 -11.186 9.927 1.00 15.69 O ATOM 1254 CB ASP A 239 7.726 -12.781 7.957 1.00 15.64 C ATOM 1255 CG ASP A 239 8.350 -13.480 6.726 1.00 15.76 C ATOM 1256 OD1 ASP A 239 7.556 -13.660 5.783 1.00 23.12 O ATOM 1257 OD2 ASP A 239 9.559 -13.835 6.756 1.00 19.61 O ATOM 1258 H ASP A 239 8.492 -10.509 6.913 1.00 0.00 H ATOM 1259 N ILE A 240 5.220 -10.046 8.455 1.00 12.79 N ATOM 1260 CA ILE A 240 4.525 -9.216 9.415 1.00 14.61 C ATOM 1261 C ILE A 240 3.041 -9.236 9.216 1.00 13.78 C ATOM 1262 O ILE A 240 2.510 -9.447 8.112 1.00 17.65 O ATOM 1263 CB ILE A 240 5.043 -7.769 9.496 1.00 15.37 C ATOM 1264 CG1 ILE A 240 4.771 -7.026 8.232 1.00 17.52 C ATOM 1265 CG2 ILE A 240 6.487 -7.786 9.943 1.00 14.82 C ATOM 1266 CD1 ILE A 240 4.991 -5.517 8.365 1.00 16.95 C ATOM 1267 H ILE A 240 4.994 -9.911 7.449 1.00 0.00 H ATOM 1268 N ASP A 241 2.346 -9.000 10.305 1.00 15.97 N ATOM 1269 CA ASP A 241 0.975 -8.527 10.271 1.00 19.08 C ATOM 1270 C ASP A 241 1.042 -7.015 10.455 1.00 18.81 C ATOM 1271 O ASP A 241 1.632 -6.518 11.428 1.00 19.19 O ATOM 1272 CB ASP A 241 0.168 -9.185 11.397 1.00 23.59 C ATOM 1273 CG ASP A 241 -0.012 -10.657 11.173 1.00 30.14 C ATOM 1274 OD1 ASP A 241 -0.053 -11.117 9.990 1.00 35.66 O ATOM 1275 OD2 ASP A 241 -0.100 -11.375 12.207 1.00 36.53 O ATOM 1276 H ASP A 241 2.797 -9.159 11.229 1.00 0.00 H ATOM 1277 N LEU A 242 0.491 -6.272 9.521 1.00 14.59 N ATOM 1278 CA LEU A 242 0.586 -4.859 9.587 1.00 15.15 C ATOM 1279 C LEU A 242 -0.648 -4.198 10.119 1.00 15.84 C ATOM 1280 O LEU A 242 -1.748 -4.526 9.606 1.00 16.80 O ATOM 1281 CB LEU A 242 0.905 -4.329 8.160 1.00 14.14 C ATOM 1282 CG LEU A 242 1.058 -2.829 7.918 1.00 16.23 C ATOM 1283 CD1 LEU A 242 2.233 -2.234 8.651 1.00 14.89 C ATOM 1284 CD2 LEU A 242 1.283 -2.594 6.396 1.00 16.81 C ATOM 1285 H LEU A 242 -0.016 -6.722 8.732 1.00 0.00 H ATOM 1286 N THR A 243 -0.536 -3.388 11.146 1.00 15.27 N ATOM 1287 CA THR A 243 -1.621 -2.772 11.794 1.00 17.36 C ATOM 1288 C THR A 243 -1.872 -1.349 11.316 1.00 20.32 C ATOM 1289 O THR A 243 -3.031 -0.918 11.227 1.00 22.60 O ATOM 1290 CB THR A 243 -1.304 -2.763 13.300 1.00 21.14 C ATOM 1291 OG1 THR A 243 -1.187 -4.114 13.724 1.00 23.90 O ATOM 1292 CG2 THR A 243 -2.325 -2.013 14.088 1.00 23.58 C ATOM 1293 HG1 THR A 243 -0.983 -4.138 14.692 1.00 0.00 H ATOM 1294 H THR A 243 0.420 -3.189 11.504 1.00 0.00 H ATOM 1295 N SER A 244 -0.828 -0.577 11.079 1.00 15.97 N ATOM 1296 CA SER A 244 -1.021 0.764 10.563 1.00 15.14 C ATOM 1297 C SER A 244 0.291 1.336 10.042 1.00 14.30 C ATOM 1298 O SER A 244 1.398 0.911 10.402 1.00 13.61 O ATOM 1299 CB SER A 244 -1.585 1.646 11.633 1.00 14.46 C ATOM 1300 OG SER A 244 -0.676 1.847 12.695 1.00 14.45 O ATOM 1301 HG SER A 244 0.147 2.273 12.347 1.00 0.00 H ATOM 1302 H SER A 244 0.133 -0.931 11.262 1.00 0.00 H ATOM 1303 N ALA A 245 0.151 2.267 9.090 1.00 15.20 N ATOM 1304 CA ALA A 245 1.239 2.856 8.402 1.00 13.87 C ATOM 1305 C ALA A 245 0.798 4.282 8.116 1.00 15.81 C ATOM 1306 O ALA A 245 -0.212 4.490 7.424 1.00 16.69 O ATOM 1307 CB ALA A 245 1.584 2.105 7.143 1.00 15.63 C ATOM 1308 H ALA A 245 -0.811 2.575 8.842 1.00 0.00 H ATOM 1309 N SER A 246 1.479 5.208 8.661 1.00 13.84 N ATOM 1310 CA SER A 246 1.100 6.601 8.458 1.00 15.89 C ATOM 1311 C SER A 246 2.257 7.579 8.646 1.00 15.86 C ATOM 1312 O SER A 246 3.395 7.198 9.011 1.00 14.86 O ATOM 1313 CB SER A 246 -0.044 6.906 9.439 1.00 17.22 C ATOM 1314 OG SER A 246 0.403 6.957 10.778 1.00 20.01 O ATOM 1315 HG SER A 246 1.086 7.668 10.870 1.00 0.00 H ATOM 1316 H SER A 246 2.303 4.972 9.249 1.00 0.00 H ATOM 1317 N TYR A 247 2.000 8.869 8.518 1.00 16.19 N ATOM 1318 CA TYR A 247 3.028 9.876 8.610 1.00 14.69 C ATOM 1319 C TYR A 247 2.422 11.159 9.205 1.00 17.63 C ATOM 1320 O TYR A 247 1.195 11.364 9.158 1.00 16.65 O ATOM 1321 CB TYR A 247 3.756 10.161 7.261 1.00 18.15 C ATOM 1322 CG TYR A 247 2.807 10.427 6.123 1.00 16.28 C ATOM 1323 CD1 TYR A 247 2.123 11.672 6.038 1.00 18.54 C ATOM 1324 CD2 TYR A 247 2.529 9.502 5.149 1.00 18.10 C ATOM 1325 CE1 TYR A 247 1.216 11.879 5.045 1.00 19.99 C ATOM 1326 CE2 TYR A 247 1.644 9.727 4.090 1.00 18.13 C ATOM 1327 CZ TYR A 247 0.965 10.934 4.080 1.00 16.21 C ATOM 1328 OH TYR A 247 0.100 11.079 3.030 1.00 21.33 O ATOM 1329 HH TYR A 247 -0.581 10.361 3.063 1.00 0.00 H ATOM 1330 H TYR A 247 1.020 9.169 8.344 1.00 0.00 H ATOM 1331 N THR A 248 3.281 11.940 9.812 1.00 16.98 N ATOM 1332 CA THR A 248 2.969 13.236 10.318 1.00 20.86 C ATOM 1333 C THR A 248 4.193 14.140 10.232 1.00 22.11 C ATOM 1334 O THR A 248 5.288 13.714 9.877 1.00 21.58 O ATOM 1335 CB THR A 248 2.476 13.143 11.760 1.00 24.50 C ATOM 1336 OG1 THR A 248 1.944 14.442 12.111 1.00 28.03 O ATOM 1337 CG2 THR A 248 3.567 12.825 12.762 1.00 23.00 C ATOM 1338 HG1 THR A 248 1.613 14.421 13.044 1.00 0.00 H ATOM 1339 H THR A 248 4.254 11.592 9.933 1.00 0.00 H ATOM 1340 N MET A 249 4.004 15.449 10.404 1.00 21.10 N ATOM 1341 CA MET A 249 5.107 16.425 10.487 1.00 21.93 C ATOM 1342 C MET A 249 5.375 16.747 11.932 1.00 26.10 C ATOM 1343 O MET A 249 4.458 16.988 12.723 1.00 29.34 O ATOM 1344 CB MET A 249 4.783 17.742 9.798 1.00 22.86 C ATOM 1345 CG MET A 249 4.909 17.750 8.290 1.00 21.56 C ATOM 1346 SD MET A 249 6.449 17.053 7.648 1.00 19.98 S ATOM 1347 CE MET A 249 5.922 16.708 5.952 1.00 19.17 C ATOM 1348 H MET A 249 3.028 15.800 10.484 1.00 0.00 H ATOM 1349 N ILE A 250 6.622 16.742 12.293 1.00 24.72 N ATOM 1350 CA ILE A 250 7.112 16.880 13.620 1.00 29.67 C ATOM 1351 C ILE A 250 7.556 18.307 13.591 1.00 33.72 C ATOM 1352 O ILE A 250 7.375 19.012 12.561 1.00 34.99 O ATOM 1353 CB ILE A 250 8.189 15.747 13.845 1.00 32.53 C ATOM 1354 CG1 ILE A 250 7.682 14.829 14.892 1.00 37.48 C ATOM 1355 CG2 ILE A 250 9.641 16.167 14.003 1.00 32.58 C ATOM 1356 CD1 ILE A 250 6.280 14.325 14.583 1.00 38.45 C ATOM 1357 OXT ILE A 250 8.044 18.791 14.624 1.00 36.76 O ATOM 1358 H ILE A 250 7.330 16.626 11.540 1.00 0.00 H TER 1359 ILE A 250 HETATM 1360 O HOH 1 26.085 13.064 5.944 1.00 38.53 O HETATM 1361 O HOH 2 14.623 15.915 13.552 1.00 31.09 O HETATM 1362 O HOH 3 0.903 4.140 12.150 1.00 21.12 O HETATM 1363 O HOH 4 23.513 -12.553 2.730 1.00 29.58 O HETATM 1364 O HOH 5 13.590 -3.201 -9.923 1.00 29.32 O HETATM 1365 O HOH 6 4.865 7.828 15.900 1.00 27.99 O HETATM 1366 O HOH 7 15.447 -8.737 20.112 1.00 31.16 O HETATM 1367 O HOH 8 9.087 -3.458 1.026 1.00 14.79 O HETATM 1368 O HOH 9 18.680 5.968 -11.180 1.00 24.49 O HETATM 1369 O HOH 10 19.921 12.765 14.568 1.00 34.18 O HETATM 1370 O HOH 11 -1.226 -7.617 7.701 1.00 25.03 O HETATM 1371 O HOH 12 12.557 -1.180 -7.158 1.00 29.39 O HETATM 1372 O HOH 13 11.198 -19.196 8.715 1.00 37.65 O HETATM 1373 O HOH 14 24.939 -13.118 8.871 1.00 23.85 O HETATM 1374 O HOH 15 12.308 -16.069 13.333 1.00 32.01 O HETATM 1375 O HOH 16 -0.488 8.491 1.736 1.00 26.28 O HETATM 1376 O HOH 17 5.484 0.431 -2.860 1.00 33.06 O HETATM 1377 O HOH 18 15.947 12.826 15.946 1.00 36.13 O HETATM 1378 O HOH 19 17.515 4.786 -15.265 1.00 27.99 O HETATM 1379 O HOH 20 10.422 -1.274 -8.684 1.00 23.09 O HETATM 1380 O HOH 21 24.690 6.070 6.713 1.00 17.53 O HETATM 1381 O HOH 22 9.853 3.574 17.655 1.00 12.99 O HETATM 1382 O HOH 23 4.160 9.324 12.289 1.00 21.68 O HETATM 1383 O HOH 24 11.938 17.421 0.167 1.00 26.22 O HETATM 1384 O HOH 25 0.189 -8.380 18.329 1.00 36.28 O HETATM 1385 O HOH 26 19.134 -19.684 12.884 1.00 26.92 O HETATM 1386 O HOH 27 24.233 12.072 8.938 1.00 26.92 O HETATM 1387 O HOH 28 13.613 16.284 11.197 1.00 22.19 O HETATM 1388 O HOH 29 15.777 2.049 -11.800 1.00 16.38 O HETATM 1389 O HOH 30 21.888 -1.380 8.897 1.00 21.01 O HETATM 1390 O HOH 31 13.517 8.020 14.745 1.00 17.11 O HETATM 1391 O HOH 32 -8.075 -1.980 7.590 1.00 23.86 O HETATM 1392 O HOH 33 1.442 9.120 12.034 1.00 21.56 O HETATM 1393 O HOH 34 27.120 6.677 5.406 1.00 31.53 O HETATM 1394 O HOH 35 10.239 20.669 6.533 1.00 29.78 O HETATM 1395 O HOH 36 -1.573 6.505 6.203 1.00 35.32 O HETATM 1396 O HOH 37 14.257 19.272 15.126 1.00 20.35 O HETATM 1397 O HOH 38 15.853 7.547 16.557 1.00 19.42 O HETATM 1398 O HOH 39 22.785 2.574 8.275 1.00 19.50 O HETATM 1399 O HOH 40 28.039 -14.679 -3.863 1.00 33.37 O HETATM 1400 O HOH 41 10.433 7.709 19.545 1.00 34.07 O HETATM 1401 O HOH 42 23.985 5.926 3.211 1.00 15.07 O HETATM 1402 O HOH 43 19.043 3.083 21.504 1.00 32.16 O HETATM 1403 O HOH 44 17.464 9.547 0.554 1.00 11.68 O HETATM 1404 O HOH 45 10.250 -7.336 -0.155 1.00 24.97 O HETATM 1405 O HOH 46 11.389 -8.472 22.819 1.00 28.47 O HETATM 1406 O HOH 47 18.977 -16.934 13.253 1.00 24.85 O HETATM 1407 O HOH 48 19.102 7.524 0.058 1.00 11.92 O HETATM 1408 O HOH 49 14.417 14.586 -11.268 1.00 23.81 O HETATM 1409 O HOH 50 12.440 -5.589 -0.352 1.00 21.99 O HETATM 1410 O HOH 51 13.642 -3.958 -2.488 1.00 31.80 O HETATM 1411 O HOH 52 -0.207 -6.732 -1.731 1.00 33.16 O HETATM 1412 O HOH 53 24.843 9.414 -3.163 1.00 24.68 O HETATM 1413 O HOH 54 17.397 7.643 -7.345 1.00 15.39 O HETATM 1414 O HOH 55 15.482 -13.576 21.775 1.00 25.49 O HETATM 1415 O HOH 56 15.954 -8.930 1.319 1.00 18.99 O HETATM 1416 O HOH 57 16.756 0.597 -9.003 1.00 14.09 O HETATM 1417 O HOH 58 8.562 -14.571 21.023 1.00 29.77 O HETATM 1418 O HOH 59 19.005 18.415 3.486 1.00 17.88 O HETATM 1419 O HOH 60 22.154 8.483 -5.704 1.00 25.15 O HETATM 1420 O HOH 61 16.715 -14.255 7.216 1.00 19.68 O HETATM 1421 O HOH 62 26.973 2.285 -2.654 1.00 21.26 O HETATM 1422 O HOH 63 9.111 -11.330 2.041 1.00 27.87 O HETATM 1423 O HOH 64 20.042 -6.591 19.726 1.00 26.97 O HETATM 1424 O HOH 65 25.839 10.708 -0.742 1.00 24.31 O HETATM 1425 O HOH 66 23.210 5.826 14.875 1.00 22.85 O HETATM 1426 O HOH 67 -0.999 -1.374 -0.804 1.00 24.84 O HETATM 1427 O HOH 68 -2.078 -3.717 0.371 1.00 27.47 O HETATM 1428 O HOH 69 24.515 12.015 13.211 1.00 34.12 O HETATM 1429 O HOH 70 26.649 2.976 8.526 1.00 35.60 O HETATM 1430 O HOH 71 -1.555 -9.561 3.934 1.00 31.93 O HETATM 1431 O HOH 72 3.178 9.760 -4.135 1.00 24.65 O HETATM 1432 O HOH 73 9.173 -5.810 18.935 1.00 17.57 O HETATM 1433 O HOH 74 23.716 1.707 -10.605 1.00 32.29 O HETATM 1434 O HOH 75 22.725 -12.890 15.607 1.00 23.46 O HETATM 1435 O HOH 76 20.014 -10.735 17.669 1.00 27.59 O HETATM 1436 O HOH 77 19.279 -9.533 19.561 1.00 27.80 O HETATM 1437 O HOH 78 10.757 -7.077 20.481 1.00 22.75 O HETATM 1438 O HOH 79 19.239 12.467 -9.716 1.00 29.58 O HETATM 1439 O HOH 80 20.654 -18.301 5.922 1.00 33.40 O HETATM 1440 O HOH 81 16.448 6.330 21.907 1.00 21.34 O HETATM 1441 O HOH 82 27.782 -4.566 0.403 1.00 25.29 O HETATM 1442 O HOH 83 13.999 -1.442 20.956 1.00 29.21 O HETATM 1443 O HOH 84 16.707 -7.105 -5.754 1.00 31.30 O HETATM 1444 O HOH 85 15.843 -10.727 3.564 1.00 22.86 O HETATM 1445 O HOH 86 18.496 -9.268 -5.168 1.00 39.39 O HETATM 1446 O HOH 87 15.667 -0.283 18.858 1.00 23.64 O HETATM 1447 O HOH 88 9.171 -7.550 16.958 1.00 14.40 O HETATM 1448 O HOH 89 8.130 6.762 -6.079 1.00 13.48 O HETATM 1449 O HOH 90 6.798 -16.062 8.952 1.00 32.82 O HETATM 1450 O HOH 91 26.434 6.702 2.463 1.00 30.84 O HETATM 1451 O HOH 92 2.275 -2.913 17.045 1.00 21.46 O HETATM 1452 O HOH 93 23.077 1.735 -5.486 1.00 18.00 O HETATM 1453 O HOH 94 14.212 -6.639 -12.653 1.00 24.29 O HETATM 1454 O HOH 95 22.187 -5.774 -7.576 1.00 28.25 O HETATM 1455 O HOH 96 13.136 -13.990 16.341 1.00 26.06 O HETATM 1456 O HOH 97 -2.842 2.535 8.422 1.00 24.58 O HETATM 1457 O HOH 98 23.708 4.159 12.565 1.00 18.02 O HETATM 1458 O HOH 99 5.291 -9.364 1.657 1.00 22.99 O HETATM 1459 O HOH 100 26.535 -8.757 9.304 1.00 21.95 O HETATM 1460 O HOH 101 24.006 -5.902 -2.033 1.00 28.58 O HETATM 1461 O HOH 102 -0.759 10.953 11.591 1.00 33.99 O HETATM 1462 O HOH 103 24.180 3.279 -3.432 1.00 13.48 O HETATM 1463 O HOH 104 -4.915 -2.736 3.191 1.00 24.32 O HETATM 1464 O HOH 105 -0.798 9.451 6.972 1.00 23.00 O HETATM 1465 O HOH 106 14.005 17.653 -2.283 1.00 27.49 O HETATM 1466 O HOH 107 18.823 11.756 -6.666 1.00 16.50 O HETATM 1467 O HOH 108 -2.816 10.909 4.828 1.00 33.97 O HETATM 1468 O HOH 109 14.675 18.506 10.269 1.00 28.55 O HETATM 1469 O HOH 110 16.245 -19.801 12.967 1.00 31.46 O HETATM 1470 O HOH 111 26.400 -6.618 11.464 1.00 21.12 O HETATM 1471 O HOH 112 2.236 15.213 7.067 1.00 34.09 O HETATM 1472 O HOH 113 23.387 0.412 9.677 1.00 24.18 O HETATM 1473 O HOH 114 13.510 -11.758 -4.702 1.00 39.73 O HETATM 1474 O HOH 115 19.870 8.918 -7.212 1.00 19.28 O HETATM 1475 O HOH 116 25.612 -11.231 10.786 1.00 29.15 O HETATM 1476 O HOH 117 16.431 19.355 2.875 1.00 31.23 O HETATM 1477 O HOH 118 25.148 5.491 -4.447 1.00 26.72 O HETATM 1478 O35 UNN A 119 27.053 -12.693 -2.249 1.00 -0.40 O HETATM 1479 C33 UNN A 119 27.558 -11.594 -1.970 1.00 0.17 C HETATM 1480 C34 UNN A 119 28.957 -11.220 -2.370 1.00 0.03 C HETATM 1481 H1 UNN A 119 29.181 -10.204 -2.014 1.00 0.05 H HETATM 1482 H2 UNN A 119 29.046 -11.252 -3.466 1.00 0.05 H HETATM 1483 H3 UNN A 119 29.668 -11.930 -1.923 1.00 0.05 H HETATM 1484 N1 UNN A 119 26.814 -10.567 -1.334 1.00 -0.26 N HETATM 1485 UNK UNN A 119 25.379 -10.819 -1.164 1.00 0.17 C HETATM 1486 UNK UNN A 119 24.928 -9.991 0.080 1.00 0.12 C HETATM 1487 N2 UNN A 119 25.429 -10.701 1.296 1.00 -0.28 N HETATM 1488 C36 UNN A 119 26.556 -10.238 1.889 1.00 0.20 C HETATM 1489 C38 UNN A 119 26.872 -10.846 3.202 1.00 0.04 C HETATM 1490 C39 UNN A 119 26.391 -12.111 3.686 1.00 -0.05 C HETATM 1491 C40 UNN A 119 26.753 -12.514 4.997 1.00 -0.06 C HETATM 1492 C41 UNN A 119 27.518 -11.619 5.783 1.00 -0.03 C HETATM 1493 C42 UNN A 119 27.974 -10.376 5.252 1.00 0.10 C HETATM 1494 O44 UNN A 119 28.745 -9.430 5.897 1.00 -0.32 O HETATM 1495 C45 UNN A 119 29.305 -8.230 5.252 1.00 0.06 C HETATM 1496 H11 UNN A 119 29.876 -7.649 5.991 1.00 0.06 H HETATM 1497 H12 UNN A 119 28.487 -7.612 4.854 1.00 0.06 H HETATM 1498 H13 UNN A 119 29.970 -8.532 4.430 1.00 0.06 H HETATM 1499 C43 UNN A 119 27.608 -9.994 3.971 1.00 -0.01 C HETATM 1500 H14 UNN A 119 27.904 -9.026 3.584 1.00 0.06 H HETATM 1501 H10 UNN A 119 27.761 -11.883 6.806 1.00 0.06 H HETATM 1502 H9 UNN A 119 26.452 -13.480 5.386 1.00 0.06 H HETATM 1503 H8 UNN A 119 25.767 -12.742 3.064 1.00 0.06 H HETATM 1504 O37 UNN A 119 27.218 -9.303 1.471 1.00 -0.38 O HETATM 1505 H7 UNN A 119 24.946 -11.496 1.662 1.00 0.19 H HETATM 1506 UNK UNN A 119 23.440 -10.017 0.229 1.00 0.11 C HETATM 1507 UNK UNN A 119 22.750 -9.558 -1.050 1.00 0.12 C HETATM 1508 UNK UNN A 119 23.300 -10.404 -2.249 1.00 0.11 C HETATM 1509 UNK UNN A 119 24.695 -10.222 -2.270 1.00 -0.34 O HETATM 1510 UNK UNN A 119 22.728 -9.884 -3.598 1.00 0.07 C HETATM 1511 UNK UNN A 119 22.989 -8.453 -3.812 1.00 -0.39 O HETATM 1512 H18 UNN A 119 23.927 -8.300 -3.815 1.00 0.21 H HETATM 1513 H16 UNN A 119 21.640 -10.048 -3.606 1.00 0.06 H HETATM 1514 H17 UNN A 119 23.190 -10.452 -4.418 1.00 0.06 H HETATM 1515 H15 UNN A 119 23.045 -11.466 -2.115 1.00 0.06 H HETATM 1516 O1 UNN A 119 21.380 -9.793 -0.953 1.00 -0.34 O HETATM 1517 C1 UNN A 119 20.553 -8.713 -1.424 1.00 0.19 C HETATM 1518 C2 UNN A 119 19.153 -9.180 -1.321 1.00 0.13 C HETATM 1519 O2 UNN A 119 18.937 -10.217 -2.363 1.00 -0.38 O HETATM 1520 H24 UNN A 119 19.096 -9.840 -3.221 1.00 0.21 H HETATM 1521 C3 UNN A 119 18.164 -8.089 -1.623 1.00 0.12 C HETATM 1522 C4 UNN A 119 18.512 -6.862 -0.789 1.00 0.11 C HETATM 1523 O4 UNN A 119 18.070 -7.141 0.569 1.00 -0.39 O HETATM 1524 H27 UNN A 119 17.133 -7.296 0.570 1.00 0.21 H HETATM 1525 C5 UNN A 119 19.970 -6.502 -0.920 1.00 0.11 C HETATM 1526 C6 UNN A 119 20.310 -5.328 -0.050 1.00 0.07 C HETATM 1527 O6 UNN A 119 21.684 -5.061 -0.084 1.00 -0.39 O HETATM 1528 H31 UNN A 119 22.161 -5.821 0.228 1.00 0.21 H HETATM 1529 H29 UNN A 119 20.012 -5.549 0.986 1.00 0.06 H HETATM 1530 H30 UNN A 119 19.763 -4.444 -0.408 1.00 0.06 H HETATM 1531 O5 UNN A 119 20.705 -7.665 -0.489 1.00 -0.34 O HETATM 1532 H28 UNN A 119 20.210 -6.263 -1.967 1.00 0.06 H HETATM 1533 H26 UNN A 119 17.933 -6.005 -1.165 1.00 0.06 H HETATM 1534 O3 UNN A 119 16.892 -8.589 -1.421 1.00 -0.36 O HETATM 1535 C24 UNN A 119 15.906 -7.871 -2.176 1.00 0.08 C HETATM 1536 C25 UNN A 119 14.532 -8.483 -2.139 1.00 -0.03 C HETATM 1537 C26 UNN A 119 13.475 -7.845 -2.767 1.00 -0.07 C HETATM 1538 C27 UNN A 119 12.256 -8.488 -2.668 1.00 -0.08 C HETATM 1539 C28 UNN A 119 12.059 -9.727 -2.028 1.00 -0.04 C HETATM 1540 C29 UNN A 119 13.084 -10.371 -1.438 1.00 0.08 C HETATM 1541 C30 UNN A 119 14.328 -9.725 -1.549 1.00 -0.03 C HETATM 1542 H37 UNN A 119 15.194 -10.235 -1.143 1.00 0.05 H HETATM 1543 O31 UNN A 119 12.910 -11.629 -0.774 1.00 -0.32 O HETATM 1544 C32 UNN A 119 13.963 -12.435 -0.126 1.00 0.06 C HETATM 1545 H38 UNN A 119 13.518 -13.349 0.295 1.00 0.06 H HETATM 1546 H39 UNN A 119 14.430 -11.849 0.680 1.00 0.06 H HETATM 1547 H40 UNN A 119 14.726 -12.708 -0.870 1.00 0.06 H HETATM 1548 H36 UNN A 119 11.069 -10.168 -2.010 1.00 0.05 H HETATM 1549 H35 UNN A 119 11.393 -8.006 -3.113 1.00 0.06 H HETATM 1550 H34 UNN A 119 13.596 -6.908 -3.298 1.00 0.05 H HETATM 1551 H32 UNN A 119 16.237 -7.830 -3.224 1.00 0.07 H HETATM 1552 H33 UNN A 119 15.839 -6.850 -1.773 1.00 0.07 H HETATM 1553 H25 UNN A 119 18.251 -7.809 -2.683 1.00 0.07 H HETATM 1554 H23 UNN A 119 18.972 -9.588 -0.316 1.00 0.07 H HETATM 1555 H22 UNN A 119 20.814 -8.401 -2.446 1.00 0.09 H HETATM 1556 H19 UNN A 119 22.941 -8.488 -1.217 1.00 0.07 H HETATM 1557 UNK UNN A 119 22.943 -9.235 1.377 1.00 -0.39 O HETATM 1558 H21 UNN A 119 23.127 -8.314 1.235 1.00 0.21 H HETATM 1559 H20 UNN A 119 23.155 -11.065 0.404 1.00 0.06 H HETATM 1560 H6 UNN A 119 25.306 -8.960 0.018 1.00 0.06 H HETATM 1561 H5 UNN A 119 25.157 -11.892 -1.063 1.00 0.09 H HETATM 1562 H4 UNN A 119 27.243 -9.720 -1.020 1.00 0.19 H CONECT 1 2 7 8 9 CONECT 8 1 CONECT 9 1 CONECT 1478 1479 CONECT 1479 1478 1480 1484 CONECT 1480 1479 1481 1482 1483 CONECT 1481 1480 CONECT 1482 1480 CONECT 1483 1480 CONECT 1484 1479 1485 1562 CONECT 1485 1484 1486 1509 1561 CONECT 1486 1485 1487 1506 1560 CONECT 1487 1486 1488 1505 CONECT 1488 1487 1489 1504 CONECT 1489 1488 1490 1499 CONECT 1490 1489 1491 1503 CONECT 1491 1490 1492 1502 CONECT 1492 1491 1493 1501 CONECT 1493 1492 1494 1499 CONECT 1494 1493 1495 CONECT 1495 1494 1496 1497 1498 CONECT 1496 1495 CONECT 1497 1495 CONECT 1498 1495 CONECT 1499 1489 1493 1500 CONECT 1500 1499 CONECT 1501 1492 CONECT 1502 1491 CONECT 1503 1490 CONECT 1504 1488 CONECT 1505 1487 CONECT 1506 1486 1507 1557 1559 CONECT 1507 1506 1508 1516 1556 CONECT 1508 1507 1509 1510 1515 CONECT 1509 1485 1508 CONECT 1510 1508 1511 1513 1514 CONECT 1511 1510 1512 CONECT 1512 1511 CONECT 1513 1510 CONECT 1514 1510 CONECT 1515 1508 CONECT 1516 1507 1517 CONECT 1517 1516 1518 1531 1555 CONECT 1518 1517 1519 1521 1554 CONECT 1519 1518 1520 CONECT 1520 1519 CONECT 1521 1518 1522 1534 1553 CONECT 1522 1521 1523 1525 1533 CONECT 1523 1522 1524 CONECT 1524 1523 CONECT 1525 1522 1526 1531 1532 CONECT 1526 1525 1527 1529 1530 CONECT 1527 1526 1528 CONECT 1528 1527 CONECT 1529 1526 CONECT 1530 1526 CONECT 1531 1517 1525 CONECT 1532 1525 CONECT 1533 1522 CONECT 1534 1521 1535 CONECT 1535 1534 1536 1551 1552 CONECT 1536 1535 1537 1541 CONECT 1537 1536 1538 1550 CONECT 1538 1537 1539 1549 CONECT 1539 1538 1540 1548 CONECT 1540 1539 1541 1543 CONECT 1541 1536 1540 1542 CONECT 1542 1541 CONECT 1543 1540 1544 CONECT 1544 1543 1545 1546 1547 CONECT 1545 1544 CONECT 1546 1544 CONECT 1547 1544 CONECT 1548 1539 CONECT 1549 1538 CONECT 1550 1537 CONECT 1551 1535 CONECT 1552 1535 CONECT 1553 1521 CONECT 1554 1518 CONECT 1555 1517 CONECT 1556 1507 CONECT 1557 1506 1558 CONECT 1558 1557 CONECT 1559 1506 CONECT 1560 1486 CONECT 1561 1485 CONECT 1562 1484 MASTER 0 0 0 0 0 0 0 0 1561 1 88 11 END
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Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
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RCSB PDB
PDBbind
146aa, >1KJR_1|Chain... at 99%
2nn8
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PDBbind
138aa, >2NN8_1|Chain... at 100%
2xg3
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138aa, >2XG3_1|Chain... at 99%
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3ayc
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135aa, >3AYC_1|Chains... at 99%
3ayd
RCSB PDB
PDBbind
135aa, >3AYD_1|Chain... at 99%
3t1l
RCSB PDB
PDBbind
143aa, >3T1L_1|Chain... at 100%
3t1m
RCSB PDB
PDBbind
143aa, >3T1M_1|Chain... at 100%
4jc1
RCSB PDB
PDBbind
143aa, >4JC1_1|Chain... at 100%
4jck
RCSB PDB
PDBbind
143aa, >4JCK_1|Chain... at 100%
4lbl
RCSB PDB
PDBbind
138aa, >4LBL_1|Chain... at 98%
4lbo
RCSB PDB
PDBbind
138aa, >4LBO_1|Chain... at 100%
5e88
RCSB PDB
PDBbind
139aa, >5E88_1|Chain... at 100%
5e89
RCSB PDB
PDBbind
139aa, >5E89_1|Chain... at 100%
5e8a
RCSB PDB
PDBbind
139aa, >5E8A_1|Chain... at 100%
5nf9
RCSB PDB
PDBbind
147aa, >5NF9_1|Chain... at 100%
5nfa
RCSB PDB
PDBbind
147aa, >5NFA_1|Chain... at 100%
5oax
RCSB PDB
PDBbind
138aa, >5OAX_1|Chain... at 99%
5ody
RCSB PDB
PDBbind
138aa, >5ODY_1|Chain... at 100%
6eog
RCSB PDB
PDBbind
138aa, >6EOG_1|Chain... at 99%
6eol
RCSB PDB
PDBbind
138aa, >6EOL_1|Chain... at 99%
6g0v
RCSB PDB
PDBbind
138aa, >6G0V_1|Chain... at 99%
6qlu
RCSB PDB
PDBbind
138aa, >6QLU_1|Chain... at 100%
6qlt
RCSB PDB
PDBbind
138aa, >6QLT_1|Chain... at 100%
6qls
RCSB PDB
PDBbind
138aa, >6QLS_1|Chain... at 100%
6qlr
RCSB PDB
PDBbind
138aa, >6QLR_1|Chain... at 100%
6qlq
RCSB PDB
PDBbind
138aa, >6QLQ_1|Chain... at 100%
6qlp
RCSB PDB
PDBbind
138aa, >6QLP_1|Chain... at 100%
6qlo
RCSB PDB
PDBbind
138aa, >6QLO_1|Chain... at 100%
6qln
RCSB PDB
PDBbind
138aa, >6QLN_1|Chain... at 100%
6qge
RCSB PDB
PDBbind
138aa, >6QGE_1|Chain... at 100%
6qgf
RCSB PDB
PDBbind
138aa, >6QGF_1|Chain... at 100%
6i78
RCSB PDB
PDBbind
138aa, >6I78_1|Chain... at 100%
6i77
RCSB PDB
PDBbind
138aa, >6I77_1|Chain... at 100%
6i76
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PDBbind
138aa, >6I76_1|Chain... at 100%
6i75
RCSB PDB
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138aa, >6I75_1|Chain... at 100%
6i74
RCSB PDB
PDBbind
138aa, >6I74_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5nfb
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Galectin-3
Ligand Name
8VT
EC.Number
E.C.-.-.-.-
Resolution
1.59(Å)
Affinity (Kd/Ki/IC50)
Kd=0.77uM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) Biochem. Biophys. Res. Commun. Vol. 489: pp. 281-286
Ligand Properties
Formula
C
3
0
H
4
0
N
2
O
1
3
Molecular Weight
636.644
Exact Mass
636.253
No. of atoms
85
No. of bonds
88
Polar Surface Area
214.73
LOGP Value
-1.10 (
Computed with XLOGP3
)
-0.79 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 7
No. of Hydrogen Bond Acceptors: 7
No. of Rotatable Bonds: 19
No. of Nitrogen and Oxygen Atoms: 15
No. of Rings: 4
Canonical SMILES
COc1cccc(c1)CO[C@@H]1[C@@H](O)[C@H](O[C@@H]2[C@@H](CO)O[C@H]([C@@H]([C@H]2O)NC(=O)c2cccc(c2)OC)NC(=O)C)O[C@@H]([C@@H]1O)CO
InChI String
InChI=1S/C30H40N2O13/c1-15(35)31-29-22(32-28(39)17-7-5-9-19(11-17)41-3)24(37)26(21(13-34)43-29)45-30-25(38)27(23(36)20(12-33)44-30)42-14-16-6-4-8-18(10-16)40-2/h4-11,20-27,29-30,33-34,36-38H,12-14H2,1-3H3,(H,31,35)(H,32,39)/t20-,21-,22-,23+,24-,25-,26-,27+,29-,30+/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P17931
Entrez Gene ID
NCBI Entrez Gene ID:
3958
ASD
Information of known allosteric effects of PDB entries
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