Browse entries in the PDBbind-CN Database
HEADER 6EOG_COMPLEX COMPND 6EOG_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 138 MET 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 BKK A 417 49 ATOM 1 N MET A 113 5.636 5.994 9.941 1.00 20.19 N ATOM 2 CA MET A 113 5.633 4.526 9.796 1.00 23.18 C ATOM 3 C MET A 113 5.232 4.129 8.358 1.00 30.74 C ATOM 4 O MET A 113 6.190 3.822 7.627 1.00 40.54 O ATOM 5 CB MET A 113 4.938 3.730 10.962 1.00 41.24 C ATOM 6 CG MET A 113 5.733 2.462 11.404 1.00 37.86 C ATOM 7 SD MET A 113 5.954 1.992 13.159 1.00 71.15 S ATOM 8 CE MET A 113 5.772 3.567 14.015 1.00 67.39 C ATOM 9 HN3 MET A 113 4.685 6.363 9.739 1.00 0.00 H ATOM 10 HN2 MET A 113 6.318 6.406 9.272 1.00 0.00 H ATOM 11 HN1 MET A 113 5.908 6.245 10.913 1.00 0.00 H ATOM 12 N LEU A 114 3.965 4.183 7.899 1.00 24.17 N ATOM 13 CA LEU A 114 3.639 3.786 6.492 1.00 20.60 C ATOM 14 C LEU A 114 3.095 5.001 5.717 1.00 18.53 C ATOM 15 O LEU A 114 2.478 5.889 6.347 1.00 63.11 O ATOM 16 CB LEU A 114 2.654 2.616 6.505 1.00 19.16 C ATOM 17 CG LEU A 114 3.052 1.309 7.157 1.00 21.52 C ATOM 18 CD1 LEU A 114 1.924 0.298 7.110 1.00 18.74 C ATOM 19 CD2 LEU A 114 4.276 0.718 6.483 1.00 25.45 C ATOM 20 H LEU A 114 3.204 4.505 8.531 1.00 0.00 H ATOM 21 N ILE A 115 3.318 5.083 4.410 1.00 16.40 N ATOM 22 CA ILE A 115 2.737 6.120 3.527 1.00 16.14 C ATOM 23 C ILE A 115 1.269 5.839 3.259 1.00 16.05 C ATOM 24 O ILE A 115 0.942 4.770 2.807 1.00 16.25 O ATOM 25 CB ILE A 115 3.506 6.154 2.167 1.00 16.64 C ATOM 26 CG1 ILE A 115 4.893 6.729 2.366 1.00 20.62 C ATOM 27 CG2 ILE A 115 2.762 6.983 1.133 1.00 17.47 C ATOM 28 CD1 ILE A 115 4.987 8.161 2.838 1.00 27.09 C ATOM 29 H ILE A 115 3.942 4.372 3.978 1.00 0.00 H ATOM 30 N VAL A 116 0.392 6.838 3.457 1.00 15.10 N ATOM 31 CA VAL A 116 -1.002 6.756 3.063 1.00 12.88 C ATOM 32 C VAL A 116 -1.197 7.580 1.802 1.00 12.97 C ATOM 33 O VAL A 116 -0.721 8.709 1.709 1.00 16.52 O ATOM 34 CB VAL A 116 -1.836 7.242 4.277 1.00 13.61 C ATOM 35 CG1 VAL A 116 -3.289 7.439 3.981 1.00 7.47 C ATOM 36 CG2 VAL A 116 -1.866 6.117 5.304 1.00 17.38 C ATOM 37 H VAL A 116 0.728 7.710 3.914 1.00 0.00 H ATOM 38 N PRO A 117 -1.984 7.080 0.833 1.00 13.14 N ATOM 39 CA PRO A 117 -2.675 5.812 0.871 1.00 13.59 C ATOM 40 C PRO A 117 -1.750 4.600 0.792 1.00 13.30 C ATOM 41 O PRO A 117 -0.767 4.655 0.085 1.00 17.49 O ATOM 42 CB PRO A 117 -3.659 5.849 -0.327 1.00 16.55 C ATOM 43 CG PRO A 117 -3.670 7.216 -0.836 1.00 15.38 C ATOM 44 CD PRO A 117 -2.405 7.875 -0.329 1.00 16.89 C ATOM 45 N TYR A 118 -2.120 3.540 1.507 1.00 11.60 N ATOM 46 CA TYR A 118 -1.284 2.325 1.604 1.00 11.75 C ATOM 47 C TYR A 118 -2.054 1.191 1.008 1.00 12.36 C ATOM 48 O TYR A 118 -3.243 1.026 1.253 1.00 14.28 O ATOM 49 CB TYR A 118 -1.052 2.022 3.076 1.00 11.36 C ATOM 50 CG TYR A 118 -0.127 0.889 3.294 1.00 12.02 C ATOM 51 CD1 TYR A 118 1.239 1.037 3.150 1.00 16.37 C ATOM 52 CD2 TYR A 118 -0.637 -0.408 3.656 1.00 13.52 C ATOM 53 CE1 TYR A 118 2.086 -0.036 3.262 1.00 20.26 C ATOM 54 CE2 TYR A 118 0.233 -1.483 3.815 1.00 15.71 C ATOM 55 CZ TYR A 118 1.588 -1.305 3.658 1.00 18.35 C ATOM 56 OH TYR A 118 2.477 -2.348 3.795 1.00 22.87 O ATOM 57 HH TYR A 118 3.398 -2.017 3.645 1.00 0.00 H ATOM 58 H TYR A 118 -3.027 3.568 2.014 1.00 0.00 H ATOM 59 N ASN A 119 -1.393 0.350 0.259 1.00 11.93 N ATOM 60 CA ASN A 119 -1.977 -0.859 -0.275 1.00 12.60 C ATOM 61 C ASN A 119 -1.366 -2.110 0.419 1.00 12.89 C ATOM 62 O ASN A 119 -0.152 -2.376 0.397 1.00 15.42 O ATOM 63 CB ASN A 119 -1.683 -1.028 -1.759 1.00 15.62 C ATOM 64 CG ASN A 119 -2.254 -2.356 -2.264 1.00 15.68 C ATOM 65 OD1 ASN A 119 -3.481 -2.565 -2.281 1.00 15.07 O ATOM 66 ND2 ASN A 119 -1.350 -3.332 -2.625 1.00 19.90 N ATOM 67 HD22 ASN A 119 -0.330 -3.130 -2.602 1.00 0.00 H ATOM 68 HD21 ASN A 119 -1.688 -4.270 -2.921 1.00 0.00 H ATOM 69 H ASN A 119 -0.399 0.560 0.036 1.00 0.00 H ATOM 70 N LEU A 120 -2.244 -2.914 1.027 1.00 11.24 N ATOM 71 CA LEU A 120 -1.859 -4.196 1.622 1.00 11.59 C ATOM 72 C LEU A 120 -2.394 -5.297 0.704 1.00 10.00 C ATOM 73 O LEU A 120 -3.571 -5.542 0.618 1.00 8.98 O ATOM 74 CB LEU A 120 -2.520 -4.340 2.999 1.00 11.03 C ATOM 75 CG LEU A 120 -2.231 -5.635 3.771 1.00 12.75 C ATOM 76 CD1 LEU A 120 -0.754 -5.841 4.085 1.00 15.44 C ATOM 77 CD2 LEU A 120 -3.086 -5.699 5.056 1.00 14.19 C ATOM 78 H LEU A 120 -3.240 -2.618 1.080 1.00 0.00 H ATOM 79 N PRO A 121 -1.487 -6.021 0.017 1.00 10.28 N ATOM 80 CA PRO A 121 -1.935 -7.162 -0.787 1.00 9.48 C ATOM 81 C PRO A 121 -2.549 -8.215 0.102 1.00 8.06 C ATOM 82 O PRO A 121 -2.013 -8.458 1.227 1.00 10.11 O ATOM 83 CB PRO A 121 -0.642 -7.705 -1.419 1.00 11.57 C ATOM 84 CG PRO A 121 0.296 -6.566 -1.369 1.00 14.76 C ATOM 85 CD PRO A 121 -0.030 -5.803 -0.115 1.00 14.46 C ATOM 86 N LEU A 122 -3.608 -8.886 -0.333 1.00 7.33 N ATOM 87 CA LEU A 122 -4.259 -9.977 0.367 1.00 7.74 C ATOM 88 C LEU A 122 -4.130 -11.207 -0.553 1.00 6.75 C ATOM 89 O LEU A 122 -4.996 -11.425 -1.413 1.00 8.00 O ATOM 90 CB LEU A 122 -5.704 -9.637 0.675 1.00 7.26 C ATOM 91 CG LEU A 122 -5.945 -8.340 1.439 1.00 7.69 C ATOM 92 CD1 LEU A 122 -7.414 -7.998 1.525 1.00 9.18 C ATOM 93 CD2 LEU A 122 -5.276 -8.311 2.801 1.00 10.05 C ATOM 94 H LEU A 122 -4.004 -8.606 -1.253 1.00 0.00 H ATOM 95 N PRO A 123 -3.050 -11.957 -0.455 1.00 7.42 N ATOM 96 CA PRO A 123 -2.773 -12.973 -1.503 1.00 7.46 C ATOM 97 C PRO A 123 -3.794 -14.050 -1.590 1.00 7.46 C ATOM 98 O PRO A 123 -4.065 -14.710 -0.597 1.00 8.96 O ATOM 99 CB PRO A 123 -1.396 -13.508 -1.095 1.00 8.60 C ATOM 100 CG PRO A 123 -0.761 -12.383 -0.287 1.00 8.30 C ATOM 101 CD PRO A 123 -1.911 -11.775 0.469 1.00 7.77 C ATOM 102 N GLY A 124 -4.417 -14.283 -2.738 1.00 8.10 N ATOM 103 CA GLY A 124 -5.466 -15.247 -2.836 1.00 8.49 C ATOM 104 C GLY A 124 -6.756 -14.803 -2.195 1.00 7.48 C ATOM 105 O GLY A 124 -7.641 -15.635 -1.939 1.00 8.87 O ATOM 106 H GLY A 124 -4.135 -13.751 -3.586 1.00 0.00 H ATOM 107 N GLY A 125 -6.897 -13.501 -1.948 1.00 8.03 N ATOM 108 CA GLY A 125 -8.095 -12.935 -1.421 1.00 7.80 C ATOM 109 C GLY A 125 -8.301 -13.229 0.058 1.00 7.41 C ATOM 110 O GLY A 125 -7.381 -13.620 0.785 1.00 9.73 O ATOM 111 H GLY A 125 -6.096 -12.869 -2.149 1.00 0.00 H ATOM 112 N VAL A 126 -9.516 -12.982 0.490 1.00 8.27 N ATOM 113 CA VAL A 126 -9.861 -13.189 1.892 1.00 8.42 C ATOM 114 C VAL A 126 -10.636 -14.502 2.027 1.00 8.39 C ATOM 115 O VAL A 126 -11.061 -15.107 1.045 1.00 9.55 O ATOM 116 CB VAL A 126 -10.636 -11.989 2.478 1.00 8.82 C ATOM 117 CG1 VAL A 126 -9.837 -10.727 2.329 1.00 9.65 C ATOM 118 CG2 VAL A 126 -12.051 -11.914 1.952 1.00 9.94 C ATOM 119 H VAL A 126 -10.239 -12.636 -0.173 1.00 0.00 H ATOM 120 N VAL A 127 -10.777 -14.941 3.261 1.00 9.86 N ATOM 121 CA VAL A 127 -11.360 -16.243 3.609 1.00 10.82 C ATOM 122 C VAL A 127 -11.786 -16.143 5.081 1.00 9.45 C ATOM 123 O VAL A 127 -11.179 -15.399 5.856 1.00 9.93 O ATOM 124 CB VAL A 127 -10.301 -17.330 3.425 1.00 12.16 C ATOM 125 CG1 VAL A 127 -9.114 -17.228 4.354 1.00 13.82 C ATOM 126 CG2 VAL A 127 -10.889 -18.723 3.518 1.00 14.61 C ATOM 127 H VAL A 127 -10.456 -14.327 4.037 1.00 0.00 H ATOM 128 N PRO A 128 -12.873 -16.878 5.480 1.00 10.02 N ATOM 129 CA PRO A 128 -13.184 -16.875 6.874 1.00 11.16 C ATOM 130 C PRO A 128 -11.985 -17.262 7.708 1.00 11.33 C ATOM 131 O PRO A 128 -11.174 -18.115 7.338 1.00 12.94 O ATOM 132 CB PRO A 128 -14.342 -17.847 6.983 1.00 13.03 C ATOM 133 CG PRO A 128 -15.054 -17.662 5.602 1.00 14.94 C ATOM 134 CD PRO A 128 -13.865 -17.621 4.688 1.00 12.12 C ATOM 135 N ARG A 129 -11.867 -16.607 8.870 1.00 11.85 N ATOM 136 CA ARG A 129 -10.792 -16.751 9.899 1.00 12.90 C ATOM 137 C ARG A 129 -9.633 -15.856 9.635 1.00 12.67 C ATOM 138 O ARG A 129 -8.677 -15.771 10.449 1.00 14.97 O ATOM 139 CB ARG A 129 -10.270 -18.158 10.159 1.00 16.72 C ATOM 140 CG ARG A 129 -11.406 -19.076 10.449 1.00 17.29 C ATOM 141 CD ARG A 129 -11.060 -20.391 11.124 1.00 25.13 C ATOM 142 NE ARG A 129 -10.544 -20.152 12.463 1.00 24.01 N ATOM 143 CZ ARG A 129 -11.315 -19.821 13.520 1.00 24.77 C ATOM 144 NH1 ARG A 129 -12.629 -19.747 13.389 1.00 33.66 N ATOM 145 NH2 ARG A 129 -10.785 -19.519 14.698 1.00 25.47 N ATOM 146 HE ARG A 129 -9.519 -20.242 12.615 1.00 0.00 H ATOM 147 HH12 ARG A 129 -13.219 -19.492 14.206 1.00 0.00 H ATOM 148 HH11 ARG A 129 -13.072 -19.944 12.469 1.00 0.00 H ATOM 149 HH22 ARG A 129 -11.402 -19.267 15.497 1.00 0.00 H ATOM 150 HH21 ARG A 129 -9.753 -19.534 14.823 1.00 0.00 H ATOM 151 H ARG A 129 -12.613 -15.914 9.082 1.00 0.00 H ATOM 152 N MET A 130 -9.632 -15.104 8.536 1.00 10.67 N ATOM 153 CA MET A 130 -8.602 -14.137 8.290 1.00 9.42 C ATOM 154 C MET A 130 -8.915 -12.840 9.076 1.00 8.73 C ATOM 155 O MET A 130 -10.006 -12.296 8.995 1.00 8.75 O ATOM 156 CB MET A 130 -8.521 -13.835 6.798 1.00 9.91 C ATOM 157 CG MET A 130 -7.268 -13.138 6.422 1.00 9.60 C ATOM 158 SD MET A 130 -7.180 -13.051 4.643 1.00 9.94 S ATOM 159 CE MET A 130 -5.846 -11.879 4.366 1.00 13.55 C ATOM 160 H MET A 130 -10.396 -15.221 7.840 1.00 0.00 H ATOM 161 N LEU A 131 -7.919 -12.394 9.839 1.00 10.26 N ATOM 162 CA LEU A 131 -8.036 -11.204 10.701 1.00 9.82 C ATOM 163 C LEU A 131 -7.021 -10.133 10.185 1.00 9.07 C ATOM 164 O LEU A 131 -5.860 -10.413 10.167 1.00 11.88 O ATOM 165 CB LEU A 131 -7.682 -11.587 12.140 1.00 10.66 C ATOM 166 CG LEU A 131 -7.734 -10.429 13.158 1.00 12.09 C ATOM 167 CD1 LEU A 131 -9.130 -9.918 13.358 1.00 11.70 C ATOM 168 CD2 LEU A 131 -7.064 -10.868 14.449 1.00 15.21 C ATOM 169 H LEU A 131 -7.016 -12.910 9.826 1.00 0.00 H ATOM 170 N ILE A 132 -7.556 -8.961 9.851 1.00 8.78 N ATOM 171 CA ILE A 132 -6.718 -7.852 9.412 1.00 8.72 C ATOM 172 C ILE A 132 -6.686 -6.872 10.611 1.00 9.89 C ATOM 173 O ILE A 132 -7.706 -6.493 11.150 1.00 11.80 O ATOM 174 CB ILE A 132 -7.305 -7.214 8.154 1.00 11.60 C ATOM 175 CG1 ILE A 132 -7.357 -8.289 6.926 1.00 16.43 C ATOM 176 CG2 ILE A 132 -6.525 -5.941 7.796 1.00 18.94 C ATOM 177 CD1 ILE A 132 -8.674 -9.083 6.801 1.00 17.33 C ATOM 178 H ILE A 132 -8.587 -8.835 9.904 1.00 0.00 H ATOM 179 N THR A 133 -5.484 -6.422 10.927 1.00 10.14 N ATOM 180 CA THR A 133 -5.285 -5.428 12.024 1.00 10.44 C ATOM 181 C THR A 133 -4.558 -4.205 11.486 1.00 11.05 C ATOM 182 O THR A 133 -3.521 -4.304 10.861 1.00 13.10 O ATOM 183 CB THR A 133 -4.442 -6.032 13.154 1.00 11.56 C ATOM 184 OG1 THR A 133 -5.110 -7.192 13.647 1.00 12.22 O ATOM 185 CG2 THR A 133 -4.272 -5.046 14.276 1.00 13.54 C ATOM 186 HG1 THR A 133 -4.576 -7.593 14.378 1.00 0.00 H ATOM 187 H THR A 133 -4.657 -6.768 10.399 1.00 0.00 H ATOM 188 N ILE A 134 -5.199 -3.054 11.721 1.00 10.74 N ATOM 189 CA ILE A 134 -4.703 -1.737 11.314 1.00 9.90 C ATOM 190 C ILE A 134 -4.447 -0.908 12.601 1.00 9.88 C ATOM 191 O ILE A 134 -5.354 -0.717 13.411 1.00 11.08 O ATOM 192 CB ILE A 134 -5.734 -0.988 10.377 1.00 10.96 C ATOM 193 CG1 ILE A 134 -6.166 -1.779 9.051 1.00 13.26 C ATOM 194 CG2 ILE A 134 -5.239 0.408 10.014 1.00 11.76 C ATOM 195 CD1 ILE A 134 -7.483 -2.546 9.103 1.00 13.04 C ATOM 196 H ILE A 134 -6.108 -3.097 12.225 1.00 0.00 H ATOM 197 N LEU A 135 -3.251 -0.378 12.765 1.00 9.69 N ATOM 198 CA LEU A 135 -2.895 0.519 13.883 1.00 8.59 C ATOM 199 C LEU A 135 -2.500 1.855 13.314 1.00 9.04 C ATOM 200 O LEU A 135 -1.726 1.958 12.333 1.00 9.18 O ATOM 201 CB LEU A 135 -1.723 -0.032 14.698 1.00 10.84 C ATOM 202 CG LEU A 135 -2.017 -1.268 15.509 1.00 12.89 C ATOM 203 CD1 LEU A 135 -0.761 -2.064 15.896 1.00 18.27 C ATOM 204 CD2 LEU A 135 -2.802 -0.878 16.724 1.00 16.15 C ATOM 205 H LEU A 135 -2.515 -0.605 12.066 1.00 0.00 H ATOM 206 N GLY A 136 -3.053 2.924 13.864 1.00 9.28 N ATOM 207 CA GLY A 136 -2.647 4.254 13.483 1.00 9.52 C ATOM 208 C GLY A 136 -3.165 5.261 14.459 1.00 9.57 C ATOM 209 O GLY A 136 -3.681 4.893 15.525 1.00 11.27 O ATOM 210 H GLY A 136 -3.794 2.803 14.584 1.00 0.00 H ATOM 211 N THR A 137 -2.977 6.537 14.131 1.00 9.42 N ATOM 212 CA THR A 137 -3.437 7.643 14.944 1.00 8.54 C ATOM 213 C THR A 137 -4.240 8.577 14.061 1.00 7.86 C ATOM 214 O THR A 137 -3.789 8.914 12.930 1.00 9.52 O ATOM 215 CB THR A 137 -2.259 8.385 15.606 1.00 8.76 C ATOM 216 OG1 THR A 137 -1.582 7.444 16.451 1.00 13.01 O ATOM 217 CG2 THR A 137 -2.704 9.528 16.446 1.00 10.42 C ATOM 218 HG1 THR A 137 -0.817 7.890 16.893 1.00 0.00 H ATOM 219 H THR A 137 -2.474 6.750 13.246 1.00 0.00 H ATOM 220 N VAL A 138 -5.398 9.041 14.494 1.00 7.91 N ATOM 221 CA VAL A 138 -6.191 9.963 13.737 1.00 8.11 C ATOM 222 C VAL A 138 -5.498 11.314 13.780 1.00 8.66 C ATOM 223 O VAL A 138 -5.110 11.780 14.868 1.00 10.13 O ATOM 224 CB VAL A 138 -7.647 10.032 14.234 1.00 8.60 C ATOM 225 CG1 VAL A 138 -8.396 11.054 13.416 1.00 9.47 C ATOM 226 CG2 VAL A 138 -8.281 8.685 14.261 1.00 9.18 C ATOM 227 H VAL A 138 -5.748 8.725 15.421 1.00 0.00 H ATOM 228 N LYS A 139 -5.391 12.002 12.637 1.00 9.06 N ATOM 229 CA LYS A 139 -4.738 13.306 12.634 1.00 10.83 C ATOM 230 C LYS A 139 -5.656 14.328 13.369 1.00 10.65 C ATOM 231 O LYS A 139 -6.841 14.137 13.524 1.00 10.96 O ATOM 232 CB LYS A 139 -4.390 13.708 11.201 1.00 11.00 C ATOM 233 CG LYS A 139 -3.273 12.901 10.534 1.00 12.41 C ATOM 234 CD LYS A 139 -3.090 13.363 9.066 1.00 14.78 C ATOM 235 CE LYS A 139 -1.935 12.783 8.334 1.00 19.44 C ATOM 236 NZ LYS A 139 -1.703 13.399 6.993 1.00 29.55 N ATOM 237 HZ1 LYS A 139 -2.546 13.263 6.400 1.00 0.00 H ATOM 238 HZ2 LYS A 139 -1.519 14.416 7.107 1.00 0.00 H ATOM 239 HZ3 LYS A 139 -0.883 12.945 6.542 1.00 0.00 H ATOM 240 H LYS A 139 -5.772 11.608 11.753 1.00 0.00 H ATOM 241 N PRO A 140 -5.059 15.470 13.756 1.00 12.92 N ATOM 242 CA PRO A 140 -5.845 16.556 14.271 1.00 13.21 C ATOM 243 C PRO A 140 -6.801 17.053 13.233 1.00 14.02 C ATOM 244 O PRO A 140 -6.448 17.075 12.065 1.00 20.07 O ATOM 245 CB PRO A 140 -4.785 17.610 14.589 1.00 14.24 C ATOM 246 CG PRO A 140 -3.573 16.746 15.033 1.00 14.02 C ATOM 247 CD PRO A 140 -3.614 15.698 13.958 1.00 12.69 C ATOM 248 N ASN A 141 -8.021 17.352 13.625 1.00 14.85 N ATOM 249 CA ASN A 141 -8.988 17.910 12.679 1.00 13.85 C ATOM 250 C ASN A 141 -9.196 17.005 11.438 1.00 15.88 C ATOM 251 O ASN A 141 -9.618 17.485 10.375 1.00 13.13 O ATOM 252 CB ASN A 141 -8.544 19.301 12.193 1.00 17.98 C ATOM 253 CG ASN A 141 -8.403 20.286 13.327 1.00 28.62 C ATOM 254 OD1 ASN A 141 -7.283 20.686 13.708 1.00 38.07 O ATOM 255 ND2 ASN A 141 -9.542 20.656 13.909 1.00 33.63 N ATOM 256 HD22 ASN A 141 -10.450 20.294 13.553 1.00 0.00 H ATOM 257 HD21 ASN A 141 -9.524 21.307 14.720 1.00 0.00 H ATOM 258 H ASN A 141 -8.300 17.191 14.614 1.00 0.00 H ATOM 259 N ALA A 142 -8.967 15.706 11.573 1.00 14.65 N ATOM 260 CA ALA A 142 -9.387 14.746 10.564 1.00 11.89 C ATOM 261 C ALA A 142 -10.798 15.030 10.031 1.00 11.60 C ATOM 262 O ALA A 142 -11.715 15.389 10.739 1.00 12.61 O ATOM 263 CB ALA A 142 -9.309 13.349 11.146 1.00 11.57 C ATOM 264 H ALA A 142 -8.474 15.364 12.423 1.00 0.00 H ATOM 265 N ASN A 143 -10.954 14.718 8.765 1.00 11.08 N ATOM 266 CA ASN A 143 -12.234 14.733 8.103 1.00 10.70 C ATOM 267 C ASN A 143 -12.743 13.347 7.710 1.00 9.79 C ATOM 268 O ASN A 143 -13.926 13.105 7.804 1.00 10.08 O ATOM 269 CB ASN A 143 -12.159 15.653 6.891 1.00 11.22 C ATOM 270 CG ASN A 143 -13.440 15.742 6.155 1.00 11.76 C ATOM 271 OD1 ASN A 143 -14.431 16.210 6.647 1.00 14.73 O ATOM 272 ND2 ASN A 143 -13.431 15.142 4.958 1.00 18.22 N ATOM 273 HD22 ASN A 143 -12.544 14.753 4.578 1.00 0.00 H ATOM 274 HD21 ASN A 143 -14.311 15.065 4.408 1.00 0.00 H ATOM 275 H ASN A 143 -10.114 14.447 8.214 1.00 0.00 H ATOM 276 N ARG A 144 -11.860 12.454 7.266 1.00 10.03 N ATOM 277 CA ARG A 144 -12.325 11.162 6.710 1.00 9.71 C ATOM 278 C ARG A 144 -11.192 10.119 6.812 1.00 8.92 C ATOM 279 O ARG A 144 -10.051 10.504 6.774 1.00 11.06 O ATOM 280 CB ARG A 144 -12.709 11.364 5.243 1.00 11.86 C ATOM 281 CG ARG A 144 -11.578 11.787 4.316 1.00 14.46 C ATOM 282 CD ARG A 144 -11.991 12.100 2.864 1.00 15.24 C ATOM 283 NE ARG A 144 -10.789 12.340 2.076 1.00 19.36 N ATOM 284 CZ ARG A 144 -10.723 12.269 0.747 1.00 22.23 C ATOM 285 NH1 ARG A 144 -11.818 12.094 0.024 1.00 24.23 N ATOM 286 NH2 ARG A 144 -9.573 12.317 0.188 1.00 23.53 N ATOM 287 HE ARG A 144 -9.918 12.585 2.589 1.00 0.00 H ATOM 288 HH12 ARG A 144 -11.754 12.040 -1.013 1.00 0.00 H ATOM 289 HH11 ARG A 144 -12.743 12.010 0.493 1.00 0.00 H ATOM 290 HH22 ARG A 144 -9.496 12.263 -0.848 1.00 0.00 H ATOM 291 HH21 ARG A 144 -8.716 12.410 0.769 1.00 0.00 H ATOM 292 H ARG A 144 -10.842 12.664 7.310 1.00 0.00 H ATOM 293 N ILE A 145 -11.645 8.856 6.912 1.00 9.06 N ATOM 294 CA ILE A 145 -10.745 7.702 6.824 1.00 8.60 C ATOM 295 C ILE A 145 -11.494 6.712 5.908 1.00 8.04 C ATOM 296 O ILE A 145 -12.696 6.634 5.961 1.00 8.23 O ATOM 297 CB ILE A 145 -10.509 7.091 8.213 1.00 10.35 C ATOM 298 CG1 ILE A 145 -9.903 8.124 9.158 1.00 11.26 C ATOM 299 CG2 ILE A 145 -9.674 5.832 8.138 1.00 11.62 C ATOM 300 CD1 ILE A 145 -9.931 7.717 10.588 1.00 12.33 C ATOM 301 H ILE A 145 -12.662 8.694 7.056 1.00 0.00 H ATOM 302 N ALA A 146 -10.722 5.896 5.175 1.00 8.40 N ATOM 303 CA ALA A 146 -11.361 4.812 4.459 1.00 7.19 C ATOM 304 C ALA A 146 -10.476 3.572 4.400 1.00 7.40 C ATOM 305 O ALA A 146 -9.284 3.616 4.151 1.00 8.45 O ATOM 306 CB ALA A 146 -11.690 5.198 3.022 1.00 9.48 C ATOM 307 H ALA A 146 -9.693 6.038 5.122 1.00 0.00 H ATOM 308 N LEU A 147 -11.173 2.441 4.616 1.00 7.05 N ATOM 309 CA LEU A 147 -10.647 1.111 4.249 1.00 6.79 C ATOM 310 C LEU A 147 -11.435 0.627 3.052 1.00 7.66 C ATOM 311 O LEU A 147 -12.626 0.649 3.066 1.00 9.02 O ATOM 312 CB LEU A 147 -10.815 0.098 5.393 1.00 7.54 C ATOM 313 CG LEU A 147 -10.255 0.427 6.699 1.00 12.60 C ATOM 314 CD1 LEU A 147 -10.461 -0.675 7.692 1.00 13.76 C ATOM 315 CD2 LEU A 147 -8.933 0.915 6.759 1.00 15.41 C ATOM 316 H LEU A 147 -12.113 2.506 5.056 1.00 0.00 H ATOM 317 N ASP A 148 -10.708 0.128 2.068 1.00 7.18 N ATOM 318 CA ASP A 148 -11.338 -0.392 0.803 1.00 7.49 C ATOM 319 C ASP A 148 -10.777 -1.778 0.533 1.00 7.45 C ATOM 320 O ASP A 148 -9.659 -1.976 0.088 1.00 8.13 O ATOM 321 CB ASP A 148 -11.019 0.538 -0.349 1.00 7.90 C ATOM 322 CG ASP A 148 -11.819 1.853 -0.279 1.00 8.49 C ATOM 323 OD1 ASP A 148 -12.991 1.804 -0.534 1.00 11.48 O ATOM 324 OD2 ASP A 148 -11.173 2.864 0.124 1.00 11.51 O ATOM 325 H ASP A 148 -9.674 0.093 2.170 1.00 0.00 H ATOM 326 N PHE A 149 -11.622 -2.790 0.795 1.00 6.87 N ATOM 327 CA PHE A 149 -11.303 -4.193 0.393 1.00 6.91 C ATOM 328 C PHE A 149 -11.745 -4.341 -1.087 1.00 7.32 C ATOM 329 O PHE A 149 -12.948 -4.259 -1.340 1.00 7.89 O ATOM 330 CB PHE A 149 -12.041 -5.180 1.268 1.00 7.99 C ATOM 331 CG PHE A 149 -11.506 -5.268 2.697 1.00 7.99 C ATOM 332 CD1 PHE A 149 -11.950 -4.377 3.695 1.00 8.26 C ATOM 333 CD2 PHE A 149 -10.538 -6.194 3.000 1.00 8.86 C ATOM 334 CE1 PHE A 149 -11.458 -4.478 4.981 1.00 9.49 C ATOM 335 CE2 PHE A 149 -10.069 -6.299 4.276 1.00 10.57 C ATOM 336 CZ PHE A 149 -10.466 -5.450 5.244 1.00 10.43 C ATOM 337 H PHE A 149 -12.516 -2.592 1.288 1.00 0.00 H ATOM 338 N GLN A 150 -10.768 -4.464 -1.962 1.00 6.30 N ATOM 339 CA GLN A 150 -10.957 -4.342 -3.391 1.00 6.54 C ATOM 340 C GLN A 150 -10.938 -5.685 -4.084 1.00 6.45 C ATOM 341 O GLN A 150 -10.132 -6.528 -3.786 1.00 7.76 O ATOM 342 CB GLN A 150 -9.898 -3.460 -3.976 1.00 9.57 C ATOM 343 CG GLN A 150 -9.603 -2.138 -3.427 1.00 13.09 C ATOM 344 CD GLN A 150 -10.169 -1.044 -4.290 1.00 15.74 C ATOM 345 OE1 GLN A 150 -10.047 0.048 -3.865 1.00 24.92 O ATOM 346 NE2 GLN A 150 -10.850 -1.297 -5.492 1.00 15.34 N ATOM 347 HE22 GLN A 150 -10.942 -2.272 -5.842 1.00 0.00 H ATOM 348 HE21 GLN A 150 -11.263 -0.509 -6.032 1.00 0.00 H ATOM 349 H GLN A 150 -9.810 -4.659 -1.607 1.00 0.00 H ATOM 350 N ARG A 151 -11.840 -5.822 -5.074 1.00 7.31 N ATOM 351 CA ARG A 151 -11.831 -6.919 -6.050 1.00 7.03 C ATOM 352 C ARG A 151 -11.654 -6.266 -7.439 1.00 7.10 C ATOM 353 O ARG A 151 -12.600 -5.770 -8.032 1.00 6.78 O ATOM 354 CB ARG A 151 -13.139 -7.708 -5.994 1.00 7.26 C ATOM 355 CG ARG A 151 -13.295 -8.761 -7.080 1.00 7.24 C ATOM 356 CD ARG A 151 -14.502 -9.627 -6.921 1.00 8.36 C ATOM 357 NE ARG A 151 -14.644 -10.570 -8.026 1.00 8.24 N ATOM 358 CZ ARG A 151 -15.422 -10.388 -9.072 1.00 9.28 C ATOM 359 NH1 ARG A 151 -16.336 -9.423 -9.141 1.00 9.50 N ATOM 360 NH2 ARG A 151 -15.358 -11.231 -10.096 1.00 9.71 N ATOM 361 HE ARG A 151 -14.090 -11.449 -7.984 1.00 0.00 H ATOM 362 HH12 ARG A 151 -16.925 -9.324 -9.993 1.00 0.00 H ATOM 363 HH11 ARG A 151 -16.462 -8.768 -8.343 1.00 0.00 H ATOM 364 HH22 ARG A 151 -15.971 -11.091 -10.924 1.00 0.00 H ATOM 365 HH21 ARG A 151 -14.695 -12.032 -10.070 1.00 0.00 H ATOM 366 H ARG A 151 -12.590 -5.106 -5.152 1.00 0.00 H ATOM 367 N GLY A 152 -10.402 -6.127 -7.872 1.00 7.52 N ATOM 368 CA GLY A 152 -10.121 -5.326 -9.031 1.00 7.45 C ATOM 369 C GLY A 152 -10.591 -3.892 -8.803 1.00 7.79 C ATOM 370 O GLY A 152 -10.287 -3.300 -7.768 1.00 9.28 O ATOM 371 H GLY A 152 -9.625 -6.600 -7.369 1.00 0.00 H ATOM 372 N ASN A 153 -11.340 -3.304 -9.739 1.00 7.17 N ATOM 373 CA ASN A 153 -11.916 -1.986 -9.597 1.00 7.45 C ATOM 374 C ASN A 153 -13.082 -1.947 -8.651 1.00 7.35 C ATOM 375 O ASN A 153 -13.560 -0.839 -8.306 1.00 8.37 O ATOM 376 CB ASN A 153 -12.307 -1.434 -10.974 1.00 8.34 C ATOM 377 CG ASN A 153 -12.747 0.028 -10.906 1.00 8.44 C ATOM 378 OD1 ASN A 153 -11.931 0.893 -10.560 1.00 10.48 O ATOM 379 ND2 ASN A 153 -13.973 0.282 -11.239 1.00 8.91 N ATOM 380 HD22 ASN A 153 -14.607 -0.493 -11.520 1.00 0.00 H ATOM 381 HD21 ASN A 153 -14.323 1.261 -11.225 1.00 0.00 H ATOM 382 H ASN A 153 -11.519 -3.825 -10.621 1.00 0.00 H ATOM 383 N ASP A 154 -13.698 -3.090 -8.357 1.00 6.76 N ATOM 384 CA ASP A 154 -14.805 -3.109 -7.423 1.00 7.03 C ATOM 385 C ASP A 154 -14.278 -2.976 -5.962 1.00 6.91 C ATOM 386 O ASP A 154 -13.189 -3.363 -5.644 1.00 7.68 O ATOM 387 CB ASP A 154 -15.672 -4.337 -7.593 1.00 6.90 C ATOM 388 CG ASP A 154 -16.535 -4.314 -8.812 1.00 7.35 C ATOM 389 OD1 ASP A 154 -16.578 -3.284 -9.547 1.00 8.16 O ATOM 390 OD2 ASP A 154 -17.244 -5.334 -9.015 1.00 8.43 O ATOM 391 H ASP A 154 -13.382 -3.976 -8.801 1.00 0.00 H ATOM 392 N VAL A 155 -15.156 -2.429 -5.116 1.00 7.19 N ATOM 393 CA VAL A 155 -14.900 -2.352 -3.685 1.00 7.60 C ATOM 394 C VAL A 155 -15.917 -3.254 -3.000 1.00 6.41 C ATOM 395 O VAL A 155 -17.099 -2.920 -2.895 1.00 7.71 O ATOM 396 CB VAL A 155 -14.920 -0.920 -3.108 1.00 7.97 C ATOM 397 CG1 VAL A 155 -14.629 -0.961 -1.629 1.00 8.28 C ATOM 398 CG2 VAL A 155 -13.966 -0.031 -3.856 1.00 9.12 C ATOM 399 H VAL A 155 -16.048 -2.047 -5.491 1.00 0.00 H ATOM 400 N ALA A 156 -15.428 -4.419 -2.513 1.00 6.84 N ATOM 401 CA ALA A 156 -16.299 -5.346 -1.824 1.00 6.90 C ATOM 402 C ALA A 156 -16.820 -4.749 -0.486 1.00 6.12 C ATOM 403 O ALA A 156 -17.987 -4.958 -0.144 1.00 7.21 O ATOM 404 CB ALA A 156 -15.547 -6.638 -1.554 1.00 7.44 C ATOM 405 H ALA A 156 -14.421 -4.649 -2.635 1.00 0.00 H ATOM 406 N PHE A 157 -15.951 -4.090 0.212 1.00 6.71 N ATOM 407 CA PHE A 157 -16.296 -3.512 1.528 1.00 6.52 C ATOM 408 C PHE A 157 -15.473 -2.236 1.701 1.00 6.65 C ATOM 409 O PHE A 157 -14.262 -2.252 1.787 1.00 7.04 O ATOM 410 CB PHE A 157 -16.005 -4.545 2.649 1.00 6.74 C ATOM 411 CG PHE A 157 -16.206 -4.035 4.050 1.00 6.87 C ATOM 412 CD1 PHE A 157 -17.275 -3.246 4.397 1.00 7.56 C ATOM 413 CD2 PHE A 157 -15.362 -4.423 5.033 1.00 7.09 C ATOM 414 CE1 PHE A 157 -17.463 -2.845 5.727 1.00 7.77 C ATOM 415 CE2 PHE A 157 -15.546 -4.034 6.373 1.00 7.83 C ATOM 416 CZ PHE A 157 -16.598 -3.226 6.685 1.00 7.82 C ATOM 417 H PHE A 157 -14.989 -3.965 -0.162 1.00 0.00 H ATOM 418 N HIS A 158 -16.248 -1.137 1.745 1.00 6.64 N ATOM 419 CA HIS A 158 -15.733 0.218 2.047 1.00 6.75 C ATOM 420 C HIS A 158 -16.223 0.577 3.457 1.00 7.02 C ATOM 421 O HIS A 158 -17.425 0.504 3.710 1.00 8.67 O ATOM 422 CB HIS A 158 -16.385 1.166 1.007 1.00 7.84 C ATOM 423 CG HIS A 158 -16.060 2.639 1.177 1.00 8.29 C ATOM 424 ND1 HIS A 158 -14.880 3.229 0.775 1.00 8.33 N ATOM 425 CD2 HIS A 158 -16.878 3.656 1.565 1.00 8.93 C ATOM 426 CE1 HIS A 158 -14.965 4.540 0.946 1.00 10.00 C ATOM 427 NE2 HIS A 158 -16.162 4.851 1.397 1.00 10.07 N ATOM 428 H HIS A 158 -17.265 -1.245 1.556 1.00 0.00 H ATOM 429 N PHE A 159 -15.253 0.907 4.307 1.00 7.22 N ATOM 430 CA PHE A 159 -15.509 1.283 5.694 1.00 6.78 C ATOM 431 C PHE A 159 -14.974 2.695 5.861 1.00 7.28 C ATOM 432 O PHE A 159 -13.789 2.936 5.720 1.00 7.65 O ATOM 433 CB PHE A 159 -14.763 0.281 6.604 1.00 7.22 C ATOM 434 CG PHE A 159 -14.798 0.635 8.091 1.00 7.29 C ATOM 435 CD1 PHE A 159 -15.785 0.202 8.916 1.00 7.59 C ATOM 436 CD2 PHE A 159 -13.787 1.400 8.625 1.00 7.72 C ATOM 437 CE1 PHE A 159 -15.775 0.504 10.270 1.00 7.89 C ATOM 438 CE2 PHE A 159 -13.774 1.705 10.003 1.00 8.11 C ATOM 439 CZ PHE A 159 -14.777 1.236 10.796 1.00 7.92 C ATOM 440 H PHE A 159 -14.270 0.896 3.968 1.00 0.00 H ATOM 441 N ASN A 160 -15.893 3.645 6.101 1.00 7.95 N ATOM 442 CA ASN A 160 -15.553 5.068 5.911 1.00 8.06 C ATOM 443 C ASN A 160 -16.073 5.925 7.066 1.00 7.94 C ATOM 444 O ASN A 160 -17.148 6.555 6.978 1.00 9.53 O ATOM 445 CB ASN A 160 -16.151 5.490 4.585 1.00 8.47 C ATOM 446 CG ASN A 160 -16.063 6.973 4.235 1.00 8.99 C ATOM 447 OD1 ASN A 160 -17.030 7.483 3.625 1.00 10.64 O ATOM 448 ND2 ASN A 160 -15.011 7.691 4.589 1.00 9.92 N ATOM 449 HD22 ASN A 160 -14.221 7.242 5.095 1.00 0.00 H ATOM 450 HD21 ASN A 160 -14.973 8.705 4.361 1.00 0.00 H ATOM 451 H ASN A 160 -16.845 3.377 6.421 1.00 0.00 H ATOM 452 N PRO A 161 -15.248 6.097 8.135 1.00 8.43 N ATOM 453 CA PRO A 161 -15.490 7.168 9.138 1.00 8.36 C ATOM 454 C PRO A 161 -15.478 8.547 8.490 1.00 8.90 C ATOM 455 O PRO A 161 -14.480 8.949 7.879 1.00 9.87 O ATOM 456 CB PRO A 161 -14.351 6.963 10.147 1.00 8.75 C ATOM 457 CG PRO A 161 -13.931 5.467 9.944 1.00 8.86 C ATOM 458 CD PRO A 161 -14.083 5.251 8.464 1.00 7.78 C ATOM 459 N ARG A 162 -16.531 9.286 8.737 1.00 9.29 N ATOM 460 CA ARG A 162 -16.695 10.688 8.339 1.00 10.49 C ATOM 461 C ARG A 162 -16.849 11.503 9.660 1.00 9.66 C ATOM 462 O ARG A 162 -17.758 11.283 10.416 1.00 10.42 O ATOM 463 CB ARG A 162 -17.927 10.878 7.436 1.00 11.25 C ATOM 464 CG ARG A 162 -17.870 10.076 6.155 1.00 11.19 C ATOM 465 CD ARG A 162 -19.088 10.301 5.269 1.00 12.66 C ATOM 466 NE ARG A 162 -18.952 9.436 4.082 1.00 12.24 N ATOM 467 CZ ARG A 162 -19.836 9.411 3.116 1.00 11.57 C ATOM 468 NH1 ARG A 162 -20.927 10.166 3.147 1.00 13.84 N ATOM 469 NH2 ARG A 162 -19.659 8.568 2.093 1.00 12.34 N ATOM 470 HE ARG A 162 -18.118 8.819 4.009 1.00 0.00 H ATOM 471 HH12 ARG A 162 -21.611 10.124 2.365 1.00 0.00 H ATOM 472 HH11 ARG A 162 -21.098 10.800 3.954 1.00 0.00 H ATOM 473 HH22 ARG A 162 -20.353 8.537 1.319 1.00 0.00 H ATOM 474 HH21 ARG A 162 -18.828 7.943 2.072 1.00 0.00 H ATOM 475 H ARG A 162 -17.314 8.842 9.258 1.00 0.00 H ATOM 476 N PHE A 163 -15.929 12.439 9.853 1.00 9.99 N ATOM 477 CA PHE A 163 -15.832 13.198 11.082 1.00 10.15 C ATOM 478 C PHE A 163 -16.749 14.423 11.086 1.00 10.65 C ATOM 479 O PHE A 163 -16.978 15.001 12.170 1.00 11.64 O ATOM 480 CB PHE A 163 -14.401 13.600 11.387 1.00 10.08 C ATOM 481 CG PHE A 163 -13.516 12.452 11.819 1.00 9.57 C ATOM 482 CD1 PHE A 163 -13.042 11.521 10.894 1.00 9.61 C ATOM 483 CD2 PHE A 163 -13.211 12.231 13.169 1.00 9.85 C ATOM 484 CE1 PHE A 163 -12.312 10.439 11.284 1.00 9.66 C ATOM 485 CE2 PHE A 163 -12.419 11.151 13.570 1.00 10.58 C ATOM 486 CZ PHE A 163 -12.003 10.258 12.610 1.00 10.43 C ATOM 487 H PHE A 163 -15.250 12.636 9.090 1.00 0.00 H ATOM 488 N ASN A 164 -17.240 14.848 9.932 1.00 11.59 N ATOM 489 CA ASN A 164 -18.001 16.040 9.836 1.00 11.48 C ATOM 490 C ASN A 164 -18.871 16.011 8.620 1.00 11.98 C ATOM 491 O ASN A 164 -18.656 16.728 7.611 1.00 15.53 O ATOM 492 CB ASN A 164 -17.048 17.233 9.784 1.00 15.64 C ATOM 493 CG ASN A 164 -17.786 18.546 9.741 1.00 18.68 C ATOM 494 OD1 ASN A 164 -19.011 18.654 9.945 1.00 20.87 O ATOM 495 ND2 ASN A 164 -17.052 19.580 9.319 1.00 27.69 N ATOM 496 HD22 ASN A 164 -16.032 19.462 9.157 1.00 0.00 H ATOM 497 HD21 ASN A 164 -17.501 20.503 9.153 1.00 0.00 H ATOM 498 H ASN A 164 -17.062 14.291 9.072 1.00 0.00 H ATOM 499 N GLU A 165 -19.892 15.175 8.669 1.00 12.16 N ATOM 500 CA GLU A 165 -20.896 15.128 7.646 1.00 12.94 C ATOM 501 C GLU A 165 -22.060 15.930 8.195 1.00 14.29 C ATOM 502 O GLU A 165 -22.788 15.429 9.085 1.00 14.24 O ATOM 503 CB GLU A 165 -21.336 13.691 7.278 1.00 14.61 C ATOM 504 CG GLU A 165 -22.305 13.649 6.138 1.00 14.73 C ATOM 505 CD GLU A 165 -22.902 12.284 5.912 1.00 15.47 C ATOM 506 OE1 GLU A 165 -23.653 11.801 6.820 1.00 19.96 O ATOM 507 OE2 GLU A 165 -22.644 11.679 4.841 1.00 16.37 O ATOM 508 H GLU A 165 -19.971 14.527 9.479 1.00 0.00 H ATOM 509 N ASN A 166 -22.293 17.154 7.762 1.00 16.49 N ATOM 510 CA ASN A 166 -23.289 18.029 8.340 1.00 15.98 C ATOM 511 C ASN A 166 -23.169 18.111 9.895 1.00 13.17 C ATOM 512 O ASN A 166 -24.184 18.051 10.574 1.00 14.86 O ATOM 513 CB ASN A 166 -24.681 17.570 7.880 1.00 19.89 C ATOM 514 CG ASN A 166 -24.783 17.523 6.343 1.00 25.62 C ATOM 515 OD1 ASN A 166 -25.246 16.536 5.778 1.00 33.51 O ATOM 516 ND2 ASN A 166 -24.332 18.596 5.666 1.00 27.57 N ATOM 517 HD22 ASN A 166 -23.947 19.413 6.182 1.00 0.00 H ATOM 518 HD21 ASN A 166 -24.369 18.608 4.627 1.00 0.00 H ATOM 519 H ASN A 166 -21.731 17.509 6.962 1.00 0.00 H ATOM 520 N ASN A 167 -21.924 18.226 10.368 1.00 12.48 N ATOM 521 CA ASN A 167 -21.629 18.389 11.781 1.00 11.67 C ATOM 522 C ASN A 167 -21.987 17.153 12.611 1.00 12.61 C ATOM 523 O ASN A 167 -22.113 17.289 13.844 1.00 13.00 O ATOM 524 CB ASN A 167 -22.247 19.682 12.359 1.00 12.76 C ATOM 525 CG ASN A 167 -21.883 20.879 11.532 1.00 13.32 C ATOM 526 OD1 ASN A 167 -22.766 21.707 11.146 1.00 18.74 O ATOM 527 ND2 ASN A 167 -20.659 21.022 11.303 1.00 14.94 N ATOM 528 HD22 ASN A 167 -19.980 20.312 11.643 1.00 0.00 H ATOM 529 HD21 ASN A 167 -20.323 21.851 10.773 1.00 0.00 H ATOM 530 H ASN A 167 -21.132 18.198 9.695 1.00 0.00 H ATOM 531 N ARG A 168 -22.004 15.987 11.962 1.00 12.59 N ATOM 532 CA ARG A 168 -22.168 14.729 12.659 1.00 12.46 C ATOM 533 C ARG A 168 -21.032 13.818 12.279 1.00 12.50 C ATOM 534 O ARG A 168 -20.439 13.919 11.177 1.00 13.68 O ATOM 535 CB ARG A 168 -23.542 14.138 12.370 1.00 15.11 C ATOM 536 CG ARG A 168 -24.567 15.176 12.750 1.00 18.59 C ATOM 537 CD ARG A 168 -25.947 14.635 12.942 1.00 19.65 C ATOM 538 NE ARG A 168 -26.883 15.708 13.242 1.00 22.60 N ATOM 539 CZ ARG A 168 -28.164 15.491 13.409 1.00 24.24 C ATOM 540 NH1 ARG A 168 -28.602 14.245 13.314 1.00 17.92 N ATOM 541 NH2 ARG A 168 -28.972 16.523 13.668 1.00 23.03 N ATOM 542 HE ARG A 168 -26.523 16.680 13.327 1.00 0.00 H ATOM 543 HH12 ARG A 168 -29.613 14.038 13.441 1.00 0.00 H ATOM 544 HH11 ARG A 168 -27.935 13.473 13.112 1.00 0.00 H ATOM 545 HH22 ARG A 168 -29.991 16.365 13.803 1.00 0.00 H ATOM 546 HH21 ARG A 168 -28.582 17.485 13.735 1.00 0.00 H ATOM 547 H ARG A 168 -21.897 15.982 10.928 1.00 0.00 H ATOM 548 N ARG A 169 -20.706 12.912 13.173 1.00 11.96 N ATOM 549 CA ARG A 169 -19.708 11.881 12.977 1.00 10.77 C ATOM 550 C ARG A 169 -20.447 10.600 12.668 1.00 11.04 C ATOM 551 O ARG A 169 -21.285 10.169 13.458 1.00 12.62 O ATOM 552 CB ARG A 169 -18.844 11.727 14.222 1.00 10.77 C ATOM 553 CG ARG A 169 -18.312 13.071 14.718 1.00 13.40 C ATOM 554 CD ARG A 169 -17.143 13.033 15.601 1.00 14.76 C ATOM 555 NE ARG A 169 -16.888 14.316 16.216 1.00 19.59 N ATOM 556 CZ ARG A 169 -16.186 15.325 15.713 1.00 16.96 C ATOM 557 NH1 ARG A 169 -15.720 15.316 14.468 1.00 34.31 N ATOM 558 NH2 ARG A 169 -15.936 16.388 16.566 1.00 14.47 N ATOM 559 HE ARG A 169 -17.301 14.466 17.159 1.00 0.00 H ATOM 560 HH12 ARG A 169 -15.174 16.126 14.111 1.00 0.00 H ATOM 561 HH11 ARG A 169 -15.901 14.499 13.851 1.00 0.00 H ATOM 562 HH22 ARG A 169 -15.391 17.208 16.230 1.00 0.00 H ATOM 563 HH21 ARG A 169 -16.293 16.366 17.543 1.00 0.00 H ATOM 564 H ARG A 169 -21.200 12.937 14.088 1.00 0.00 H ATOM 565 N VAL A 170 -20.129 9.944 11.561 1.00 11.23 N ATOM 566 CA VAL A 170 -20.820 8.719 11.191 1.00 11.33 C ATOM 567 C VAL A 170 -19.853 7.832 10.410 1.00 11.38 C ATOM 568 O VAL A 170 -18.943 8.290 9.768 1.00 14.31 O ATOM 569 CB VAL A 170 -22.146 8.988 10.436 1.00 10.34 C ATOM 570 CG1 VAL A 170 -21.914 9.705 9.141 1.00 10.89 C ATOM 571 CG2 VAL A 170 -22.915 7.749 10.099 1.00 12.77 C ATOM 572 H VAL A 170 -19.374 10.311 10.948 1.00 0.00 H ATOM 573 N ILE A 171 -20.044 6.533 10.580 1.00 12.84 N ATOM 574 CA ILE A 171 -19.348 5.539 9.738 1.00 12.97 C ATOM 575 C ILE A 171 -20.314 5.070 8.625 1.00 11.50 C ATOM 576 O ILE A 171 -21.413 4.577 8.843 1.00 13.71 O ATOM 577 CB ILE A 171 -18.795 4.397 10.579 1.00 13.45 C ATOM 578 CG1 ILE A 171 -17.749 5.025 11.572 1.00 18.83 C ATOM 579 CG2 ILE A 171 -18.169 3.370 9.721 1.00 14.10 C ATOM 580 CD1 ILE A 171 -17.325 4.155 12.626 1.00 19.16 C ATOM 581 H ILE A 171 -20.697 6.206 11.321 1.00 0.00 H ATOM 582 N VAL A 172 -19.799 5.230 7.387 1.00 10.43 N ATOM 583 CA VAL A 172 -20.538 4.780 6.185 1.00 10.35 C ATOM 584 C VAL A 172 -19.846 3.521 5.636 1.00 9.94 C ATOM 585 O VAL A 172 -18.655 3.511 5.447 1.00 9.83 O ATOM 586 CB VAL A 172 -20.552 5.900 5.112 1.00 10.89 C ATOM 587 CG1 VAL A 172 -21.305 5.405 3.882 1.00 14.01 C ATOM 588 CG2 VAL A 172 -21.217 7.156 5.692 1.00 13.59 C ATOM 589 H VAL A 172 -18.867 5.677 7.276 1.00 0.00 H ATOM 590 N CYS A 173 -20.662 2.473 5.408 1.00 8.55 N ATOM 591 CA CYS A 173 -20.166 1.273 4.761 1.00 7.98 C ATOM 592 C CYS A 173 -20.956 1.011 3.466 1.00 8.56 C ATOM 593 O CYS A 173 -22.142 1.289 3.390 1.00 9.79 O ATOM 594 CB CYS A 173 -20.256 0.051 5.672 1.00 9.06 C ATOM 595 SG CYS A 173 -19.220 0.161 7.164 1.00 10.06 S ATOM 596 H CYS A 173 -21.659 2.525 5.699 1.00 0.00 H ATOM 597 N ASN A 174 -20.258 0.541 2.453 1.00 8.47 N ATOM 598 CA ASN A 174 -20.874 0.316 1.156 1.00 8.50 C ATOM 599 C ASN A 174 -19.967 -0.590 0.305 1.00 8.16 C ATOM 600 O ASN A 174 -18.890 -1.004 0.688 1.00 7.74 O ATOM 601 CB ASN A 174 -21.171 1.680 0.451 1.00 9.35 C ATOM 602 CG ASN A 174 -22.295 1.640 -0.530 1.00 9.81 C ATOM 603 OD1 ASN A 174 -22.906 0.596 -0.856 1.00 10.46 O ATOM 604 ND2 ASN A 174 -22.706 2.828 -0.976 1.00 11.68 N ATOM 605 HD22 ASN A 174 -22.195 3.691 -0.702 1.00 0.00 H ATOM 606 HD21 ASN A 174 -23.537 2.891 -1.598 1.00 0.00 H ATOM 607 H ASN A 174 -19.249 0.327 2.583 1.00 0.00 H ATOM 608 N THR A 175 -20.512 -0.893 -0.912 1.00 7.55 N ATOM 609 CA THR A 175 -19.896 -1.695 -1.950 1.00 7.32 C ATOM 610 C THR A 175 -19.963 -0.906 -3.254 1.00 8.03 C ATOM 611 O THR A 175 -20.962 -0.247 -3.526 1.00 8.85 O ATOM 612 CB THR A 175 -20.610 -3.035 -2.067 1.00 7.27 C ATOM 613 OG1 THR A 175 -20.406 -3.802 -0.870 1.00 7.86 O ATOM 614 CG2 THR A 175 -20.212 -3.885 -3.287 1.00 8.07 C ATOM 615 HG1 THR A 175 -20.768 -3.304 -0.095 1.00 0.00 H ATOM 616 H THR A 175 -21.459 -0.512 -1.112 1.00 0.00 H ATOM 617 N LYS A 176 -18.897 -0.955 -4.033 1.00 8.04 N ATOM 618 CA LYS A 176 -18.818 -0.292 -5.344 1.00 8.49 C ATOM 619 C LYS A 176 -18.707 -1.381 -6.434 1.00 8.22 C ATOM 620 O LYS A 176 -17.769 -2.207 -6.360 1.00 7.91 O ATOM 621 CB LYS A 176 -17.609 0.658 -5.434 1.00 9.01 C ATOM 622 CG LYS A 176 -17.671 1.627 -6.610 1.00 11.05 C ATOM 623 CD LYS A 176 -16.279 2.383 -6.753 1.00 18.14 C ATOM 624 CE LYS A 176 -16.154 3.608 -7.553 1.00 18.42 C ATOM 625 NZ LYS A 176 -14.688 3.893 -7.564 1.00 23.74 N ATOM 626 HZ1 LYS A 176 -14.355 4.029 -6.588 1.00 0.00 H ATOM 627 HZ2 LYS A 176 -14.184 3.092 -7.995 1.00 0.00 H ATOM 628 HZ3 LYS A 176 -14.508 4.756 -8.116 1.00 0.00 H ATOM 629 H LYS A 176 -18.070 -1.491 -3.702 1.00 0.00 H ATOM 630 N LEU A 177 -19.685 -1.455 -7.364 1.00 8.50 N ATOM 631 CA LEU A 177 -19.728 -2.413 -8.413 1.00 8.20 C ATOM 632 C LEU A 177 -19.804 -1.702 -9.752 1.00 8.55 C ATOM 633 O LEU A 177 -20.668 -0.858 -9.939 1.00 10.39 O ATOM 634 CB LEU A 177 -20.944 -3.316 -8.276 1.00 8.92 C ATOM 635 CG LEU A 177 -21.088 -4.162 -7.004 1.00 8.66 C ATOM 636 CD1 LEU A 177 -22.403 -4.881 -6.976 1.00 11.98 C ATOM 637 CD2 LEU A 177 -19.929 -5.101 -6.815 1.00 9.87 C ATOM 638 H LEU A 177 -20.460 -0.763 -7.308 1.00 0.00 H ATOM 639 N ASP A 178 -18.899 -2.018 -10.663 1.00 9.34 N ATOM 640 CA ASP A 178 -18.900 -1.360 -11.980 1.00 10.98 C ATOM 641 C ASP A 178 -18.926 0.157 -11.864 1.00 12.80 C ATOM 642 O ASP A 178 -19.595 0.849 -12.631 1.00 13.55 O ATOM 643 CB ASP A 178 -20.042 -1.897 -12.857 1.00 12.08 C ATOM 644 CG ASP A 178 -19.815 -3.314 -13.291 1.00 14.75 C ATOM 645 OD1 ASP A 178 -18.719 -3.848 -13.183 1.00 14.84 O ATOM 646 OD2 ASP A 178 -20.850 -3.860 -13.791 1.00 21.26 O ATOM 647 H ASP A 178 -18.180 -2.738 -10.447 1.00 0.00 H ATOM 648 N ASN A 179 -18.146 0.698 -10.914 1.00 12.51 N ATOM 649 CA ASN A 179 -17.951 2.092 -10.645 1.00 15.95 C ATOM 650 C ASN A 179 -19.130 2.715 -9.953 1.00 15.31 C ATOM 651 O ASN A 179 -19.083 3.934 -9.768 1.00 23.72 O ATOM 652 CB ASN A 179 -17.516 2.866 -11.923 1.00 19.74 C ATOM 653 CG ASN A 179 -16.219 3.502 -11.793 1.00 14.21 C ATOM 654 OD1 ASN A 179 -15.303 3.095 -11.039 1.00 15.48 O ATOM 655 ND2 ASN A 179 -16.105 4.565 -12.556 1.00 16.89 N ATOM 656 HD22 ASN A 179 -16.898 4.857 -13.162 1.00 0.00 H ATOM 657 HD21 ASN A 179 -15.222 5.114 -12.554 1.00 0.00 H ATOM 658 H ASN A 179 -17.626 0.032 -10.307 1.00 0.00 H ATOM 659 N ASN A 180 -20.196 1.978 -9.531 1.00 13.33 N ATOM 660 CA ASN A 180 -21.337 2.558 -8.897 1.00 16.70 C ATOM 661 C ASN A 180 -21.475 2.094 -7.396 1.00 13.55 C ATOM 662 O ASN A 180 -21.428 0.890 -7.097 1.00 13.31 O ATOM 663 CB ASN A 180 -22.598 2.088 -9.555 1.00 19.62 C ATOM 664 CG ASN A 180 -22.677 2.380 -10.995 1.00 29.54 C ATOM 665 OD1 ASN A 180 -22.284 3.438 -11.425 1.00 38.85 O ATOM 666 ND2 ASN A 180 -23.085 1.365 -11.758 1.00 35.14 N ATOM 667 HD22 ASN A 180 -23.411 0.481 -11.317 1.00 0.00 H ATOM 668 HD21 ASN A 180 -23.077 1.457 -12.794 1.00 0.00 H ATOM 669 H ASN A 180 -20.178 0.948 -9.677 1.00 0.00 H ATOM 670 N TRP A 181 -21.654 3.039 -6.518 1.00 13.25 N ATOM 671 CA TRP A 181 -21.910 2.787 -5.129 1.00 12.33 C ATOM 672 C TRP A 181 -23.342 2.267 -4.932 1.00 14.49 C ATOM 673 O TRP A 181 -24.256 2.771 -5.553 1.00 16.28 O ATOM 674 CB TRP A 181 -21.626 4.030 -4.262 1.00 14.03 C ATOM 675 CG TRP A 181 -20.202 4.399 -4.214 1.00 12.51 C ATOM 676 CD1 TRP A 181 -19.515 5.423 -4.865 1.00 15.41 C ATOM 677 CD2 TRP A 181 -19.167 3.680 -3.461 1.00 11.33 C ATOM 678 NE1 TRP A 181 -18.183 5.380 -4.560 1.00 14.17 N ATOM 679 CE2 TRP A 181 -17.956 4.334 -3.682 1.00 12.36 C ATOM 680 CE3 TRP A 181 -19.169 2.550 -2.605 1.00 10.96 C ATOM 681 CZ2 TRP A 181 -16.784 3.895 -3.086 1.00 12.56 C ATOM 682 CZ3 TRP A 181 -18.037 2.131 -2.057 1.00 10.64 C ATOM 683 CH2 TRP A 181 -16.890 2.787 -2.256 1.00 10.57 C ATOM 684 HE1 TRP A 181 -17.458 6.028 -4.928 1.00 0.00 H ATOM 685 H TRP A 181 -21.609 4.027 -6.840 1.00 0.00 H ATOM 686 N GLY A 182 -23.482 1.319 -4.003 1.00 11.46 N ATOM 687 CA GLY A 182 -24.704 0.694 -3.687 1.00 12.49 C ATOM 688 C GLY A 182 -25.411 1.416 -2.534 1.00 12.78 C ATOM 689 O GLY A 182 -25.195 2.632 -2.273 1.00 13.15 O ATOM 690 H GLY A 182 -22.634 1.023 -3.479 1.00 0.00 H ATOM 691 N ARG A 183 -26.280 0.698 -1.864 1.00 13.64 N ATOM 692 CA ARG A 183 -27.010 1.190 -0.721 1.00 13.66 C ATOM 693 C ARG A 183 -26.137 1.246 0.526 1.00 13.34 C ATOM 694 O ARG A 183 -25.547 0.247 0.948 1.00 14.77 O ATOM 695 CB ARG A 183 -28.156 0.262 -0.403 1.00 15.85 C ATOM 696 CG ARG A 183 -29.266 1.054 0.310 1.00 19.17 C ATOM 697 CD ARG A 183 -30.710 0.501 0.230 1.00 17.82 C ATOM 698 NE ARG A 183 -30.697 -0.800 0.825 1.00 22.01 N ATOM 699 CZ ARG A 183 -31.734 -1.639 0.881 1.00 28.41 C ATOM 700 NH1 ARG A 183 -32.931 -1.296 0.413 1.00 25.26 N ATOM 701 NH2 ARG A 183 -31.551 -2.803 1.446 1.00 26.68 N ATOM 702 HE ARG A 183 -29.803 -1.120 1.250 1.00 0.00 H ATOM 703 HH12 ARG A 183 -33.723 -1.968 0.468 1.00 0.00 H ATOM 704 HH11 ARG A 183 -33.075 -0.356 -0.008 1.00 0.00 H ATOM 705 HH22 ARG A 183 -32.337 -3.481 1.507 1.00 0.00 H ATOM 706 HH21 ARG A 183 -30.619 -3.051 1.835 1.00 0.00 H ATOM 707 H ARG A 183 -26.452 -0.280 -2.174 1.00 0.00 H ATOM 708 N GLU A 184 -25.935 2.427 1.107 1.00 13.47 N ATOM 709 CA GLU A 184 -25.086 2.611 2.258 1.00 12.50 C ATOM 710 C GLU A 184 -25.690 1.970 3.482 1.00 12.19 C ATOM 711 O GLU A 184 -26.924 1.918 3.650 1.00 14.86 O ATOM 712 CB GLU A 184 -24.885 4.109 2.550 1.00 12.85 C ATOM 713 CG GLU A 184 -24.109 4.841 1.501 1.00 13.84 C ATOM 714 CD GLU A 184 -23.887 6.325 1.782 1.00 13.17 C ATOM 715 OE1 GLU A 184 -24.661 6.929 2.592 1.00 17.20 O ATOM 716 OE2 GLU A 184 -23.007 6.882 1.133 1.00 15.24 O ATOM 717 H GLU A 184 -26.415 3.260 0.710 1.00 0.00 H ATOM 718 N GLU A 185 -24.803 1.474 4.331 1.00 12.52 N ATOM 719 CA GLU A 185 -25.160 1.004 5.691 1.00 11.64 C ATOM 720 C GLU A 185 -24.506 1.905 6.694 1.00 11.42 C ATOM 721 O GLU A 185 -23.264 2.018 6.794 1.00 11.15 O ATOM 722 CB GLU A 185 -24.705 -0.425 5.928 1.00 11.64 C ATOM 723 CG GLU A 185 -25.253 -1.364 4.845 1.00 12.45 C ATOM 724 CD GLU A 185 -25.094 -2.851 5.136 1.00 12.84 C ATOM 725 OE1 GLU A 185 -24.961 -3.271 6.334 1.00 11.78 O ATOM 726 OE2 GLU A 185 -25.085 -3.622 4.185 1.00 12.86 O ATOM 727 H GLU A 185 -23.810 1.411 4.030 1.00 0.00 H ATOM 728 N ARG A 186 -25.378 2.617 7.425 1.00 13.55 N ATOM 729 CA ARG A 186 -25.001 3.518 8.497 1.00 12.15 C ATOM 730 C ARG A 186 -25.597 3.087 9.810 1.00 12.28 C ATOM 731 O ARG A 186 -26.778 2.801 9.884 1.00 13.17 O ATOM 732 CB ARG A 186 -25.498 4.915 8.236 1.00 13.84 C ATOM 733 CG ARG A 186 -24.973 5.497 6.989 1.00 12.26 C ATOM 734 CD ARG A 186 -25.808 6.661 6.563 1.00 16.40 C ATOM 735 NE ARG A 186 -25.224 7.420 5.424 1.00 18.76 N ATOM 736 CZ ARG A 186 -24.656 8.597 5.523 1.00 15.01 C ATOM 737 NH1 ARG A 186 -24.631 9.218 6.739 1.00 15.37 N ATOM 738 NH2 ARG A 186 -24.127 9.127 4.455 1.00 15.53 N ATOM 739 HE ARG A 186 -25.270 6.985 4.481 1.00 0.00 H ATOM 740 HH12 ARG A 186 -24.185 10.152 6.837 1.00 0.00 H ATOM 741 HH11 ARG A 186 -25.058 8.757 7.567 1.00 0.00 H ATOM 742 HH22 ARG A 186 -23.671 10.060 4.509 1.00 0.00 H ATOM 743 HH21 ARG A 186 -24.161 8.617 3.550 1.00 0.00 H ATOM 744 H ARG A 186 -26.390 2.516 7.208 1.00 0.00 H ATOM 745 N GLN A 187 -24.761 3.094 10.843 1.00 14.35 N ATOM 746 CA GLN A 187 -25.223 2.958 12.246 1.00 15.15 C ATOM 747 C GLN A 187 -24.609 4.103 13.050 1.00 16.97 C ATOM 748 O GLN A 187 -23.908 4.914 12.482 1.00 14.40 O ATOM 749 CB GLN A 187 -24.916 1.571 12.841 1.00 16.31 C ATOM 750 CG GLN A 187 -23.484 1.084 12.776 1.00 14.57 C ATOM 751 CD GLN A 187 -22.601 1.806 13.772 1.00 13.05 C ATOM 752 OE1 GLN A 187 -22.869 1.763 14.997 1.00 12.91 O ATOM 753 NE2 GLN A 187 -21.566 2.487 13.275 1.00 12.25 N ATOM 754 HE22 GLN A 187 -21.389 2.489 12.250 1.00 0.00 H ATOM 755 HE21 GLN A 187 -20.937 3.015 13.913 1.00 0.00 H ATOM 756 H GLN A 187 -23.743 3.199 10.661 1.00 0.00 H ATOM 757 N SER A 188 -24.924 4.260 14.341 1.00 14.06 N ATOM 758 CA SER A 188 -24.573 5.552 15.006 1.00 17.87 C ATOM 759 C SER A 188 -23.278 5.734 15.844 1.00 16.76 C ATOM 760 O SER A 188 -22.870 6.853 16.157 1.00 16.78 O ATOM 761 CB SER A 188 -25.731 5.941 15.893 1.00 18.01 C ATOM 762 OG SER A 188 -26.079 4.855 16.750 1.00 28.27 O ATOM 763 HG SER A 188 -26.338 4.073 16.201 1.00 0.00 H ATOM 764 H SER A 188 -25.401 3.502 14.869 1.00 0.00 H ATOM 765 N VAL A 189 -22.626 4.648 16.174 1.00 13.24 N ATOM 766 CA VAL A 189 -21.525 4.469 17.103 1.00 13.16 C ATOM 767 C VAL A 189 -20.240 4.842 16.379 1.00 10.83 C ATOM 768 O VAL A 189 -20.014 4.400 15.236 1.00 13.63 O ATOM 769 CB VAL A 189 -21.471 3.069 17.659 1.00 13.72 C ATOM 770 CG1 VAL A 189 -20.253 2.906 18.541 1.00 15.79 C ATOM 771 CG2 VAL A 189 -22.746 2.694 18.432 1.00 16.66 C ATOM 772 H VAL A 189 -22.946 3.781 15.698 1.00 0.00 H ATOM 773 N PHE A 190 -19.454 5.710 16.983 1.00 12.81 N ATOM 774 CA PHE A 190 -18.326 6.354 16.368 1.00 11.17 C ATOM 775 C PHE A 190 -17.191 6.360 17.321 1.00 10.96 C ATOM 776 O PHE A 190 -17.061 7.314 18.090 1.00 13.77 O ATOM 777 CB PHE A 190 -18.658 7.732 15.829 1.00 10.96 C ATOM 778 CG PHE A 190 -17.616 8.329 14.921 1.00 10.23 C ATOM 779 CD1 PHE A 190 -16.530 9.032 15.379 1.00 9.81 C ATOM 780 CD2 PHE A 190 -17.768 8.213 13.557 1.00 9.64 C ATOM 781 CE1 PHE A 190 -15.600 9.535 14.529 1.00 9.94 C ATOM 782 CE2 PHE A 190 -16.858 8.752 12.691 1.00 10.05 C ATOM 783 CZ PHE A 190 -15.752 9.420 13.150 1.00 10.30 C ATOM 784 H PHE A 190 -19.665 5.946 17.974 1.00 0.00 H ATOM 785 N PRO A 191 -16.290 5.350 17.295 1.00 11.42 N ATOM 786 CA PRO A 191 -15.291 5.174 18.343 1.00 13.09 C ATOM 787 C PRO A 191 -14.031 5.978 18.147 1.00 12.60 C ATOM 788 O PRO A 191 -13.187 6.061 19.087 1.00 16.79 O ATOM 789 CB PRO A 191 -15.026 3.699 18.352 1.00 15.97 C ATOM 790 CG PRO A 191 -15.332 3.264 16.945 1.00 17.39 C ATOM 791 CD PRO A 191 -16.441 4.129 16.474 1.00 13.47 C ATOM 792 N PHE A 192 -13.847 6.586 16.969 1.00 11.07 N ATOM 793 CA PHE A 192 -12.640 7.345 16.664 1.00 11.26 C ATOM 794 C PHE A 192 -12.721 8.745 17.228 1.00 10.47 C ATOM 795 O PHE A 192 -13.780 9.316 17.435 1.00 12.11 O ATOM 796 CB PHE A 192 -12.447 7.418 15.138 1.00 10.20 C ATOM 797 CG PHE A 192 -12.373 6.087 14.460 1.00 9.89 C ATOM 798 CD1 PHE A 192 -11.214 5.381 14.404 1.00 9.62 C ATOM 799 CD2 PHE A 192 -13.474 5.508 13.878 1.00 9.30 C ATOM 800 CE1 PHE A 192 -11.117 4.129 13.817 1.00 9.50 C ATOM 801 CE2 PHE A 192 -13.412 4.243 13.262 1.00 9.18 C ATOM 802 CZ PHE A 192 -12.218 3.568 13.257 1.00 8.37 C ATOM 803 H PHE A 192 -14.591 6.515 16.246 1.00 0.00 H ATOM 804 N GLU A 193 -11.540 9.265 17.521 1.00 10.23 N ATOM 805 CA GLU A 193 -11.348 10.632 18.045 1.00 10.53 C ATOM 806 C GLU A 193 -10.173 11.264 17.396 1.00 9.29 C ATOM 807 O GLU A 193 -9.071 10.686 17.345 1.00 9.42 O ATOM 808 CB GLU A 193 -11.125 10.793 19.560 1.00 12.13 C ATOM 809 CG GLU A 193 -12.277 10.423 20.496 1.00 12.77 C ATOM 810 CD GLU A 193 -13.480 11.360 20.441 1.00 15.03 C ATOM 811 OE1 GLU A 193 -13.324 12.509 20.004 1.00 18.08 O ATOM 812 OE2 GLU A 193 -14.564 10.913 20.812 1.00 14.74 O ATOM 813 H GLU A 193 -10.696 8.675 17.373 1.00 0.00 H ATOM 814 N SER A 194 -10.385 12.502 16.898 1.00 10.49 N ATOM 815 CA SER A 194 -9.260 13.245 16.366 1.00 10.49 C ATOM 816 C SER A 194 -8.098 13.295 17.316 1.00 9.38 C ATOM 817 O SER A 194 -8.252 13.513 18.510 1.00 10.79 O ATOM 818 CB SER A 194 -9.730 14.633 15.991 1.00 13.65 C ATOM 819 OG SER A 194 -10.631 14.576 14.847 1.00 21.36 O ATOM 820 HG SER A 194 -10.928 15.492 14.616 1.00 0.00 H ATOM 821 H SER A 194 -11.340 12.915 16.896 1.00 0.00 H ATOM 822 N GLY A 195 -6.905 13.068 16.792 1.00 8.62 N ATOM 823 CA GLY A 195 -5.696 13.136 17.557 1.00 8.67 C ATOM 824 C GLY A 195 -5.281 11.853 18.289 1.00 7.48 C ATOM 825 O GLY A 195 -4.236 11.812 18.868 1.00 10.22 O ATOM 826 H GLY A 195 -6.842 12.830 15.782 1.00 0.00 H ATOM 827 N LYS A 196 -6.160 10.820 18.292 1.00 7.51 N ATOM 828 CA LYS A 196 -5.938 9.678 19.192 1.00 7.63 C ATOM 829 C LYS A 196 -5.582 8.382 18.446 1.00 6.54 C ATOM 830 O LYS A 196 -6.081 8.135 17.324 1.00 7.16 O ATOM 831 CB LYS A 196 -7.155 9.413 20.090 1.00 7.88 C ATOM 832 CG LYS A 196 -7.514 10.569 21.038 1.00 9.21 C ATOM 833 CD LYS A 196 -8.476 10.104 22.159 1.00 9.67 C ATOM 834 CE LYS A 196 -9.247 11.191 22.831 1.00 9.30 C ATOM 835 NZ LYS A 196 -9.959 10.741 24.023 1.00 10.14 N ATOM 836 HZ1 LYS A 196 -10.633 9.994 23.761 1.00 0.00 H ATOM 837 HZ2 LYS A 196 -9.276 10.368 24.713 1.00 0.00 H ATOM 838 HZ3 LYS A 196 -10.473 11.542 24.441 1.00 0.00 H ATOM 839 H LYS A 196 -6.987 10.835 17.661 1.00 0.00 H ATOM 840 N PRO A 197 -4.755 7.556 19.061 1.00 6.93 N ATOM 841 CA PRO A 197 -4.417 6.228 18.505 1.00 7.51 C ATOM 842 C PRO A 197 -5.577 5.273 18.529 1.00 7.02 C ATOM 843 O PRO A 197 -6.375 5.254 19.469 1.00 7.88 O ATOM 844 CB PRO A 197 -3.275 5.770 19.369 1.00 8.94 C ATOM 845 CG PRO A 197 -3.403 6.488 20.626 1.00 11.09 C ATOM 846 CD PRO A 197 -4.108 7.784 20.364 1.00 7.86 C ATOM 847 N PHE A 198 -5.652 4.458 17.476 1.00 7.45 N ATOM 848 CA PHE A 198 -6.726 3.474 17.321 1.00 7.39 C ATOM 849 C PHE A 198 -6.111 2.152 16.819 1.00 7.02 C ATOM 850 O PHE A 198 -5.041 2.082 16.233 1.00 7.89 O ATOM 851 CB PHE A 198 -7.795 3.961 16.349 1.00 8.21 C ATOM 852 CG PHE A 198 -7.302 4.133 14.939 1.00 8.30 C ATOM 853 CD1 PHE A 198 -7.195 3.055 14.055 1.00 8.91 C ATOM 854 CD2 PHE A 198 -6.805 5.334 14.510 1.00 10.99 C ATOM 855 CE1 PHE A 198 -6.693 3.188 12.801 1.00 9.02 C ATOM 856 CE2 PHE A 198 -6.332 5.491 13.219 1.00 12.24 C ATOM 857 CZ PHE A 198 -6.267 4.426 12.357 1.00 10.65 C ATOM 858 H PHE A 198 -4.922 4.523 16.738 1.00 0.00 H ATOM 859 N LYS A 199 -6.944 1.128 17.013 1.00 7.13 N ATOM 860 CA LYS A 199 -6.773 -0.188 16.384 1.00 7.89 C ATOM 861 C LYS A 199 -8.072 -0.558 15.715 1.00 7.52 C ATOM 862 O LYS A 199 -9.128 -0.526 16.361 1.00 8.90 O ATOM 863 CB LYS A 199 -6.410 -1.241 17.445 1.00 8.96 C ATOM 864 CG LYS A 199 -6.237 -2.660 16.885 1.00 9.46 C ATOM 865 CD LYS A 199 -5.683 -3.627 17.917 1.00 12.13 C ATOM 866 CE LYS A 199 -6.625 -3.925 19.057 1.00 12.74 C ATOM 867 NZ LYS A 199 -6.049 -4.849 20.038 1.00 17.11 N ATOM 868 HZ1 LYS A 199 -5.818 -5.749 19.571 1.00 0.00 H ATOM 869 HZ2 LYS A 199 -5.184 -4.433 20.438 1.00 0.00 H ATOM 870 HZ3 LYS A 199 -6.738 -5.019 20.799 1.00 0.00 H ATOM 871 H LYS A 199 -7.759 1.269 17.644 1.00 0.00 H ATOM 872 N ILE A 200 -7.994 -0.955 14.437 1.00 7.26 N ATOM 873 CA ILE A 200 -9.156 -1.541 13.752 1.00 7.51 C ATOM 874 C ILE A 200 -8.804 -2.981 13.485 1.00 7.27 C ATOM 875 O ILE A 200 -7.740 -3.293 12.940 1.00 9.25 O ATOM 876 CB ILE A 200 -9.458 -0.854 12.397 1.00 7.72 C ATOM 877 CG1 ILE A 200 -9.704 0.651 12.569 1.00 8.61 C ATOM 878 CG2 ILE A 200 -10.644 -1.509 11.728 1.00 9.16 C ATOM 879 CD1 ILE A 200 -9.679 1.439 11.264 1.00 9.43 C ATOM 880 H ILE A 200 -7.097 -0.847 13.922 1.00 0.00 H ATOM 881 N GLN A 201 -9.726 -3.891 13.850 1.00 7.10 N ATOM 882 CA GLN A 201 -9.619 -5.321 13.532 1.00 8.09 C ATOM 883 C GLN A 201 -10.811 -5.655 12.652 1.00 7.06 C ATOM 884 O GLN A 201 -11.931 -5.348 12.984 1.00 9.60 O ATOM 885 CB GLN A 201 -9.615 -6.181 14.765 1.00 9.43 C ATOM 886 CG GLN A 201 -8.317 -6.058 15.564 1.00 12.39 C ATOM 887 CD GLN A 201 -8.499 -6.586 17.052 1.00 12.84 C ATOM 888 OE1 GLN A 201 -9.501 -6.224 17.731 1.00 15.45 O ATOM 889 NE2 GLN A 201 -7.639 -7.467 17.476 1.00 15.89 N ATOM 890 HE22 GLN A 201 -6.829 -7.732 16.880 1.00 0.00 H ATOM 891 HE21 GLN A 201 -7.762 -7.905 18.411 1.00 0.00 H ATOM 892 H GLN A 201 -10.557 -3.565 14.384 1.00 0.00 H ATOM 893 N VAL A 202 -10.511 -6.269 11.506 1.00 7.09 N ATOM 894 CA VAL A 202 -11.560 -6.759 10.578 1.00 7.19 C ATOM 895 C VAL A 202 -11.376 -8.265 10.476 1.00 7.02 C ATOM 896 O VAL A 202 -10.361 -8.774 10.001 1.00 7.95 O ATOM 897 CB VAL A 202 -11.451 -6.137 9.195 1.00 7.10 C ATOM 898 CG1 VAL A 202 -12.568 -6.637 8.302 1.00 8.22 C ATOM 899 CG2 VAL A 202 -11.449 -4.615 9.255 1.00 7.88 C ATOM 900 H VAL A 202 -9.511 -6.408 11.256 1.00 0.00 H ATOM 901 N LEU A 203 -12.374 -8.989 11.002 1.00 7.45 N ATOM 902 CA LEU A 203 -12.394 -10.468 10.999 1.00 7.87 C ATOM 903 C LEU A 203 -13.365 -10.916 9.906 1.00 7.79 C ATOM 904 O LEU A 203 -14.500 -10.536 9.896 1.00 9.98 O ATOM 905 CB LEU A 203 -12.775 -11.006 12.354 1.00 9.75 C ATOM 906 CG LEU A 203 -12.841 -12.559 12.405 1.00 11.88 C ATOM 907 CD1 LEU A 203 -11.529 -13.202 12.054 1.00 11.97 C ATOM 908 CD2 LEU A 203 -13.299 -12.981 13.783 1.00 16.24 C ATOM 909 H LEU A 203 -13.175 -8.485 11.434 1.00 0.00 H ATOM 910 N VAL A 204 -12.858 -11.709 8.961 1.00 8.53 N ATOM 911 CA VAL A 204 -13.721 -12.242 7.926 1.00 8.41 C ATOM 912 C VAL A 204 -14.492 -13.449 8.519 1.00 8.72 C ATOM 913 O VAL A 204 -13.811 -14.401 9.000 1.00 10.79 O ATOM 914 CB VAL A 204 -12.936 -12.633 6.683 1.00 8.87 C ATOM 915 CG1 VAL A 204 -13.845 -13.147 5.566 1.00 10.56 C ATOM 916 CG2 VAL A 204 -12.114 -11.452 6.192 1.00 9.40 C ATOM 917 H VAL A 204 -11.845 -11.944 8.967 1.00 0.00 H ATOM 918 N GLU A 205 -15.778 -13.432 8.532 1.00 9.14 N ATOM 919 CA GLU A 205 -16.602 -14.557 8.985 1.00 9.86 C ATOM 920 C GLU A 205 -17.358 -15.070 7.740 1.00 10.87 C ATOM 921 O GLU A 205 -17.354 -14.459 6.650 1.00 10.70 O ATOM 922 CB GLU A 205 -17.523 -14.114 10.123 1.00 11.18 C ATOM 923 CG GLU A 205 -16.748 -13.764 11.360 1.00 13.06 C ATOM 924 CD GLU A 205 -17.435 -13.643 12.719 1.00 15.17 C ATOM 925 OE1 GLU A 205 -18.555 -13.143 12.714 1.00 17.73 O ATOM 926 OE2 GLU A 205 -16.773 -14.009 13.737 1.00 14.45 O ATOM 927 H GLU A 205 -16.261 -12.572 8.203 1.00 0.00 H ATOM 928 N PRO A 206 -18.027 -16.219 7.850 1.00 11.49 N ATOM 929 CA PRO A 206 -18.497 -16.797 6.599 1.00 11.54 C ATOM 930 C PRO A 206 -19.596 -15.931 5.937 1.00 10.24 C ATOM 931 O PRO A 206 -19.863 -16.061 4.718 1.00 10.72 O ATOM 932 CB PRO A 206 -18.955 -18.206 7.049 1.00 9.06 C ATOM 933 CG PRO A 206 -18.114 -18.529 8.249 1.00 9.99 C ATOM 934 CD PRO A 206 -18.022 -17.205 8.968 1.00 12.42 C ATOM 935 N ASP A 207 -20.316 -15.100 6.673 1.00 10.99 N ATOM 936 CA ASP A 207 -21.388 -14.333 6.041 1.00 11.24 C ATOM 937 C ASP A 207 -21.200 -12.816 6.096 1.00 9.45 C ATOM 938 O ASP A 207 -22.047 -12.064 5.568 1.00 9.11 O ATOM 939 CB ASP A 207 -22.768 -14.656 6.645 1.00 13.77 C ATOM 940 CG ASP A 207 -23.268 -16.022 6.338 1.00 15.74 C ATOM 941 OD1 ASP A 207 -22.844 -16.529 5.277 1.00 15.15 O ATOM 942 OD2 ASP A 207 -24.164 -16.507 7.129 1.00 17.26 O ATOM 943 H ASP A 207 -20.122 -14.994 7.689 1.00 0.00 H ATOM 944 N HIS A 208 -20.197 -12.368 6.833 1.00 9.44 N ATOM 945 CA HIS A 208 -19.932 -10.940 6.975 1.00 8.88 C ATOM 946 C HIS A 208 -18.500 -10.660 7.313 1.00 8.59 C ATOM 947 O HIS A 208 -17.724 -11.544 7.815 1.00 10.32 O ATOM 948 CB HIS A 208 -20.916 -10.351 7.986 1.00 11.59 C ATOM 949 CG HIS A 208 -20.943 -11.061 9.277 1.00 9.72 C ATOM 950 ND1 HIS A 208 -21.959 -11.927 9.624 1.00 14.15 N ATOM 951 CD2 HIS A 208 -19.989 -11.161 10.227 1.00 10.17 C ATOM 952 CE1 HIS A 208 -21.622 -12.530 10.763 1.00 13.13 C ATOM 953 NE2 HIS A 208 -20.444 -12.052 11.158 1.00 12.46 N ATOM 954 H HIS A 208 -19.583 -13.050 7.323 1.00 0.00 H ATOM 955 N PHE A 209 -18.114 -9.406 7.097 1.00 8.48 N ATOM 956 CA PHE A 209 -16.944 -8.831 7.757 1.00 8.06 C ATOM 957 C PHE A 209 -17.410 -8.321 9.167 1.00 7.82 C ATOM 958 O PHE A 209 -18.438 -7.666 9.270 1.00 9.84 O ATOM 959 CB PHE A 209 -16.400 -7.615 6.994 1.00 8.03 C ATOM 960 CG PHE A 209 -15.867 -7.919 5.649 1.00 7.79 C ATOM 961 CD1 PHE A 209 -14.569 -8.276 5.487 1.00 9.24 C ATOM 962 CD2 PHE A 209 -16.655 -7.798 4.523 1.00 8.72 C ATOM 963 CE1 PHE A 209 -14.067 -8.574 4.210 1.00 10.62 C ATOM 964 CE2 PHE A 209 -16.181 -8.078 3.256 1.00 10.26 C ATOM 965 CZ PHE A 209 -14.896 -8.449 3.111 1.00 10.51 C ATOM 966 H PHE A 209 -18.662 -8.816 6.438 1.00 0.00 H ATOM 967 N LYS A 210 -16.636 -8.659 10.186 1.00 8.34 N ATOM 968 CA LYS A 210 -16.876 -8.197 11.571 1.00 8.94 C ATOM 969 C LYS A 210 -15.757 -7.223 11.982 1.00 8.74 C ATOM 970 O LYS A 210 -14.614 -7.579 11.921 1.00 12.18 O ATOM 971 CB LYS A 210 -16.914 -9.411 12.496 1.00 10.15 C ATOM 972 CG LYS A 210 -17.349 -9.148 13.915 1.00 11.30 C ATOM 973 CD LYS A 210 -17.455 -10.442 14.786 1.00 13.60 C ATOM 974 CE LYS A 210 -16.092 -10.956 15.230 1.00 11.28 C ATOM 975 NZ LYS A 210 -16.189 -12.338 15.916 1.00 10.52 N ATOM 976 HZ1 LYS A 210 -16.798 -12.265 16.756 1.00 0.00 H ATOM 977 HZ2 LYS A 210 -16.595 -13.026 15.250 1.00 0.00 H ATOM 978 HZ3 LYS A 210 -15.239 -12.649 16.202 1.00 0.00 H ATOM 979 H LYS A 210 -15.821 -9.279 10.005 1.00 0.00 H ATOM 980 N VAL A 211 -16.165 -5.999 12.400 1.00 8.13 N ATOM 981 CA VAL A 211 -15.206 -4.975 12.726 1.00 7.36 C ATOM 982 C VAL A 211 -15.271 -4.621 14.211 1.00 7.79 C ATOM 983 O VAL A 211 -16.365 -4.341 14.718 1.00 8.49 O ATOM 984 CB VAL A 211 -15.483 -3.711 11.870 1.00 7.86 C ATOM 985 CG1 VAL A 211 -14.457 -2.642 12.146 1.00 8.43 C ATOM 986 CG2 VAL A 211 -15.497 -4.010 10.384 1.00 8.69 C ATOM 987 H VAL A 211 -17.182 -5.798 12.486 1.00 0.00 H ATOM 988 N ALA A 212 -14.099 -4.588 14.810 1.00 7.88 N ATOM 989 CA ALA A 212 -13.937 -4.085 16.173 1.00 8.16 C ATOM 990 C ALA A 212 -12.902 -2.942 16.154 1.00 8.29 C ATOM 991 O ALA A 212 -11.933 -2.985 15.424 1.00 8.82 O ATOM 992 CB ALA A 212 -13.400 -5.205 17.135 1.00 9.74 C ATOM 993 H ALA A 212 -13.262 -4.931 14.297 1.00 0.00 H ATOM 994 N VAL A 213 -13.169 -1.929 16.973 1.00 7.90 N ATOM 995 CA VAL A 213 -12.264 -0.811 17.119 1.00 7.13 C ATOM 996 C VAL A 213 -11.849 -0.733 18.601 1.00 8.21 C ATOM 997 O VAL A 213 -12.695 -0.780 19.497 1.00 8.41 O ATOM 998 CB VAL A 213 -12.880 0.527 16.625 1.00 7.34 C ATOM 999 CG1 VAL A 213 -11.929 1.663 16.876 1.00 8.56 C ATOM 1000 CG2 VAL A 213 -13.207 0.401 15.143 1.00 8.40 C ATOM 1001 H VAL A 213 -14.052 -1.941 17.523 1.00 0.00 H ATOM 1002 N ASN A 214 -10.571 -0.674 18.821 1.00 7.74 N ATOM 1003 CA ASN A 214 -10.096 -0.547 20.229 1.00 8.88 C ATOM 1004 C ASN A 214 -10.631 -1.648 21.080 1.00 11.49 C ATOM 1005 O ASN A 214 -10.979 -1.449 22.239 1.00 12.54 O ATOM 1006 CB ASN A 214 -10.319 0.850 20.815 1.00 8.95 C ATOM 1007 CG ASN A 214 -9.661 1.949 19.998 1.00 7.81 C ATOM 1008 OD1 ASN A 214 -8.789 1.688 19.222 1.00 8.51 O ATOM 1009 ND2 ASN A 214 -10.164 3.153 20.183 1.00 8.52 N ATOM 1010 HD22 ASN A 214 -10.923 3.298 20.879 1.00 0.00 H ATOM 1011 HD21 ASN A 214 -9.802 3.958 19.633 1.00 0.00 H ATOM 1012 H ASN A 214 -9.893 -0.714 18.033 1.00 0.00 H ATOM 1013 N ASP A 215 -10.662 -2.872 20.542 1.00 10.80 N ATOM 1014 CA ASP A 215 -11.125 -4.122 21.169 1.00 11.84 C ATOM 1015 C ASP A 215 -12.581 -4.164 21.457 1.00 11.59 C ATOM 1016 O ASP A 215 -13.064 -5.150 22.052 1.00 15.32 O ATOM 1017 CB ASP A 215 -10.327 -4.425 22.423 1.00 12.84 C ATOM 1018 CG ASP A 215 -8.925 -4.684 22.149 1.00 15.47 C ATOM 1019 OD1 ASP A 215 -8.613 -5.481 21.220 1.00 19.34 O ATOM 1020 OD2 ASP A 215 -8.059 -4.055 22.877 1.00 20.92 O ATOM 1021 H ASP A 215 -10.318 -2.951 19.564 1.00 0.00 H ATOM 1022 N ALA A 216 -13.425 -3.260 20.972 1.00 10.42 N ATOM 1023 CA ALA A 216 -14.872 -3.291 21.136 1.00 11.46 C ATOM 1024 C ALA A 216 -15.523 -3.491 19.809 1.00 10.00 C ATOM 1025 O ALA A 216 -15.280 -2.787 18.838 1.00 10.33 O ATOM 1026 CB ALA A 216 -15.382 -2.044 21.769 1.00 13.24 C ATOM 1027 H ALA A 216 -13.021 -2.468 20.433 1.00 0.00 H ATOM 1028 N HIS A 217 -16.425 -4.449 19.727 1.00 10.11 N ATOM 1029 CA HIS A 217 -17.182 -4.709 18.508 1.00 9.56 C ATOM 1030 C HIS A 217 -17.899 -3.453 18.085 1.00 9.37 C ATOM 1031 O HIS A 217 -18.514 -2.757 18.912 1.00 11.80 O ATOM 1032 CB HIS A 217 -18.260 -5.801 18.774 1.00 10.48 C ATOM 1033 CG HIS A 217 -19.160 -6.026 17.584 1.00 11.19 C ATOM 1034 ND1 HIS A 217 -18.674 -6.553 16.410 1.00 12.22 N ATOM 1035 CD2 HIS A 217 -20.443 -5.653 17.367 1.00 14.12 C ATOM 1036 CE1 HIS A 217 -19.658 -6.549 15.547 1.00 12.99 C ATOM 1037 NE2 HIS A 217 -20.725 -5.984 16.067 1.00 13.48 N ATOM 1038 H HIS A 217 -16.603 -5.041 20.563 1.00 0.00 H ATOM 1039 N LEU A 218 -17.836 -3.167 16.805 1.00 8.80 N ATOM 1040 CA LEU A 218 -18.462 -2.015 16.191 1.00 9.10 C ATOM 1041 C LEU A 218 -19.620 -2.396 15.282 1.00 8.70 C ATOM 1042 O LEU A 218 -20.738 -1.895 15.452 1.00 10.74 O ATOM 1043 CB LEU A 218 -17.422 -1.172 15.448 1.00 9.63 C ATOM 1044 CG LEU A 218 -17.972 0.049 14.763 1.00 10.21 C ATOM 1045 CD1 LEU A 218 -18.673 1.005 15.731 1.00 11.11 C ATOM 1046 CD2 LEU A 218 -16.888 0.750 13.950 1.00 12.18 C ATOM 1047 H LEU A 218 -17.300 -3.812 16.190 1.00 0.00 H ATOM 1048 N LEU A 219 -19.369 -3.206 14.239 1.00 9.77 N ATOM 1049 CA LEU A 219 -20.425 -3.460 13.254 1.00 9.20 C ATOM 1050 C LEU A 219 -20.042 -4.735 12.499 1.00 9.11 C ATOM 1051 O LEU A 219 -18.922 -5.230 12.525 1.00 9.20 O ATOM 1052 CB LEU A 219 -20.572 -2.287 12.294 1.00 9.89 C ATOM 1053 CG LEU A 219 -19.406 -1.807 11.413 1.00 9.40 C ATOM 1054 CD1 LEU A 219 -19.197 -2.702 10.169 1.00 10.34 C ATOM 1055 CD2 LEU A 219 -19.638 -0.345 10.987 1.00 11.14 C ATOM 1056 H LEU A 219 -18.434 -3.649 14.132 1.00 0.00 H ATOM 1057 N GLN A 220 -21.046 -5.256 11.770 1.00 9.90 N ATOM 1058 CA GLN A 220 -20.913 -6.341 10.780 1.00 10.84 C ATOM 1059 C GLN A 220 -21.373 -5.850 9.438 1.00 9.24 C ATOM 1060 O GLN A 220 -22.323 -5.025 9.400 1.00 11.82 O ATOM 1061 CB GLN A 220 -21.805 -7.509 11.123 1.00 13.19 C ATOM 1062 CG GLN A 220 -21.268 -8.184 12.360 1.00 15.52 C ATOM 1063 CD GLN A 220 -22.046 -9.351 12.865 1.00 18.65 C ATOM 1064 OE1 GLN A 220 -21.728 -9.806 13.942 1.00 23.56 O ATOM 1065 NE2 GLN A 220 -23.088 -9.823 12.135 1.00 17.52 N ATOM 1066 HE22 GLN A 220 -23.316 -9.393 11.216 1.00 0.00 H ATOM 1067 HE21 GLN A 220 -23.659 -10.614 12.495 1.00 0.00 H ATOM 1068 H GLN A 220 -21.996 -4.860 11.917 1.00 0.00 H ATOM 1069 N TYR A 221 -20.802 -6.382 8.373 1.00 9.40 N ATOM 1070 CA TYR A 221 -21.220 -5.999 6.992 1.00 9.32 C ATOM 1071 C TYR A 221 -21.346 -7.297 6.202 1.00 8.23 C ATOM 1072 O TYR A 221 -20.361 -7.978 5.967 1.00 8.76 O ATOM 1073 CB TYR A 221 -20.176 -5.073 6.382 1.00 9.04 C ATOM 1074 CG TYR A 221 -20.545 -4.517 5.039 1.00 8.71 C ATOM 1075 CD1 TYR A 221 -21.316 -3.332 4.970 1.00 8.88 C ATOM 1076 CD2 TYR A 221 -20.153 -5.145 3.866 1.00 9.06 C ATOM 1077 CE1 TYR A 221 -21.632 -2.805 3.773 1.00 8.44 C ATOM 1078 CE2 TYR A 221 -20.481 -4.586 2.633 1.00 8.41 C ATOM 1079 CZ TYR A 221 -21.227 -3.417 2.562 1.00 7.99 C ATOM 1080 OH TYR A 221 -21.543 -2.802 1.382 1.00 8.71 O ATOM 1081 HH TYR A 221 -20.710 -2.550 0.909 1.00 0.00 H ATOM 1082 H TYR A 221 -20.044 -7.083 8.499 1.00 0.00 H ATOM 1083 N ASN A 222 -22.555 -7.607 5.788 1.00 9.20 N ATOM 1084 CA ASN A 222 -22.794 -8.854 5.115 1.00 9.12 C ATOM 1085 C ASN A 222 -22.116 -8.873 3.748 1.00 8.92 C ATOM 1086 O ASN A 222 -22.026 -7.823 3.022 1.00 9.02 O ATOM 1087 CB ASN A 222 -24.329 -8.969 4.941 1.00 8.68 C ATOM 1088 CG ASN A 222 -25.089 -9.436 6.206 1.00 13.74 C ATOM 1089 OD1 ASN A 222 -24.517 -9.928 7.171 1.00 15.37 O ATOM 1090 ND2 ASN A 222 -26.384 -9.114 6.209 1.00 18.33 N ATOM 1091 HD22 ASN A 222 -26.818 -8.698 5.360 1.00 0.00 H ATOM 1092 HD21 ASN A 222 -26.959 -9.279 7.060 1.00 0.00 H ATOM 1093 H ASN A 222 -23.342 -6.946 5.948 1.00 0.00 H ATOM 1094 N HIS A 223 -21.637 -10.040 3.340 1.00 8.16 N ATOM 1095 CA HIS A 223 -20.961 -10.168 2.029 1.00 8.53 C ATOM 1096 C HIS A 223 -21.906 -9.930 0.883 1.00 8.58 C ATOM 1097 O HIS A 223 -22.812 -10.722 0.670 1.00 11.79 O ATOM 1098 CB HIS A 223 -20.261 -11.515 1.891 1.00 8.07 C ATOM 1099 CG HIS A 223 -19.189 -11.767 2.891 1.00 7.99 C ATOM 1100 ND1 HIS A 223 -18.116 -10.885 3.053 1.00 8.56 N ATOM 1101 CD2 HIS A 223 -18.963 -12.801 3.749 1.00 8.13 C ATOM 1102 CE1 HIS A 223 -17.324 -11.374 3.980 1.00 8.05 C ATOM 1103 NE2 HIS A 223 -17.834 -12.532 4.392 1.00 9.65 N ATOM 1104 H HIS A 223 -21.737 -10.877 3.949 1.00 0.00 H ATOM 1105 N ARG A 224 -21.666 -8.884 0.147 1.00 8.10 N ATOM 1106 CA ARG A 224 -22.348 -8.620 -1.125 1.00 8.34 C ATOM 1107 C ARG A 224 -21.554 -9.235 -2.282 1.00 7.59 C ATOM 1108 O ARG A 224 -22.121 -9.811 -3.226 1.00 9.08 O ATOM 1109 CB ARG A 224 -22.550 -7.137 -1.358 1.00 8.42 C ATOM 1110 CG ARG A 224 -23.334 -6.445 -0.259 1.00 8.97 C ATOM 1111 CD ARG A 224 -23.674 -5.012 -0.607 1.00 9.06 C ATOM 1112 NE ARG A 224 -24.208 -4.274 0.512 1.00 9.49 N ATOM 1113 CZ ARG A 224 -24.395 -2.967 0.532 1.00 10.29 C ATOM 1114 NH1 ARG A 224 -24.212 -2.239 -0.567 1.00 10.56 N ATOM 1115 NH2 ARG A 224 -24.740 -2.345 1.638 1.00 11.24 N ATOM 1116 HE ARG A 224 -24.464 -4.811 1.365 1.00 0.00 H ATOM 1117 HH12 ARG A 224 -24.362 -1.210 -0.540 1.00 0.00 H ATOM 1118 HH11 ARG A 224 -23.919 -2.699 -1.453 1.00 0.00 H ATOM 1119 HH22 ARG A 224 -24.882 -1.315 1.632 1.00 0.00 H ATOM 1120 HH21 ARG A 224 -24.870 -2.883 2.518 1.00 0.00 H ATOM 1121 H ARG A 224 -20.955 -8.201 0.477 1.00 0.00 H ATOM 1122 N VAL A 225 -20.251 -9.014 -2.276 1.00 7.39 N ATOM 1123 CA VAL A 225 -19.302 -9.672 -3.194 1.00 7.39 C ATOM 1124 C VAL A 225 -18.994 -11.027 -2.616 1.00 7.78 C ATOM 1125 O VAL A 225 -18.520 -11.155 -1.489 1.00 10.45 O ATOM 1126 CB VAL A 225 -18.045 -8.815 -3.348 1.00 7.67 C ATOM 1127 CG1 VAL A 225 -17.027 -9.546 -4.175 1.00 9.12 C ATOM 1128 CG2 VAL A 225 -18.392 -7.461 -3.957 1.00 8.91 C ATOM 1129 H VAL A 225 -19.873 -8.337 -1.584 1.00 0.00 H ATOM 1130 N LYS A 226 -19.338 -12.029 -3.432 1.00 7.45 N ATOM 1131 CA LYS A 226 -19.382 -13.464 -3.043 1.00 7.32 C ATOM 1132 C LYS A 226 -18.048 -14.167 -3.267 1.00 7.27 C ATOM 1133 O LYS A 226 -17.732 -15.160 -2.584 1.00 7.88 O ATOM 1134 CB LYS A 226 -20.493 -14.228 -3.858 1.00 8.85 C ATOM 1135 CG LYS A 226 -21.859 -13.614 -3.772 1.00 8.84 C ATOM 1136 CD LYS A 226 -22.433 -13.739 -2.402 1.00 8.73 C ATOM 1137 CE LYS A 226 -23.734 -13.050 -2.252 1.00 7.81 C ATOM 1138 NZ LYS A 226 -24.109 -13.025 -0.833 1.00 6.44 N ATOM 1139 HZ1 LYS A 226 -24.188 -14.000 -0.479 1.00 0.00 H ATOM 1140 HZ2 LYS A 226 -23.381 -12.516 -0.292 1.00 0.00 H ATOM 1141 HZ3 LYS A 226 -25.023 -12.541 -0.726 1.00 0.00 H ATOM 1142 H LYS A 226 -19.594 -11.787 -4.411 1.00 0.00 H ATOM 1143 N LYS A 227 -17.227 -13.652 -4.237 1.00 7.45 N ATOM 1144 CA LYS A 227 -15.980 -14.264 -4.577 1.00 7.72 C ATOM 1145 C LYS A 227 -14.873 -13.747 -3.667 1.00 7.24 C ATOM 1146 O LYS A 227 -14.044 -12.889 -4.006 1.00 7.34 O ATOM 1147 CB LYS A 227 -15.630 -13.975 -6.058 1.00 8.83 C ATOM 1148 CG LYS A 227 -16.485 -14.788 -7.060 1.00 8.95 C ATOM 1149 CD LYS A 227 -16.260 -14.430 -8.499 1.00 9.41 C ATOM 1150 CE LYS A 227 -17.407 -14.897 -9.414 1.00 12.31 C ATOM 1151 NZ LYS A 227 -17.332 -14.449 -10.808 1.00 14.65 N ATOM 1152 HZ1 LYS A 227 -17.340 -13.409 -10.838 1.00 0.00 H ATOM 1153 HZ2 LYS A 227 -16.453 -14.803 -11.238 1.00 0.00 H ATOM 1154 HZ3 LYS A 227 -18.150 -14.818 -11.334 1.00 0.00 H ATOM 1155 H LYS A 227 -17.520 -12.790 -4.741 1.00 0.00 H ATOM 1156 N LEU A 228 -14.879 -14.272 -2.427 1.00 7.61 N ATOM 1157 CA LEU A 228 -13.953 -13.796 -1.398 1.00 8.13 C ATOM 1158 C LEU A 228 -12.515 -13.936 -1.812 1.00 6.99 C ATOM 1159 O LEU A 228 -11.690 -13.071 -1.504 1.00 7.64 O ATOM 1160 CB LEU A 228 -14.246 -14.477 -0.120 1.00 13.13 C ATOM 1161 CG LEU A 228 -15.583 -14.365 0.589 1.00 9.74 C ATOM 1162 CD1 LEU A 228 -15.647 -15.120 1.889 1.00 10.56 C ATOM 1163 CD2 LEU A 228 -16.075 -12.953 0.716 1.00 10.41 C ATOM 1164 H LEU A 228 -15.554 -15.029 -2.196 1.00 0.00 H ATOM 1165 N ASN A 229 -12.147 -14.997 -2.492 1.00 7.96 N ATOM 1166 CA ASN A 229 -10.774 -15.242 -2.869 1.00 8.84 C ATOM 1167 C ASN A 229 -10.343 -14.358 -4.075 1.00 7.85 C ATOM 1168 O ASN A 229 -9.256 -14.589 -4.595 1.00 9.19 O ATOM 1169 CB ASN A 229 -10.490 -16.700 -3.089 1.00 10.22 C ATOM 1170 CG ASN A 229 -11.161 -17.242 -4.340 1.00 9.11 C ATOM 1171 OD1 ASN A 229 -11.803 -16.517 -5.149 1.00 7.76 O ATOM 1172 ND2 ASN A 229 -11.044 -18.602 -4.488 1.00 11.05 N ATOM 1173 HD22 ASN A 229 -10.504 -19.156 -3.793 1.00 0.00 H ATOM 1174 HD21 ASN A 229 -11.496 -19.078 -5.295 1.00 0.00 H ATOM 1175 H ASN A 229 -12.872 -15.688 -2.770 1.00 0.00 H ATOM 1176 N GLU A 230 -11.176 -13.405 -4.491 1.00 7.13 N ATOM 1177 CA GLU A 230 -10.736 -12.400 -5.472 1.00 7.23 C ATOM 1178 C GLU A 230 -10.662 -11.006 -4.859 1.00 6.91 C ATOM 1179 O GLU A 230 -10.286 -10.057 -5.562 1.00 7.41 O ATOM 1180 CB GLU A 230 -11.723 -12.388 -6.658 1.00 7.70 C ATOM 1181 CG GLU A 230 -11.711 -13.696 -7.416 1.00 8.19 C ATOM 1182 CD GLU A 230 -12.510 -13.734 -8.654 1.00 8.43 C ATOM 1183 OE1 GLU A 230 -13.146 -12.731 -9.008 1.00 9.76 O ATOM 1184 OE2 GLU A 230 -12.543 -14.813 -9.309 1.00 12.40 O ATOM 1185 H GLU A 230 -12.147 -13.371 -4.119 1.00 0.00 H ATOM 1186 N ILE A 231 -10.930 -10.874 -3.567 1.00 6.90 N ATOM 1187 CA ILE A 231 -10.802 -9.626 -2.803 1.00 6.63 C ATOM 1188 C ILE A 231 -9.366 -9.494 -2.335 1.00 7.24 C ATOM 1189 O ILE A 231 -9.050 -9.888 -1.187 1.00 8.80 O ATOM 1190 CB ILE A 231 -11.818 -9.516 -1.665 1.00 7.26 C ATOM 1191 CG1 ILE A 231 -13.233 -9.758 -2.160 1.00 7.68 C ATOM 1192 CG2 ILE A 231 -11.693 -8.190 -0.938 1.00 7.69 C ATOM 1193 CD1 ILE A 231 -14.299 -9.879 -1.053 1.00 8.51 C ATOM 1194 H ILE A 231 -11.256 -11.719 -3.055 1.00 0.00 H ATOM 1195 N SER A 232 -8.484 -9.070 -3.236 1.00 7.29 N ATOM 1196 CA SER A 232 -7.072 -9.314 -3.105 1.00 7.00 C ATOM 1197 C SER A 232 -6.195 -8.119 -2.734 1.00 7.37 C ATOM 1198 O SER A 232 -4.981 -8.245 -2.716 1.00 7.78 O ATOM 1199 CB SER A 232 -6.487 -9.944 -4.390 1.00 11.95 C ATOM 1200 OG SER A 232 -7.218 -11.122 -4.607 1.00 12.44 O ATOM 1201 HG SER A 232 -8.176 -10.899 -4.720 1.00 0.00 H ATOM 1202 H SER A 232 -8.827 -8.543 -4.065 1.00 0.00 H ATOM 1203 N LYS A 233 -6.856 -7.012 -2.381 1.00 7.08 N ATOM 1204 CA LYS A 233 -6.096 -5.863 -1.895 1.00 7.27 C ATOM 1205 C LYS A 233 -6.968 -5.115 -0.872 1.00 7.30 C ATOM 1206 O LYS A 233 -8.166 -5.084 -0.959 1.00 7.75 O ATOM 1207 CB LYS A 233 -5.719 -4.870 -3.032 1.00 9.16 C ATOM 1208 CG LYS A 233 -4.707 -5.243 -4.081 1.00 9.71 C ATOM 1209 CD LYS A 233 -4.630 -4.124 -5.086 1.00 12.94 C ATOM 1210 CE LYS A 233 -3.890 -4.521 -6.367 1.00 12.87 C ATOM 1211 NZ LYS A 233 -2.377 -4.459 -6.165 1.00 15.11 N ATOM 1212 HZ1 LYS A 233 -2.102 -3.490 -5.907 1.00 0.00 H ATOM 1213 HZ2 LYS A 233 -2.103 -5.113 -5.404 1.00 0.00 H ATOM 1214 HZ3 LYS A 233 -1.899 -4.732 -7.047 1.00 0.00 H ATOM 1215 H LYS A 233 -7.893 -6.970 -2.451 1.00 0.00 H ATOM 1216 N LEU A 234 -6.260 -4.528 0.123 1.00 7.57 N ATOM 1217 CA LEU A 234 -6.849 -3.597 1.039 1.00 7.50 C ATOM 1218 C LEU A 234 -6.123 -2.246 0.882 1.00 7.60 C ATOM 1219 O LEU A 234 -4.949 -2.131 1.113 1.00 9.66 O ATOM 1220 CB LEU A 234 -6.707 -4.070 2.471 1.00 8.23 C ATOM 1221 CG LEU A 234 -7.111 -3.053 3.544 1.00 9.81 C ATOM 1222 CD1 LEU A 234 -8.537 -2.624 3.464 1.00 11.00 C ATOM 1223 CD2 LEU A 234 -6.783 -3.599 4.924 1.00 11.89 C ATOM 1224 H LEU A 234 -5.252 -4.762 0.226 1.00 0.00 H ATOM 1225 N GLY A 235 -6.957 -1.233 0.517 1.00 7.74 N ATOM 1226 CA GLY A 235 -6.438 0.146 0.507 1.00 7.83 C ATOM 1227 C GLY A 235 -6.799 0.867 1.812 1.00 7.50 C ATOM 1228 O GLY A 235 -7.903 0.743 2.277 1.00 9.12 O ATOM 1229 H GLY A 235 -7.943 -1.429 0.250 1.00 0.00 H ATOM 1230 N ILE A 236 -5.860 1.609 2.323 1.00 8.50 N ATOM 1231 CA ILE A 236 -6.017 2.390 3.557 1.00 8.22 C ATOM 1232 C ILE A 236 -5.712 3.834 3.180 1.00 8.97 C ATOM 1233 O ILE A 236 -4.608 4.164 2.770 1.00 10.69 O ATOM 1234 CB ILE A 236 -5.073 1.894 4.666 1.00 8.67 C ATOM 1235 CG1 ILE A 236 -5.345 0.436 4.942 1.00 8.65 C ATOM 1236 CG2 ILE A 236 -5.221 2.779 5.923 1.00 10.07 C ATOM 1237 CD1 ILE A 236 -4.388 -0.229 5.898 1.00 9.19 C ATOM 1238 H ILE A 236 -4.946 1.651 1.829 1.00 0.00 H ATOM 1239 N SER A 237 -6.716 4.745 3.395 1.00 9.56 N ATOM 1240 CA SER A 237 -6.558 6.155 2.973 1.00 9.64 C ATOM 1241 C SER A 237 -7.212 7.068 4.027 1.00 9.97 C ATOM 1242 O SER A 237 -7.949 6.642 4.893 1.00 10.00 O ATOM 1243 CB SER A 237 -7.177 6.375 1.631 1.00 12.26 C ATOM 1244 OG SER A 237 -8.493 6.061 1.567 1.00 13.95 O ATOM 1245 HG SER A 237 -8.614 5.104 1.789 1.00 0.00 H ATOM 1246 H SER A 237 -7.596 4.442 3.859 1.00 0.00 H ATOM 1247 N GLY A 238 -6.863 8.324 3.882 1.00 10.70 N ATOM 1248 CA GLY A 238 -7.457 9.386 4.666 1.00 10.77 C ATOM 1249 C GLY A 238 -6.549 9.902 5.776 1.00 9.04 C ATOM 1250 O GLY A 238 -5.336 9.878 5.702 1.00 9.76 O ATOM 1251 H GLY A 238 -6.135 8.565 3.180 1.00 0.00 H ATOM 1252 N ASP A 239 -7.211 10.483 6.786 1.00 9.39 N ATOM 1253 CA ASP A 239 -6.585 11.467 7.669 1.00 9.18 C ATOM 1254 C ASP A 239 -6.003 10.784 8.926 1.00 8.45 C ATOM 1255 O ASP A 239 -6.443 11.053 10.060 1.00 9.03 O ATOM 1256 CB ASP A 239 -7.586 12.536 7.997 1.00 10.03 C ATOM 1257 CG ASP A 239 -8.066 13.294 6.765 1.00 10.92 C ATOM 1258 OD1 ASP A 239 -7.298 13.372 5.759 1.00 13.68 O ATOM 1259 OD2 ASP A 239 -9.187 13.806 6.812 1.00 11.27 O ATOM 1260 H ASP A 239 -8.205 10.225 6.948 1.00 0.00 H ATOM 1261 N ILE A 240 -5.039 9.915 8.699 1.00 9.11 N ATOM 1262 CA ILE A 240 -4.357 9.146 9.721 1.00 8.40 C ATOM 1263 C ILE A 240 -2.855 9.176 9.509 1.00 9.88 C ATOM 1264 O ILE A 240 -2.407 9.309 8.359 1.00 10.91 O ATOM 1265 CB ILE A 240 -4.837 7.681 9.807 1.00 8.55 C ATOM 1266 CG1 ILE A 240 -4.492 6.886 8.530 1.00 9.88 C ATOM 1267 CG2 ILE A 240 -6.341 7.624 10.076 1.00 9.61 C ATOM 1268 CD1 ILE A 240 -4.765 5.409 8.639 1.00 10.84 C ATOM 1269 H ILE A 240 -4.745 9.770 7.712 1.00 0.00 H ATOM 1270 N ASP A 241 -2.155 8.974 10.597 1.00 9.03 N ATOM 1271 CA ASP A 241 -0.792 8.473 10.570 1.00 10.11 C ATOM 1272 C ASP A 241 -0.912 6.972 10.749 1.00 9.77 C ATOM 1273 O ASP A 241 -1.454 6.474 11.742 1.00 11.94 O ATOM 1274 CB ASP A 241 0.007 9.078 11.741 1.00 12.04 C ATOM 1275 CG ASP A 241 0.207 10.567 11.624 1.00 18.99 C ATOM 1276 OD1 ASP A 241 0.286 11.097 10.485 1.00 22.94 O ATOM 1277 OD2 ASP A 241 0.267 11.223 12.686 1.00 25.69 O ATOM 1278 H ASP A 241 -2.593 9.181 11.518 1.00 0.00 H ATOM 1279 N LEU A 242 -0.446 6.240 9.757 1.00 10.15 N ATOM 1280 CA LEU A 242 -0.597 4.764 9.726 1.00 9.37 C ATOM 1281 C LEU A 242 0.667 4.113 10.263 1.00 10.71 C ATOM 1282 O LEU A 242 1.761 4.335 9.703 1.00 12.28 O ATOM 1283 CB LEU A 242 -0.845 4.330 8.304 1.00 10.36 C ATOM 1284 CG LEU A 242 -1.028 2.848 8.071 1.00 10.59 C ATOM 1285 CD1 LEU A 242 -2.199 2.227 8.840 1.00 10.75 C ATOM 1286 CD2 LEU A 242 -1.219 2.542 6.577 1.00 11.34 C ATOM 1287 H LEU A 242 0.044 6.712 8.970 1.00 0.00 H ATOM 1288 N THR A 243 0.513 3.358 11.336 1.00 9.96 N ATOM 1289 CA THR A 243 1.608 2.669 11.998 1.00 11.68 C ATOM 1290 C THR A 243 1.903 1.312 11.399 1.00 12.27 C ATOM 1291 O THR A 243 3.033 0.989 11.102 1.00 15.11 O ATOM 1292 CB THR A 243 1.312 2.606 13.509 1.00 14.43 C ATOM 1293 OG1 THR A 243 1.210 3.979 13.948 1.00 16.10 O ATOM 1294 CG2 THR A 243 2.375 1.828 14.224 1.00 17.32 C ATOM 1295 HG1 THR A 243 1.019 4.000 14.919 1.00 0.00 H ATOM 1296 H THR A 243 -0.444 3.251 11.728 1.00 0.00 H ATOM 1297 N SER A 244 0.850 0.531 11.200 1.00 11.24 N ATOM 1298 CA SER A 244 1.024 -0.816 10.675 1.00 11.89 C ATOM 1299 C SER A 244 -0.285 -1.392 10.161 1.00 11.25 C ATOM 1300 O SER A 244 -1.352 -0.933 10.514 1.00 10.09 O ATOM 1301 CB SER A 244 1.590 -1.777 11.684 1.00 15.69 C ATOM 1302 OG SER A 244 0.768 -1.874 12.805 1.00 15.67 O ATOM 1303 HG SER A 244 1.165 -2.512 13.450 1.00 0.00 H ATOM 1304 H SER A 244 -0.104 0.882 11.420 1.00 0.00 H ATOM 1305 N ALA A 245 -0.123 -2.324 9.236 1.00 11.97 N ATOM 1306 CA ALA A 245 -1.268 -3.045 8.659 1.00 11.11 C ATOM 1307 C ALA A 245 -0.834 -4.442 8.334 1.00 12.00 C ATOM 1308 O ALA A 245 0.158 -4.606 7.618 1.00 13.80 O ATOM 1309 CB ALA A 245 -1.744 -2.332 7.408 1.00 12.89 C ATOM 1310 H ALA A 245 0.837 -2.552 8.909 1.00 0.00 H ATOM 1311 N SER A 246 -1.575 -5.425 8.869 1.00 11.39 N ATOM 1312 CA SER A 246 -1.131 -6.808 8.695 1.00 11.67 C ATOM 1313 C SER A 246 -2.334 -7.737 8.800 1.00 10.37 C ATOM 1314 O SER A 246 -3.432 -7.304 9.120 1.00 11.96 O ATOM 1315 CB SER A 246 -0.066 -7.135 9.697 1.00 15.05 C ATOM 1316 OG SER A 246 -0.612 -7.167 10.999 1.00 17.33 O ATOM 1317 HG SER A 246 -1.320 -7.858 11.042 1.00 0.00 H ATOM 1318 H SER A 246 -2.445 -5.208 9.395 1.00 0.00 H ATOM 1319 N TYR A 247 -2.073 -9.035 8.545 1.00 10.85 N ATOM 1320 CA TYR A 247 -3.116 -10.033 8.688 1.00 11.00 C ATOM 1321 C TYR A 247 -2.554 -11.327 9.308 1.00 11.67 C ATOM 1322 O TYR A 247 -1.324 -11.586 9.275 1.00 13.15 O ATOM 1323 CB TYR A 247 -3.815 -10.364 7.339 1.00 11.47 C ATOM 1324 CG TYR A 247 -2.893 -10.625 6.231 1.00 10.23 C ATOM 1325 CD1 TYR A 247 -2.179 -11.834 6.159 1.00 11.83 C ATOM 1326 CD2 TYR A 247 -2.675 -9.714 5.240 1.00 11.12 C ATOM 1327 CE1 TYR A 247 -1.272 -12.042 5.141 1.00 11.85 C ATOM 1328 CE2 TYR A 247 -1.800 -9.954 4.193 1.00 13.23 C ATOM 1329 CZ TYR A 247 -1.092 -11.128 4.133 1.00 10.81 C ATOM 1330 OH TYR A 247 -0.203 -11.291 3.137 1.00 12.34 O ATOM 1331 HH TYR A 247 0.486 -10.582 3.192 1.00 0.00 H ATOM 1332 H TYR A 247 -1.120 -9.322 8.244 1.00 0.00 H ATOM 1333 N THR A 248 -3.482 -12.121 9.839 1.00 12.34 N ATOM 1334 CA THR A 248 -3.161 -13.447 10.364 1.00 13.04 C ATOM 1335 C THR A 248 -4.436 -14.303 10.310 1.00 14.08 C ATOM 1336 O THR A 248 -5.537 -13.793 10.091 1.00 16.71 O ATOM 1337 CB THR A 248 -2.554 -13.323 11.778 1.00 15.35 C ATOM 1338 OG1 THR A 248 -1.923 -14.573 12.114 1.00 18.67 O ATOM 1339 CG2 THR A 248 -3.691 -12.998 12.798 1.00 15.49 C ATOM 1340 HG1 THR A 248 -2.598 -15.297 12.097 1.00 0.00 H ATOM 1341 H THR A 248 -4.466 -11.787 9.882 1.00 0.00 H ATOM 1342 N MET A 249 -4.259 -15.616 10.515 1.00 16.44 N ATOM 1343 CA MET A 249 -5.410 -16.498 10.566 1.00 18.95 C ATOM 1344 C MET A 249 -5.667 -16.847 12.036 1.00 18.95 C ATOM 1345 O MET A 249 -4.762 -17.241 12.765 1.00 32.72 O ATOM 1346 CB MET A 249 -5.235 -17.759 9.694 1.00 21.45 C ATOM 1347 CG MET A 249 -4.839 -17.489 8.240 1.00 21.79 C ATOM 1348 SD MET A 249 -6.147 -16.800 7.176 1.00 15.39 S ATOM 1349 CE MET A 249 -7.369 -18.004 7.421 1.00 16.43 C ATOM 1350 H MET A 249 -3.301 -16.001 10.637 1.00 0.00 H ATOM 1351 N ILE A 250 -6.869 -16.719 12.476 1.00 19.20 N ATOM 1352 CA ILE A 250 -7.189 -17.123 13.806 1.00 20.47 C ATOM 1353 C ILE A 250 -7.856 -18.468 13.799 1.00 24.83 C ATOM 1354 O ILE A 250 -8.051 -19.008 14.879 1.00 31.28 O ATOM 1355 CB ILE A 250 -8.012 -16.117 14.504 1.00 21.59 C ATOM 1356 CG1 ILE A 250 -9.367 -15.993 13.876 1.00 26.28 C ATOM 1357 CG2 ILE A 250 -7.176 -14.832 14.624 1.00 26.33 C ATOM 1358 CD1 ILE A 250 -10.220 -15.144 14.730 1.00 32.75 C ATOM 1359 OXT ILE A 250 -8.103 -19.074 12.731 1.00 25.99 O ATOM 1360 H ILE A 250 -7.608 -16.321 11.862 1.00 0.00 H TER 1361 ILE A 250 HETATM 1362 O HOH 1 -21.244 5.903 12.892 1.00 12.42 O HETATM 1363 O HOH 2 -14.096 18.379 8.313 1.00 20.24 O HETATM 1364 O HOH 3 -24.650 -8.711 9.717 1.00 30.80 O HETATM 1365 O HOH 4 -26.638 3.774 14.404 1.00 26.38 O HETATM 1366 O HOH 5 -23.906 18.937 15.542 1.00 27.42 O HETATM 1367 O HOH 6 -21.923 2.787 10.389 1.00 13.30 O HETATM 1368 O HOH 7 -5.436 17.028 10.383 1.00 21.16 O HETATM 1369 O HOH 8 -24.353 -0.019 16.513 1.00 37.91 O HETATM 1370 O HOH 9 -7.772 -3.714 -7.027 1.00 32.93 O HETATM 1371 O HOH 10 -10.930 2.035 -4.242 1.00 37.25 O HETATM 1372 O HOH 11 7.945 1.944 7.273 1.00 25.17 O HETATM 1373 O HOH 12 -22.879 8.498 14.162 1.00 36.92 O HETATM 1374 O HOH 13 5.705 6.150 7.075 1.00 36.58 O HETATM 1375 O HOH 14 -14.220 -19.536 15.303 1.00 19.73 O HETATM 1376 O HOH 15 -11.519 16.378 13.315 1.00 23.59 O HETATM 1377 O HOH 16 -25.934 -14.558 8.740 1.00 14.90 O HETATM 1378 O HOH 17 -7.601 -8.454 19.816 1.00106.45 O HETATM 1379 O HOH 18 -12.446 -17.007 -8.022 1.00 81.00 O HETATM 1380 O HOH 19 -2.656 -16.362 13.904 1.00 34.69 O HETATM 1381 O HOH 20 -21.987 1.203 8.850 1.00 23.12 O HETATM 1382 O HOH 21 -7.419 -18.162 -2.262 1.00 17.24 O HETATM 1383 O HOH 22 -8.807 3.342 1.042 1.00 11.56 O HETATM 1384 O HOH 23 -22.844 -2.551 8.221 1.00 15.01 O HETATM 1385 O HOH 24 -22.171 -8.996 16.362 1.00 31.40 O HETATM 1386 O HOH 25 2.887 -3.662 5.990 1.00 41.41 O HETATM 1387 O HOH 26 -9.997 -3.671 17.751 1.00 10.88 O HETATM 1388 O HOH 27 -24.557 13.206 8.819 1.00 21.20 O HETATM 1389 O HOH 28 -20.299 19.903 8.049 1.00 28.41 O HETATM 1390 O HOH 29 -22.983 9.496 1.273 1.00 16.99 O HETATM 1391 O HOH 30 -24.570 4.986 -6.918 1.00 86.67 O HETATM 1392 O HOH 31 -5.153 -7.961 16.161 1.00 19.59 O HETATM 1393 O HOH 32 2.146 -4.238 1.995 1.00 34.02 O HETATM 1394 O HOH 33 -8.510 -15.774 -6.823 1.00 23.60 O HETATM 1395 O HOH 34 0.064 8.020 18.431 1.00 17.52 O HETATM 1396 O HOH 35 -17.663 -12.172 18.103 1.00 17.98 O HETATM 1397 O HOH 36 -9.065 16.084 5.246 1.00 88.69 O HETATM 1398 O HOH 37 -10.097 1.210 -8.669 1.00 21.10 O HETATM 1399 O HOH 38 -15.773 8.623 20.233 1.00 26.44 O HETATM 1400 O HOH 39 -0.772 10.353 6.548 1.00 26.18 O HETATM 1401 O HOH 40 1.144 7.653 7.814 1.00 19.47 O HETATM 1402 O HOH 41 -5.234 -0.602 -2.645 1.00 19.85 O HETATM 1403 O HOH 42 -23.109 -2.674 -14.549 1.00 36.07 O HETATM 1404 O HOH 43 -18.622 -5.842 -11.238 1.00 13.89 O HETATM 1405 O HOH 44 -23.031 5.469 -9.865 1.00 99.01 O HETATM 1406 O HOH 45 -24.566 -11.983 9.053 1.00 16.28 O HETATM 1407 O HOH 46 -26.555 -2.968 8.455 1.00 34.28 O HETATM 1408 O HOH 47 -15.079 -16.084 13.713 1.00 21.91 O HETATM 1409 O HOH 48 -29.192 0.808 4.549 1.00 27.99 O HETATM 1410 O HOH 49 -19.164 9.577 19.651 1.00 32.99 O HETATM 1411 O HOH 50 -8.467 13.391 3.343 1.00 25.86 O HETATM 1412 O HOH 51 -24.038 -5.819 3.034 1.00 10.33 O HETATM 1413 O HOH 52 -26.504 14.708 7.303 1.00 39.54 O HETATM 1414 O HOH 53 -1.056 13.439 13.456 1.00 33.54 O HETATM 1415 O HOH 54 -17.581 -4.845 -15.413 1.00 22.77 O HETATM 1416 O HOH 55 -5.936 -3.573 -9.136 1.00 16.37 O HETATM 1417 O HOH 56 -11.379 15.509 3.242 1.00 35.92 O HETATM 1418 O HOH 57 -26.882 18.151 10.723 1.00 39.53 O HETATM 1419 O HOH 58 -10.558 -7.911 19.561 1.00 28.71 O HETATM 1420 O HOH 59 -24.857 -5.967 6.523 1.00 12.74 O HETATM 1421 O HOH 60 -19.527 -3.260 21.369 1.00 27.97 O HETATM 1422 O HOH 61 -1.502 -6.100 -4.200 1.00 19.15 O HETATM 1423 O HOH 62 -18.279 9.138 -5.192 1.00 39.98 O HETATM 1424 O HOH 63 -34.728 1.085 -0.478 1.00 20.65 O HETATM 1425 O HOH 64 0.594 6.256 -1.636 1.00 27.25 O HETATM 1426 O HOH 65 -12.180 5.271 -0.632 1.00 19.03 O HETATM 1427 O HOH 66 -26.038 -10.907 -0.851 1.00 21.31 O HETATM 1428 O HOH 67 0.865 10.260 15.162 1.00 17.99 O HETATM 1429 O HOH 68 -21.357 1.209 -14.679 1.00 27.20 O HETATM 1430 O HOH 69 -1.550 -9.452 12.162 1.00 17.71 O HETATM 1431 O HOH 70 -7.657 -16.611 -5.505 1.00 32.93 O HETATM 1432 O HOH 71 0.620 -8.800 1.889 1.00 16.60 O HETATM 1433 O HOH 72 -8.147 15.070 20.767 1.00 93.44 O HETATM 1434 O HOH 73 -4.230 -9.446 12.352 1.00 14.73 O HETATM 1435 O HOH 74 -17.230 -7.472 -7.293 1.00 9.79 O HETATM 1436 O HOH 75 -10.584 -20.712 6.641 1.00 25.93 O HETATM 1437 O HOH 76 -2.780 -8.772 -4.286 1.00 10.93 O HETATM 1438 O HOH 77 -4.586 13.690 5.350 1.00 23.70 O HETATM 1439 O HOH 78 -16.769 17.392 5.706 1.00 64.34 O HETATM 1440 O HOH 79 2.494 -2.568 14.851 1.00 40.01 O HETATM 1441 O HOH 80 -13.772 5.836 21.781 1.00 29.44 O HETATM 1442 O HOH 81 -5.143 -3.203 22.069 1.00 31.94 O HETATM 1443 O HOH 82 -13.489 17.516 10.663 1.00 37.41 O HETATM 1444 O HOH 83 -15.401 11.253 -2.201 1.00 33.80 O HETATM 1445 O HOH 84 -12.170 -17.524 0.255 1.00 19.32 O HETATM 1446 O HOH 85 -18.977 -18.419 3.551 1.00 12.13 O HETATM 1447 O HOH 86 -8.731 -1.026 -7.415 1.00 15.63 O HETATM 1448 O HOH 87 -3.136 11.311 4.764 1.00 25.49 O HETATM 1449 O HOH 88 -28.720 3.906 2.874 1.00 19.93 O HETATM 1450 O HOH 89 1.867 -6.439 6.392 1.00 37.19 O HETATM 1451 O HOH 90 -12.684 -20.390 -6.457 1.00 42.23 O HETATM 1452 O HOH 91 -15.498 -2.030 -11.796 1.00 9.79 O HETATM 1453 O HOH 92 -24.702 -15.212 9.748 1.00 34.94 O HETATM 1454 O HOH 93 -7.296 11.742 1.712 1.00 45.51 O HETATM 1455 O HOH 94 -22.517 13.258 2.531 1.00 32.58 O HETATM 1456 O HOH 95 -19.184 -7.488 -0.010 1.00 7.89 O HETATM 1457 O HOH 96 -24.708 20.504 15.098 1.00 31.19 O HETATM 1458 O HOH 97 -16.431 -0.536 -9.009 1.00 9.48 O HETATM 1459 O HOH 98 -9.125 5.727 19.172 1.00 12.17 O HETATM 1460 O HOH 99 -23.288 -5.694 14.946 1.00 25.73 O HETATM 1461 O HOH 100 -22.121 -1.122 17.779 1.00 34.98 O HETATM 1462 O HOH 101 7.414 5.073 5.419 1.00 47.05 O HETATM 1463 O HOH 102 -14.382 -14.447 -11.417 1.00 15.66 O HETATM 1464 O HOH 103 -10.817 7.124 20.761 1.00 17.62 O HETATM 1465 O HOH 104 -19.974 10.794 17.514 1.00 27.47 O HETATM 1466 O HOH 105 -19.427 22.894 9.579 1.00 20.21 O HETATM 1467 O HOH 106 -12.163 1.118 -6.817 1.00 20.05 O HETATM 1468 O HOH 107 -13.919 4.867 -5.022 1.00 69.23 O HETATM 1469 O HOH 108 -24.116 10.236 13.268 1.00 17.52 O HETATM 1470 O HOH 109 -14.909 11.872 16.926 1.00 27.65 O HETATM 1471 O HOH 110 -16.065 -7.641 16.697 1.00 14.54 O HETATM 1472 O HOH 111 -24.935 -9.429 -3.319 1.00 15.25 O HETATM 1473 O HOH 112 -1.644 -1.765 -5.631 1.00 27.48 O HETATM 1474 O HOH 113 -17.536 -9.499 0.602 1.00 7.99 O HETATM 1475 O HOH 114 -23.457 -1.345 -10.275 1.00 25.08 O HETATM 1476 O HOH 115 -31.671 16.686 14.591 1.00 49.02 O HETATM 1477 O HOH 116 -21.974 -8.461 -5.740 1.00 16.89 O HETATM 1478 O HOH 117 -20.593 18.231 5.731 1.00 24.63 O HETATM 1479 O HOH 118 -23.795 11.149 14.428 1.00 21.44 O HETATM 1480 O HOH 119 -15.891 6.859 -5.438 1.00 25.36 O HETATM 1481 O HOH 120 -2.033 -4.854 -8.983 1.00 30.95 O HETATM 1482 O HOH 121 -13.514 -7.376 23.802 1.00 53.86 O HETATM 1483 O HOH 122 -17.902 0.037 19.176 1.00 41.98 O HETATM 1484 O HOH 123 4.640 -0.999 9.789 1.00 22.67 O HETATM 1485 O HOH 124 -13.344 13.716 16.542 1.00 16.17 O HETATM 1486 O HOH 125 -27.260 -6.548 5.251 1.00 30.77 O HETATM 1487 O HOH 126 -18.621 19.820 12.943 1.00 18.01 O HETATM 1488 O HOH 127 -22.456 13.128 15.456 1.00 17.48 O HETATM 1489 O HOH 128 -26.331 6.858 11.367 1.00 25.42 O HETATM 1490 O HOH 129 -13.018 3.517 -2.859 1.00 20.09 O HETATM 1491 O HOH 130 -26.648 -1.991 -2.855 1.00 14.97 O HETATM 1492 O HOH 131 -16.550 14.231 7.183 1.00 16.84 O HETATM 1493 O HOH 132 1.534 -3.055 -2.562 1.00 29.59 O HETATM 1494 O HOH 133 -1.013 -4.110 12.303 1.00 15.23 O HETATM 1495 O HOH 134 -8.742 -3.527 25.651 1.00 43.73 O HETATM 1496 O HOH 135 2.406 9.811 8.967 1.00 47.55 O HETATM 1497 O HOH 136 -13.051 3.908 21.038 1.00 27.21 O HETATM 1498 O HOH 137 -15.124 13.752 21.937 1.00 25.68 O HETATM 1499 O HOH 138 -9.255 -19.859 -2.553 1.00 17.34 O HETATM 1500 O HOH 139 -25.959 1.239 -7.369 1.00 34.63 O HETATM 1501 O HOH 140 -20.112 6.797 19.622 1.00 26.96 O HETATM 1502 O HOH 141 -8.333 17.911 16.490 1.00 25.40 O HETATM 1503 O HOH 142 -11.408 8.323 23.187 1.00 15.03 O HETATM 1504 O HOH 143 -17.609 -11.013 -11.979 1.00 33.60 O HETATM 1505 O HOH 144 -27.602 4.723 0.270 1.00 24.97 O HETATM 1506 O HOH 145 -18.378 5.300 -14.301 1.00 24.80 O HETATM 1507 O HOH 146 -9.205 7.488 17.114 1.00 9.41 O HETATM 1508 O HOH 147 -2.498 13.073 15.404 1.00 26.25 O HETATM 1509 O HOH 148 -26.234 9.000 9.224 1.00 22.92 O HETATM 1510 O HOH 149 -27.836 -3.263 3.121 1.00 35.67 O HETATM 1511 O HOH 150 -2.790 10.811 2.098 1.00 36.29 O HETATM 1512 O HOH 151 -22.026 5.815 -7.527 1.00 24.61 O HETATM 1513 O HOH 152 -11.329 -23.031 12.463 1.00 37.25 O HETATM 1514 O HOH 153 -4.579 -0.324 -5.310 1.00 28.22 O HETATM 1515 O HOH 154 -22.840 -1.549 -5.454 1.00 14.04 O HETATM 1516 O HOH 155 -24.816 21.155 7.139 1.00 38.44 O HETATM 1517 O HOH 156 -10.573 18.279 16.132 1.00 30.24 O HETATM 1518 O HOH 157 -17.948 -8.372 -11.438 1.00 28.18 O HETATM 1519 O HOH 158 -23.749 -4.165 12.470 1.00 17.52 O HETATM 1520 O HOH 159 -16.661 22.538 9.011 1.00 40.02 O HETATM 1521 O HOH 160 -13.897 -16.354 11.280 1.00 18.50 O HETATM 1522 O HOH 161 -12.666 -2.137 24.635 1.00 28.54 O HETATM 1523 O HOH 162 -15.434 0.438 19.106 1.00 29.56 O HETATM 1524 O HOH 163 1.423 9.403 4.681 1.00 56.51 O HETATM 1525 O HOH 164 -2.200 2.818 17.162 1.00 15.44 O HETATM 1526 O HOH 165 -4.141 -6.764 18.665 1.00 15.58 O HETATM 1527 O HOH 166 2.812 -2.906 8.641 1.00 19.07 O HETATM 1528 O HOH 167 -24.985 -12.077 12.935 1.00 38.45 O HETATM 1529 O HOH 168 0.559 -9.515 7.063 1.00 22.99 O HETATM 1530 O HOH 169 -24.043 -3.034 -3.516 1.00 10.60 O HETATM 1531 O HOH 170 -27.314 2.492 15.072 1.00 28.97 O HETATM 1532 O HOH 171 -26.175 1.635 16.910 1.00 51.67 O HETATM 1533 O HOH 172 -1.538 -16.991 10.016 1.00 26.87 O HETATM 1534 O HOH 173 -26.325 -0.325 9.639 1.00 32.10 O HETATM 1535 O HOH 174 -14.473 17.719 12.917 1.00 27.79 O HETATM 1536 O HOH 175 -4.435 -0.267 -8.302 1.00108.24 O HETATM 1537 O HOH 176 -13.693 -8.148 14.905 1.00 11.70 O HETATM 1538 O HOH 177 -6.973 16.828 18.040 1.00 38.68 O HETATM 1539 O HOH 178 -10.810 21.143 16.815 1.00 41.20 O HETATM 1540 O HOH 179 -18.905 -11.757 -6.601 1.00 17.48 O HETATM 1541 O HOH 180 -21.406 -5.748 -11.255 1.00 16.18 O HETATM 1542 O HOH 181 -6.665 -21.908 14.710 1.00 49.84 O HETATM 1543 O HOH 182 -14.579 6.464 -9.506 1.00 47.87 O HETATM 1544 O HOH 183 -20.448 3.563 -14.148 1.00 48.01 O HETATM 1545 O HOH 184 -26.236 18.833 13.703 1.00 33.32 O HETATM 1546 O HOH 185 -26.305 12.188 4.967 1.00 42.70 O HETATM 1547 O HOH 186 -4.424 1.991 -1.645 1.00 24.42 O HETATM 1548 O HOH 187 -2.355 -7.711 -6.598 1.00 21.77 O HETATM 1549 O HOH 188 -25.214 -6.559 9.145 1.00 38.09 O HETATM 1550 O HOH 189 2.690 -11.130 4.743 1.00 27.00 O HETATM 1551 O HOH 190 1.621 7.834 15.648 1.00 29.03 O HETATM 1552 O HOH 191 1.101 9.394 -0.991 1.00 65.38 O HETATM 1553 O HOH 192 2.795 6.656 11.860 1.00 16.07 O HETATM 1554 O HOH 193 -12.887 -20.458 -2.384 1.00 37.32 O HETATM 1555 O HOH 194 4.107 8.825 5.960 1.00 42.10 O HETATM 1556 O HOH 195 -14.625 1.586 20.999 1.00 47.99 O HETATM 1557 O HOH 196 -9.603 6.329 -1.665 1.00 64.39 O HETATM 1558 O HOH 197 -19.483 16.360 4.257 1.00 65.79 O HETATM 1559 O HOH 198 -25.639 -4.896 10.729 1.00 32.39 O HETATM 1560 O HOH 199 -20.337 -9.217 18.141 1.00 27.05 O HETATM 1561 O HOH 200 -12.283 18.378 14.446 1.00 21.47 O HETATM 1562 O HOH 201 -27.287 -6.075 -0.308 1.00 20.11 O HETATM 1563 O HOH 202 -18.442 14.044 5.117 1.00 22.26 O HETATM 1564 O HOH 203 -19.171 12.177 0.628 1.00 45.46 O HETATM 1565 O HOH 204 0.826 -0.941 -4.397 1.00 44.42 O HETATM 1566 O HOH 205 -26.100 11.560 12.894 1.00 32.08 O HETATM 1567 O HOH 206 -25.400 10.814 1.416 1.00 27.28 O HETATM 1568 O HOH 207 -2.466 -15.299 7.287 1.00 15.14 O HETATM 1569 O HOH 208 -21.278 -0.669 20.241 1.00 42.41 O HETATM 1570 O HOH 209 -30.372 -3.396 -2.028 1.00 35.19 O HETATM 1571 O HOH 210 -31.203 -0.722 -2.862 1.00 45.61 O HETATM 1572 O HOH 211 -24.474 -1.203 -7.625 1.00 25.75 O HETATM 1573 O HOH 212 -2.279 2.828 -2.812 1.00 34.61 O HETATM 1574 O HOH 213 -27.219 -11.762 11.107 1.00 43.80 O HETATM 1575 O HOH 214 -16.304 12.880 4.060 1.00 53.71 O HETATM 1576 O HOH 215 -6.227 15.974 8.278 1.00 14.99 O HETATM 1577 O HOH 216 -23.485 -0.401 9.701 1.00 24.72 O HETATM 1578 O HOH 217 -23.519 -3.978 -11.091 1.00 41.72 O HETATM 1579 O HOH 218 -26.456 -6.786 2.271 1.00 17.76 O HETATM 1580 O HOH 219 -0.488 -5.814 14.565 1.00 28.48 O HETATM 1581 O HOH 220 -23.322 -0.270 -15.204 1.00 45.11 O HETATM 1582 O HOH 221 -14.537 21.686 11.302 1.00 32.41 O HETATM 1583 O HOH 222 8.585 5.108 12.226 1.00 48.11 O HETATM 1584 O HOH 223 -6.676 3.635 -0.846 1.00 24.12 O HETATM 1585 O HOH 224 7.039 -0.406 8.280 1.00 45.38 O HETATM 1586 O HOH 225 -27.913 -3.402 -0.779 1.00 22.93 O HETATM 1587 O HOH 226 -20.188 -9.053 -9.798 1.00 46.81 O HETATM 1588 O HOH 227 -6.967 6.399 -2.036 1.00 36.85 O HETATM 1589 O HOH 228 -17.842 4.257 20.743 1.00 35.90 O HETATM 1590 O HOH 229 3.349 -5.284 9.844 1.00 27.49 O HETATM 1591 O HOH 230 -3.780 -10.327 15.667 1.00 37.06 O HETATM 1592 O HOH 231 3.898 -4.221 13.504 1.00 96.14 O HETATM 1593 O HOH 232 -15.033 -18.509 10.349 1.00 26.53 O HETATM 1594 O HOH 233 -19.765 -8.873 -7.195 1.00 13.15 O HETATM 1595 O HOH 234 -28.112 1.455 -5.572 1.00 77.24 O HETATM 1596 O HOH 235 -28.239 -1.201 -4.955 1.00 35.13 O HETATM 1597 O HOH 236 2.740 6.328 17.043 1.00 33.36 O HETATM 1598 O HOH 237 -28.032 14.931 3.092 1.00 58.30 O HETATM 1599 O HOH 238 -1.209 -8.867 14.800 1.00 39.83 O HETATM 1600 O HOH 239 -17.187 -18.640 -11.353 1.00 26.98 O HETATM 1601 O HOH 240 2.344 8.750 17.377 1.00 33.29 O HETATM 1602 O HOH 241 0.780 1.524 -3.196 1.00 33.09 O HETATM 1603 O HOH 242 -25.751 11.460 10.526 1.00 36.56 O HETATM 1604 O HOH 243 -6.834 3.217 -5.280 1.00 44.02 O HETATM 1605 O HOH 244 3.390 4.736 -1.164 1.00 92.42 O HETATM 1606 O HOH 245 -16.047 -17.999 -8.630 1.00 42.73 O HETATM 1607 O HOH 246 -24.495 -7.504 -6.085 1.00 22.52 O HETATM 1608 O HOH 247 5.906 -2.200 12.044 1.00 47.22 O HETATM 1609 O HOH 248 -18.127 -2.120 23.243 1.00129.32 O HETATM 1610 O HOH 249 2.448 -9.812 -0.071 1.00 31.92 O HETATM 1611 O HOH 250 -0.131 12.103 16.996 1.00 57.21 O HETATM 1612 O HOH 251 -0.313 -13.276 16.032 1.00 56.35 O HETATM 1613 O HOH 252 -10.282 -19.381 0.012 1.00 22.88 O HETATM 1614 O HOH 253 1.160 -6.899 -4.737 1.00 59.14 O HETATM 1615 O HOH 254 -0.681 15.575 11.647 1.00 40.24 O HETATM 1616 O HOH 255 -26.207 -6.965 -2.647 1.00 23.47 O HETATM 1617 O HOH 256 -32.573 13.971 15.640 1.00 55.84 O HETATM 1618 O HOH 257 -18.705 1.212 21.289 1.00 35.68 O HETATM 1619 O HOH 258 -14.665 -20.908 8.715 1.00 24.75 O HETATM 1620 O HOH 259 -4.394 16.727 18.418 1.00 35.53 O HETATM 1621 O HOH 260 -29.376 -1.742 5.568 1.00 32.69 O HETATM 1622 O HOH 261 -22.317 6.083 20.942 1.00 24.59 O HETATM 1623 O HOH 262 -28.902 17.563 2.862 1.00 38.21 O HETATM 1624 O HOH 263 -6.190 9.066 -1.368 1.00 36.23 O HETATM 1625 O HOH 264 2.281 -7.125 3.327 1.00 36.74 O HETATM 1626 O HOH 265 -9.630 9.477 -3.859 1.00 43.64 O HETATM 1627 O HOH 266 -16.462 -19.095 2.833 1.00 20.74 O HETATM 1628 O HOH 267 -10.882 -22.036 4.345 1.00 28.73 O HETATM 1629 O HOH 268 -2.367 20.130 16.029 1.00 46.03 O HETATM 1630 O HOH 269 -25.174 -5.321 -4.580 1.00 18.02 O HETATM 1631 O HOH 270 -22.673 -7.723 -10.543 1.00 21.66 O HETATM 1632 O HOH 271 -14.771 -21.512 -8.078 1.00 43.13 O HETATM 1633 O HOH 272 -29.507 -7.543 -1.210 1.00 39.44 O HETATM 1634 O HOH 273 -18.495 7.280 23.755 1.00 31.05 O HETATM 1635 O HOH 274 -21.577 1.382 21.905 1.00 49.97 O HETATM 1636 O HOH 275 2.810 -7.958 -4.104 1.00 18.74 O HETATM 1637 O HOH 276 -8.282 5.913 -5.631 1.00 49.98 O HETATM 1638 O HOH 277 5.178 6.390 -2.247 1.00 38.64 O HETATM 1639 O HOH 278 -8.305 -25.439 6.610 1.00 43.96 O HETATM 1640 C1 BKK A 279 -17.334 7.526 -1.671 1.00 0.15 C HETATM 1641 C3 BKK A 279 -18.110 8.825 -1.585 1.00 0.13 C HETATM 1642 C4 BKK A 279 -19.587 8.489 -1.797 1.00 0.15 C HETATM 1643 S BKK A 279 -20.664 9.820 -1.824 1.00 -0.07 S HETATM 1644 C17 BKK A 279 -21.837 8.976 -2.797 1.00 0.02 C HETATM 1645 C18 BKK A 279 -22.597 7.854 -2.353 1.00 -0.04 C HETATM 1646 C19 BKK A 279 -23.523 7.205 -3.189 1.00 0.03 C HETATM 1647 C14 BKK A 279 -23.737 7.619 -4.500 1.00 -0.05 C HETATM 1648 C15 BKK A 279 -22.976 8.706 -4.913 1.00 -0.07 C HETATM 1649 C16 BKK A 279 -22.081 9.364 -4.122 1.00 -0.05 C HETATM 1650 H13 BKK A 279 -21.542 10.212 -4.530 1.00 0.06 H HETATM 1651 H10 BKK A 279 -23.102 9.054 -5.932 1.00 0.06 H HETATM 1652 H9 BKK A 279 -24.448 7.128 -5.154 1.00 0.06 H HETATM 1653 CL BKK A 279 -24.487 5.805 -2.635 1.00 -0.07 CL HETATM 1654 H12 BKK A 279 -22.457 7.491 -1.341 1.00 0.06 H HETATM 1655 O2 BKK A 279 -20.002 7.600 -0.761 1.00 -0.35 O HETATM 1656 C2 BKK A 279 -19.354 6.350 -0.904 1.00 0.11 C HETATM 1657 C5 BKK A 279 -19.970 5.388 0.108 1.00 0.07 C HETATM 1658 O3 BKK A 279 -21.355 5.153 -0.131 1.00 -0.39 O HETATM 1659 H14 BKK A 279 -21.828 5.975 -0.078 1.00 0.21 H HETATM 1660 H5 BKK A 279 -19.854 5.815 1.115 1.00 0.06 H HETATM 1661 H6 BKK A 279 -19.435 4.428 0.052 1.00 0.06 H HETATM 1662 C BKK A 279 -17.889 6.553 -0.675 1.00 0.12 C HETATM 1663 O BKK A 279 -17.628 6.970 0.652 1.00 -0.39 O HETATM 1664 H16 BKK A 279 -16.693 7.090 0.767 1.00 0.21 H HETATM 1665 H15 BKK A 279 -17.385 5.587 -0.828 1.00 0.07 H HETATM 1666 H2 BKK A 279 -19.510 5.957 -1.920 1.00 0.06 H HETATM 1667 H4 BKK A 279 -19.672 7.975 -2.766 1.00 0.08 H HETATM 1668 O1 BKK A 279 -17.692 9.750 -2.616 1.00 -0.38 O HETATM 1669 H17 BKK A 279 -17.813 9.348 -3.468 1.00 0.21 H HETATM 1670 H3 BKK A 279 -17.961 9.284 -0.596 1.00 0.07 H HETATM 1671 N BKK A 279 -15.916 7.764 -1.445 1.00 -0.16 N HETATM 1672 C6 BKK A 279 -15.209 8.186 -0.382 1.00 0.09 C HETATM 1673 C7 BKK A 279 -13.887 8.176 -0.751 1.00 0.07 C HETATM 1674 C8 BKK A 279 -12.705 8.494 0.044 1.00 -0.03 C HETATM 1675 C10 BKK A 279 -11.488 8.694 -0.588 1.00 -0.03 C HETATM 1676 C13 BKK A 279 -10.363 8.928 0.129 1.00 0.16 C HETATM 1677 C12 BKK A 279 -10.451 8.916 1.567 1.00 0.19 C HETATM 1678 C11 BKK A 279 -11.684 8.730 2.145 1.00 0.16 C HETATM 1679 C9 BKK A 279 -12.792 8.422 1.419 1.00 -0.03 C HETATM 1680 H11 BKK A 279 -13.715 8.129 1.906 1.00 0.05 H HETATM 1681 F BKK A 279 -11.701 8.703 3.516 1.00 -0.19 F HETATM 1682 F1 BKK A 279 -9.341 9.157 2.255 1.00 -0.19 F HETATM 1683 F2 BKK A 279 -9.160 9.108 -0.456 1.00 -0.19 F HETATM 1684 H8 BKK A 279 -11.436 8.663 -1.670 1.00 0.05 H HETATM 1685 N2 BKK A 279 -13.799 7.718 -2.033 1.00 -0.22 N HETATM 1686 N1 BKK A 279 -15.071 7.488 -2.467 1.00 -0.09 N HETATM 1687 H7 BKK A 279 -15.609 8.480 0.587 1.00 0.11 H HETATM 1688 H1 BKK A 279 -17.458 7.105 -2.680 1.00 0.07 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 1640 1641 1662 1671 1688 CONECT 1641 1640 1642 1668 1670 CONECT 1642 1641 1643 1655 1667 CONECT 1643 1642 1644 CONECT 1644 1643 1645 1649 CONECT 1645 1644 1646 1654 CONECT 1646 1645 1647 1653 CONECT 1647 1646 1648 1652 CONECT 1648 1647 1649 1651 CONECT 1649 1644 1648 1650 CONECT 1650 1649 CONECT 1651 1648 CONECT 1652 1647 CONECT 1653 1646 CONECT 1654 1645 CONECT 1655 1642 1656 CONECT 1656 1655 1657 1662 1666 CONECT 1657 1656 1658 1660 1661 CONECT 1658 1657 1659 CONECT 1659 1658 CONECT 1660 1657 CONECT 1661 1657 CONECT 1662 1640 1656 1663 1665 CONECT 1663 1662 1664 CONECT 1664 1663 CONECT 1665 1662 CONECT 1666 1656 CONECT 1667 1642 CONECT 1668 1641 1669 CONECT 1669 1668 CONECT 1670 1641 CONECT 1671 1640 1672 1686 CONECT 1672 1671 1673 1687 CONECT 1673 1672 1674 1685 CONECT 1674 1673 1675 1679 CONECT 1675 1674 1676 1684 CONECT 1676 1675 1677 1683 CONECT 1677 1676 1678 1682 CONECT 1678 1677 1679 1681 CONECT 1679 1674 1678 1680 CONECT 1680 1679 CONECT 1681 1678 CONECT 1682 1677 CONECT 1683 1676 CONECT 1684 1675 CONECT 1685 1673 1686 CONECT 1686 1671 1685 CONECT 1687 1672 CONECT 1688 1640 MASTER 0 0 0 0 0 0 0 0 1687 1 53 11 END
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Related entries of code: 6eog
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
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Protein Sequence Similarity
1kjr
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PDBbind
146aa, >1KJR_1|Chain... at 99%
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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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PDBbind
135aa, >3AYA_1|Chains... at 99%
3ayc
RCSB PDB
PDBbind
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%
5nfb
RCSB PDB
PDBbind
176aa, >5NFB_1|Chain... *
5oax
RCSB PDB
PDBbind
138aa, >5OAX_1|Chain... at 99%
5ody
RCSB PDB
PDBbind
138aa, >5ODY_1|Chain... at 100%
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
RCSB PDB
PDBbind
138aa, >6I76_1|Chain... at 100%
6i75
RCSB PDB
PDBbind
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
6eog
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
Galectin-3
Ligand Name
BKK
EC.Number
E.C.-.-.-.-
Resolution
1.2(Å)
Affinity (Kd/Ki/IC50)
Kd=1.60uM
Release Year
2018
Protein/NA Sequence
Check fasta file
Primary Reference
(2018) ChemMedChem Vol. 13: pp. 133-137
Ligand Properties
Formula
C
2
0
H
1
7
ClF
3
N
3
O
4
S
Molecular Weight
487.880
Exact Mass
487.058
No. of atoms
49
No. of bonds
52
Polar Surface Area
125.93
LOGP Value
2.94 (
Computed with XLOGP3
)
2.79 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 5
No. of Rotatable Bonds: 8
No. of Nitrogen and Oxygen Atoms: 7
No. of Rings: 4
Canonical SMILES
OC[C@H]1O[C@@H](Sc2cccc(c2)Cl)[C@@H]([C@H]([C@H]1O)n1nnc(c1)c1cc(F)c(c(c1)F)F)O
InChI String
InChI=1S/C20H17ClF3N3O4S/c21-10-2-1-3-11(6-10)32-20-19(30)17(18(29)15(8-28)31-20)27-7-14(25-26-27)9-4-12(22)16(24)13(23)5-9/h1-7,15,17-20,28-30H,8H2/t15-,17+,18+,19-,20+/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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