Browse entries in the PDBbind-CN Database
HEADER 6QLT_COMPLEX COMPND 6QLT_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 138 PRO LEU ILE VAL PRO TYR ASN LEU PRO LEU PRO GLY GLY SEQRES 2 A 138 VAL VAL PRO ARG MET LEU ILE THR ILE LEU GLY THR VAL SEQRES 3 A 138 LYS PRO ASN ALA ASN ARG ILE ALA LEU ASP PHE GLN ARG SEQRES 4 A 138 GLY ASN ASP VAL ALA PHE HIS PHE ASN PRO ARG PHE ASN SEQRES 5 A 138 GLU ASN ASN ARG ARG VAL ILE VAL CYS ASN THR LYS LEU SEQRES 6 A 138 ASP ASN ASN TRP GLY ARG GLU GLU ARG GLN SER VAL PHE SEQRES 7 A 138 PRO PHE GLU SER GLY LYS PRO PHE LYS ILE GLN VAL LEU SEQRES 8 A 138 VAL GLU PRO ASP HIS PHE LYS VAL ALA VAL ASN ASP ALA SEQRES 9 A 138 HIS LEU LEU GLN TYR ASN HIS ARG VAL LYS LYS LEU ASN SEQRES 10 A 138 GLU ILE SER LYS LEU GLY ILE SER GLY ASP ILE ASP LEU SEQRES 11 A 138 THR SER ALA SER TYR THR MET ILE HET J A 5W 52 ATOM 1 N PRO A 113 6.514 6.070 10.115 1.00 30.29 N ATOM 2 CA PRO A 113 5.120 5.735 9.820 1.00 29.19 C ATOM 3 C PRO A 113 4.972 5.320 8.372 1.00 24.12 C ATOM 4 O PRO A 113 5.853 5.648 7.565 1.00 26.22 O ATOM 5 CB PRO A 113 4.383 7.051 10.036 1.00 30.99 C ATOM 6 HN3 PRO A 113 6.817 6.855 9.504 1.00 0.00 H ATOM 7 HN2 PRO A 113 7.114 5.239 9.937 1.00 0.00 H ATOM 8 HN1 PRO A 113 6.598 6.353 11.112 1.00 0.00 H ATOM 9 N LEU A 114 3.875 4.647 8.049 1.00 20.37 N ATOM 10 CA LEU A 114 3.606 4.218 6.687 1.00 18.54 C ATOM 11 C LEU A 114 3.009 5.365 5.875 1.00 18.18 C ATOM 12 O LEU A 114 2.314 6.254 6.397 1.00 20.29 O ATOM 13 CB LEU A 114 2.600 3.062 6.713 1.00 19.52 C ATOM 14 CG LEU A 114 3.033 1.808 7.483 1.00 21.18 C ATOM 15 CD1 LEU A 114 1.967 0.722 7.443 1.00 22.31 C ATOM 16 CD2 LEU A 114 4.370 1.291 6.961 1.00 23.07 C ATOM 17 H LEU A 114 3.186 4.419 8.794 1.00 0.00 H ATOM 18 N ILE A 115 3.211 5.291 4.570 1.00 18.33 N ATOM 19 CA ILE A 115 2.628 6.284 3.685 1.00 19.62 C ATOM 20 C ILE A 115 1.131 6.040 3.604 1.00 15.52 C ATOM 21 O ILE A 115 0.675 4.896 3.533 1.00 18.75 O ATOM 22 CB ILE A 115 3.285 6.214 2.295 1.00 24.15 C ATOM 23 CG1 ILE A 115 4.789 6.513 2.414 1.00 26.40 C ATOM 24 CG2 ILE A 115 2.595 7.187 1.348 1.00 27.15 C ATOM 25 CD1 ILE A 115 5.363 7.443 1.373 1.00 29.55 C ATOM 26 H ILE A 115 3.788 4.520 4.177 1.00 0.00 H ATOM 27 N VAL A 116 0.364 7.122 3.537 1.00 14.23 N ATOM 28 CA VAL A 116 -1.075 7.083 3.353 1.00 13.47 C ATOM 29 C VAL A 116 -1.358 7.900 2.092 1.00 15.21 C ATOM 30 O VAL A 116 -0.881 9.030 1.994 1.00 17.57 O ATOM 31 CB VAL A 116 -1.812 7.697 4.556 1.00 14.86 C ATOM 32 CG1 VAL A 116 -3.257 7.725 4.308 1.00 14.78 C ATOM 33 CG2 VAL A 116 -1.446 6.937 5.813 1.00 15.09 C ATOM 34 H VAL A 116 0.822 8.052 3.621 1.00 0.00 H ATOM 35 N PRO A 117 -2.125 7.390 1.121 1.00 15.34 N ATOM 36 CA PRO A 117 -2.819 6.108 1.122 1.00 15.25 C ATOM 37 C PRO A 117 -1.864 4.932 1.047 1.00 13.69 C ATOM 38 O PRO A 117 -0.806 5.008 0.412 1.00 15.19 O ATOM 39 CB PRO A 117 -3.700 6.173 -0.137 1.00 16.47 C ATOM 40 CG PRO A 117 -3.741 7.544 -0.548 1.00 17.70 C ATOM 41 CD PRO A 117 -2.520 8.213 -0.034 1.00 16.43 C ATOM 42 N TYR A 118 -2.229 3.860 1.746 1.00 12.91 N ATOM 43 CA TYR A 118 -1.429 2.650 1.824 1.00 11.98 C ATOM 44 C TYR A 118 -2.131 1.496 1.121 1.00 11.91 C ATOM 45 O TYR A 118 -3.321 1.278 1.310 1.00 12.90 O ATOM 46 CB TYR A 118 -1.175 2.265 3.294 1.00 12.63 C ATOM 47 CG TYR A 118 -0.134 1.181 3.475 1.00 12.38 C ATOM 48 CD1 TYR A 118 1.200 1.517 3.487 1.00 14.93 C ATOM 49 CD2 TYR A 118 -0.484 -0.166 3.643 1.00 13.24 C ATOM 50 CE1 TYR A 118 2.170 0.562 3.633 1.00 16.69 C ATOM 51 CE2 TYR A 118 0.482 -1.116 3.792 1.00 14.82 C ATOM 52 CZ TYR A 118 1.804 -0.740 3.818 1.00 15.93 C ATOM 53 OH TYR A 118 2.732 -1.728 3.954 1.00 19.08 O ATOM 54 HH TYR A 118 3.638 -1.330 3.959 1.00 0.00 H ATOM 55 H TYR A 118 -3.132 3.890 2.262 1.00 0.00 H ATOM 56 N ASN A 119 -1.353 0.718 0.381 1.00 12.31 N ATOM 57 CA ASN A 119 -1.821 -0.479 -0.323 1.00 13.62 C ATOM 58 C ASN A 119 -1.264 -1.724 0.353 1.00 12.80 C ATOM 59 O ASN A 119 -0.063 -1.979 0.293 1.00 15.09 O ATOM 60 CB ASN A 119 -1.349 -0.372 -1.775 1.00 18.62 C ATOM 61 CG ASN A 119 -1.467 -1.663 -2.529 1.00 22.86 C ATOM 62 OD1 ASN A 119 -2.335 -2.449 -2.242 1.00 22.26 O ATOM 63 ND2 ASN A 119 -0.584 -1.893 -3.490 1.00 25.23 N ATOM 64 HD22 ASN A 119 0.148 -1.186 -3.704 1.00 0.00 H ATOM 65 HD21 ASN A 119 -0.623 -2.781 -4.031 1.00 0.00 H ATOM 66 H ASN A 119 -0.348 0.973 0.295 1.00 0.00 H ATOM 67 N LEU A 120 -2.140 -2.494 0.988 1.00 10.50 N ATOM 68 CA LEU A 120 -1.786 -3.765 1.599 1.00 10.52 C ATOM 69 C LEU A 120 -2.324 -4.888 0.711 1.00 9.25 C ATOM 70 O LEU A 120 -3.541 -5.153 0.722 1.00 9.47 O ATOM 71 CB LEU A 120 -2.398 -3.851 2.999 1.00 11.35 C ATOM 72 CG LEU A 120 -2.080 -5.151 3.746 1.00 11.56 C ATOM 73 CD1 LEU A 120 -0.612 -5.323 4.077 1.00 14.58 C ATOM 74 CD2 LEU A 120 -2.939 -5.249 5.002 1.00 12.95 C ATOM 75 H LEU A 120 -3.127 -2.172 1.051 1.00 0.00 H ATOM 76 N PRO A 121 -1.481 -5.572 -0.074 1.00 9.77 N ATOM 77 CA PRO A 121 -1.965 -6.750 -0.821 1.00 9.99 C ATOM 78 C PRO A 121 -2.475 -7.807 0.134 1.00 8.92 C ATOM 79 O PRO A 121 -1.910 -8.005 1.199 1.00 10.39 O ATOM 80 CB PRO A 121 -0.716 -7.249 -1.562 1.00 11.15 C ATOM 81 CG PRO A 121 0.216 -6.025 -1.622 1.00 13.34 C ATOM 82 CD PRO A 121 -0.046 -5.302 -0.323 1.00 10.96 C ATOM 83 N LEU A 122 -3.536 -8.520 -0.269 1.00 7.60 N ATOM 84 CA LEU A 122 -4.105 -9.637 0.482 1.00 7.69 C ATOM 85 C LEU A 122 -3.946 -10.845 -0.437 1.00 7.12 C ATOM 86 O LEU A 122 -4.813 -11.090 -1.287 1.00 7.59 O ATOM 87 CB LEU A 122 -5.572 -9.359 0.831 1.00 7.71 C ATOM 88 CG LEU A 122 -5.811 -8.053 1.616 1.00 7.76 C ATOM 89 CD1 LEU A 122 -7.307 -7.850 1.773 1.00 7.64 C ATOM 90 CD2 LEU A 122 -5.125 -8.014 2.935 1.00 9.95 C ATOM 91 H LEU A 122 -3.982 -8.262 -1.172 1.00 0.00 H ATOM 92 N PRO A 123 -2.835 -11.574 -0.370 1.00 7.76 N ATOM 93 CA PRO A 123 -2.573 -12.551 -1.449 1.00 7.86 C ATOM 94 C PRO A 123 -3.608 -13.660 -1.494 1.00 7.63 C ATOM 95 O PRO A 123 -3.854 -14.324 -0.488 1.00 7.64 O ATOM 96 CB PRO A 123 -1.194 -13.110 -1.096 1.00 8.98 C ATOM 97 CG PRO A 123 -0.521 -11.943 -0.308 1.00 8.35 C ATOM 98 CD PRO A 123 -1.656 -11.371 0.510 1.00 8.17 C ATOM 99 N GLY A 124 -4.163 -13.888 -2.678 1.00 7.37 N ATOM 100 CA GLY A 124 -5.181 -14.900 -2.800 1.00 7.59 C ATOM 101 C GLY A 124 -6.497 -14.503 -2.179 1.00 7.47 C ATOM 102 O GLY A 124 -7.365 -15.355 -1.996 1.00 8.03 O ATOM 103 H GLY A 124 -3.865 -13.341 -3.511 1.00 0.00 H ATOM 104 N GLY A 125 -6.683 -13.209 -1.890 1.00 7.36 N ATOM 105 CA GLY A 125 -7.926 -12.697 -1.349 1.00 7.01 C ATOM 106 C GLY A 125 -8.067 -13.012 0.121 1.00 7.25 C ATOM 107 O GLY A 125 -7.099 -13.339 0.820 1.00 8.40 O ATOM 108 H GLY A 125 -5.903 -12.543 -2.061 1.00 0.00 H ATOM 109 N VAL A 126 -9.290 -12.859 0.614 1.00 7.76 N ATOM 110 CA VAL A 126 -9.578 -13.059 2.015 1.00 7.46 C ATOM 111 C VAL A 126 -10.268 -14.406 2.186 1.00 8.38 C ATOM 112 O VAL A 126 -10.714 -15.035 1.225 1.00 9.78 O ATOM 113 CB VAL A 126 -10.392 -11.909 2.629 1.00 8.96 C ATOM 114 CG1 VAL A 126 -9.632 -10.606 2.414 1.00 9.21 C ATOM 115 CG2 VAL A 126 -11.774 -11.868 2.034 1.00 9.42 C ATOM 116 H VAL A 126 -10.063 -12.587 -0.027 1.00 0.00 H ATOM 117 N VAL A 127 -10.324 -14.869 3.433 1.00 8.87 N ATOM 118 CA VAL A 127 -10.882 -16.167 3.789 1.00 9.78 C ATOM 119 C VAL A 127 -11.392 -16.052 5.213 1.00 9.45 C ATOM 120 O VAL A 127 -10.819 -15.296 6.008 1.00 9.77 O ATOM 121 CB VAL A 127 -9.813 -17.266 3.665 1.00 12.86 C ATOM 122 CG1 VAL A 127 -8.650 -17.049 4.641 1.00 14.14 C ATOM 123 CG2 VAL A 127 -10.437 -18.645 3.833 1.00 15.52 C ATOM 124 H VAL A 127 -9.948 -14.270 4.196 1.00 0.00 H ATOM 125 N PRO A 128 -12.412 -16.804 5.595 1.00 9.97 N ATOM 126 CA PRO A 128 -12.808 -16.786 7.001 1.00 11.61 C ATOM 127 C PRO A 128 -11.633 -17.153 7.896 1.00 11.65 C ATOM 128 O PRO A 128 -10.795 -17.992 7.547 1.00 13.17 O ATOM 129 CB PRO A 128 -13.969 -17.781 7.060 1.00 13.30 C ATOM 130 CG PRO A 128 -14.544 -17.674 5.696 1.00 13.88 C ATOM 131 CD PRO A 128 -13.358 -17.575 4.777 1.00 12.98 C ATOM 132 N ARG A 129 -11.561 -16.455 9.038 1.00 12.01 N ATOM 133 CA ARG A 129 -10.550 -16.566 10.093 1.00 12.94 C ATOM 134 C ARG A 129 -9.325 -15.720 9.794 1.00 11.32 C ATOM 135 O ARG A 129 -8.401 -15.707 10.632 1.00 12.92 O ATOM 136 CB ARG A 129 -10.191 -18.024 10.425 1.00 18.12 C ATOM 137 CG ARG A 129 -11.436 -18.775 10.886 1.00 22.28 C ATOM 138 CD ARG A 129 -11.240 -20.217 11.298 1.00 23.04 C ATOM 139 NE ARG A 129 -10.265 -20.332 12.367 1.00 23.40 N ATOM 140 CZ ARG A 129 -9.988 -21.468 12.993 1.00 24.78 C ATOM 141 NH1 ARG A 129 -9.056 -21.475 13.931 1.00 27.26 N ATOM 142 NH2 ARG A 129 -10.662 -22.589 12.713 1.00 25.00 N ATOM 143 HE ARG A 129 -9.754 -19.474 12.659 1.00 0.00 H ATOM 144 HH12 ARG A 129 -8.828 -22.358 14.431 1.00 0.00 H ATOM 145 HH11 ARG A 129 -8.551 -20.597 14.169 1.00 0.00 H ATOM 146 HH22 ARG A 129 -10.433 -23.472 13.213 1.00 0.00 H ATOM 147 HH21 ARG A 129 -11.415 -22.578 11.996 1.00 0.00 H ATOM 148 H ARG A 129 -12.311 -15.752 9.194 1.00 0.00 H ATOM 149 N MET A 130 -9.318 -14.942 8.704 1.00 10.14 N ATOM 150 CA MET A 130 -8.281 -13.957 8.477 1.00 9.79 C ATOM 151 C MET A 130 -8.603 -12.678 9.220 1.00 9.90 C ATOM 152 O MET A 130 -9.692 -12.116 9.085 1.00 9.72 O ATOM 153 CB MET A 130 -8.194 -13.695 6.991 1.00 9.22 C ATOM 154 CG MET A 130 -7.033 -12.853 6.596 1.00 10.54 C ATOM 155 SD MET A 130 -6.995 -12.758 4.784 1.00 11.13 S ATOM 156 CE MET A 130 -5.535 -11.723 4.535 1.00 11.56 C ATOM 157 H MET A 130 -10.078 -15.048 8.002 1.00 0.00 H ATOM 158 N LEU A 131 -7.636 -12.241 10.021 1.00 9.62 N ATOM 159 CA LEU A 131 -7.735 -11.048 10.856 1.00 9.22 C ATOM 160 C LEU A 131 -6.776 -9.982 10.337 1.00 9.92 C ATOM 161 O LEU A 131 -5.566 -10.201 10.292 1.00 10.22 O ATOM 162 CB LEU A 131 -7.388 -11.433 12.298 1.00 11.20 C ATOM 163 CG LEU A 131 -7.406 -10.276 13.297 1.00 12.31 C ATOM 164 CD1 LEU A 131 -8.845 -9.729 13.450 1.00 12.69 C ATOM 165 CD2 LEU A 131 -6.843 -10.694 14.623 1.00 15.60 C ATOM 166 H LEU A 131 -6.750 -12.785 10.055 1.00 0.00 H ATOM 167 N ILE A 132 -7.318 -8.823 9.969 1.00 8.85 N ATOM 168 CA ILE A 132 -6.543 -7.681 9.502 1.00 9.12 C ATOM 169 C ILE A 132 -6.519 -6.649 10.631 1.00 10.05 C ATOM 170 O ILE A 132 -7.566 -6.299 11.188 1.00 11.33 O ATOM 171 CB ILE A 132 -7.140 -7.090 8.213 1.00 12.25 C ATOM 172 CG1 ILE A 132 -7.161 -8.136 7.078 1.00 14.55 C ATOM 173 CG2 ILE A 132 -6.334 -5.865 7.833 1.00 15.65 C ATOM 174 CD1 ILE A 132 -8.397 -8.885 6.899 1.00 17.65 C ATOM 175 H ILE A 132 -8.352 -8.727 10.018 1.00 0.00 H ATOM 176 N THR A 133 -5.331 -6.182 10.995 1.00 9.28 N ATOM 177 CA THR A 133 -5.171 -5.188 12.048 1.00 10.09 C ATOM 178 C THR A 133 -4.512 -3.937 11.492 1.00 10.50 C ATOM 179 O THR A 133 -3.410 -4.003 10.919 1.00 11.42 O ATOM 180 CB THR A 133 -4.315 -5.748 13.193 1.00 11.70 C ATOM 181 OG1 THR A 133 -4.940 -6.928 13.728 1.00 12.16 O ATOM 182 CG2 THR A 133 -4.133 -4.723 14.321 1.00 13.18 C ATOM 183 HG1 THR A 133 -5.023 -7.609 13.014 1.00 0.00 H ATOM 184 H THR A 133 -4.483 -6.539 10.510 1.00 0.00 H ATOM 185 N ILE A 134 -5.145 -2.790 11.759 1.00 9.66 N ATOM 186 CA ILE A 134 -4.648 -1.481 11.346 1.00 9.90 C ATOM 187 C ILE A 134 -4.433 -0.678 12.623 1.00 9.69 C ATOM 188 O ILE A 134 -5.360 -0.513 13.435 1.00 10.42 O ATOM 189 CB ILE A 134 -5.657 -0.760 10.440 1.00 10.24 C ATOM 190 CG1 ILE A 134 -6.044 -1.613 9.227 1.00 12.74 C ATOM 191 CG2 ILE A 134 -5.121 0.609 9.997 1.00 11.44 C ATOM 192 CD1 ILE A 134 -4.915 -2.084 8.404 1.00 17.95 C ATOM 193 H ILE A 134 -6.039 -2.833 12.289 1.00 0.00 H ATOM 194 N LEU A 135 -3.225 -0.189 12.813 1.00 8.45 N ATOM 195 CA LEU A 135 -2.904 0.660 13.962 1.00 9.05 C ATOM 196 C LEU A 135 -2.520 2.034 13.452 1.00 8.81 C ATOM 197 O LEU A 135 -1.771 2.161 12.484 1.00 9.00 O ATOM 198 CB LEU A 135 -1.731 0.115 14.784 1.00 11.32 C ATOM 199 CG LEU A 135 -2.032 -1.154 15.566 1.00 13.88 C ATOM 200 CD1 LEU A 135 -0.707 -1.810 15.917 1.00 16.84 C ATOM 201 CD2 LEU A 135 -2.814 -0.857 16.811 1.00 15.31 C ATOM 202 H LEU A 135 -2.477 -0.413 12.126 1.00 0.00 H ATOM 203 N GLY A 136 -3.018 3.077 14.100 1.00 10.13 N ATOM 204 CA GLY A 136 -2.642 4.420 13.711 1.00 11.59 C ATOM 205 C GLY A 136 -3.135 5.411 14.742 1.00 11.20 C ATOM 206 O GLY A 136 -3.606 5.039 15.818 1.00 12.33 O ATOM 207 H GLY A 136 -3.680 2.931 14.889 1.00 0.00 H ATOM 208 N THR A 137 -3.019 6.681 14.388 1.00 9.70 N ATOM 209 CA THR A 137 -3.507 7.790 15.192 1.00 9.76 C ATOM 210 C THR A 137 -4.297 8.719 14.285 1.00 9.55 C ATOM 211 O THR A 137 -3.855 9.058 13.179 1.00 10.56 O ATOM 212 CB THR A 137 -2.340 8.541 15.848 1.00 11.61 C ATOM 213 OG1 THR A 137 -1.628 7.620 16.684 1.00 14.87 O ATOM 214 CG2 THR A 137 -2.824 9.745 16.671 1.00 10.70 C ATOM 215 HG1 THR A 137 -1.285 6.873 16.133 1.00 0.00 H ATOM 216 H THR A 137 -2.553 6.898 13.484 1.00 0.00 H ATOM 217 N VAL A 138 -5.484 9.104 14.734 1.00 9.06 N ATOM 218 CA VAL A 138 -6.276 10.028 13.932 1.00 9.69 C ATOM 219 C VAL A 138 -5.647 11.404 14.017 1.00 10.22 C ATOM 220 O VAL A 138 -5.254 11.860 15.093 1.00 11.01 O ATOM 221 CB VAL A 138 -7.731 10.066 14.435 1.00 8.99 C ATOM 222 CG1 VAL A 138 -8.585 11.028 13.628 1.00 9.85 C ATOM 223 CG2 VAL A 138 -8.347 8.708 14.418 1.00 10.10 C ATOM 224 H VAL A 138 -5.844 8.752 15.644 1.00 0.00 H ATOM 225 N LYS A 139 -5.569 12.097 12.884 1.00 10.30 N ATOM 226 CA LYS A 139 -5.035 13.456 12.896 1.00 12.21 C ATOM 227 C LYS A 139 -5.937 14.400 13.681 1.00 12.00 C ATOM 228 O LYS A 139 -7.141 14.171 13.809 1.00 11.61 O ATOM 229 CB LYS A 139 -4.861 14.002 11.477 1.00 14.86 C ATOM 230 CG LYS A 139 -3.758 13.274 10.726 1.00 18.94 C ATOM 231 CD LYS A 139 -3.471 13.835 9.358 1.00 23.59 C ATOM 232 CE LYS A 139 -2.168 13.276 8.785 1.00 27.71 C ATOM 233 NZ LYS A 139 -0.915 13.778 9.483 1.00 30.94 N ATOM 234 HZ1 LYS A 139 -0.866 14.814 9.402 1.00 0.00 H ATOM 235 HZ2 LYS A 139 -0.948 13.509 10.487 1.00 0.00 H ATOM 236 HZ3 LYS A 139 -0.077 13.354 9.036 1.00 0.00 H ATOM 237 H LYS A 139 -5.888 11.671 11.990 1.00 0.00 H ATOM 238 N PRO A 140 -5.389 15.538 14.131 1.00 14.65 N ATOM 239 CA PRO A 140 -6.120 16.382 15.101 1.00 15.67 C ATOM 240 C PRO A 140 -7.455 16.946 14.631 1.00 16.01 C ATOM 241 O PRO A 140 -8.382 17.071 15.444 1.00 16.32 O ATOM 242 CB PRO A 140 -5.114 17.504 15.411 1.00 15.95 C ATOM 243 CG PRO A 140 -4.124 17.476 14.264 1.00 15.75 C ATOM 244 CD PRO A 140 -4.022 16.031 13.887 1.00 15.70 C ATOM 245 N ASN A 141 -7.571 17.365 13.375 1.00 16.44 N ATOM 246 CA ASN A 141 -8.840 17.913 12.906 1.00 16.85 C ATOM 247 C ASN A 141 -9.341 17.057 11.754 1.00 15.44 C ATOM 248 O ASN A 141 -9.655 17.566 10.675 1.00 15.75 O ATOM 249 CB ASN A 141 -8.704 19.372 12.457 1.00 19.61 C ATOM 250 CG ASN A 141 -10.056 20.041 12.205 1.00 22.30 C ATOM 251 OD1 ASN A 141 -11.032 19.815 12.929 1.00 23.47 O ATOM 252 ND2 ASN A 141 -10.113 20.867 11.174 1.00 23.14 N ATOM 253 HD22 ASN A 141 -9.268 21.029 10.590 1.00 0.00 H ATOM 254 HD21 ASN A 141 -11.003 21.355 10.947 1.00 0.00 H ATOM 255 H ASN A 141 -6.759 17.303 12.728 1.00 0.00 H ATOM 256 N ALA A 142 -9.408 15.750 11.975 1.00 14.34 N ATOM 257 CA ALA A 142 -9.715 14.813 10.902 1.00 12.47 C ATOM 258 C ALA A 142 -11.108 15.031 10.329 1.00 12.15 C ATOM 259 O ALA A 142 -12.061 15.373 11.030 1.00 12.73 O ATOM 260 CB ALA A 142 -9.629 13.391 11.454 1.00 13.49 C ATOM 261 H ALA A 142 -9.238 15.387 12.935 1.00 0.00 H ATOM 262 N ASN A 143 -11.224 14.757 9.040 1.00 11.44 N ATOM 263 CA ASN A 143 -12.502 14.761 8.354 1.00 11.10 C ATOM 264 C ASN A 143 -12.978 13.357 8.008 1.00 10.37 C ATOM 265 O ASN A 143 -14.156 13.066 8.145 1.00 11.01 O ATOM 266 CB ASN A 143 -12.422 15.599 7.077 1.00 15.12 C ATOM 267 CG ASN A 143 -13.747 15.695 6.372 1.00 21.99 C ATOM 268 OD1 ASN A 143 -13.900 15.187 5.265 1.00 27.36 O ATOM 269 ND2 ASN A 143 -14.714 16.353 6.999 1.00 24.81 N ATOM 270 HD22 ASN A 143 -14.538 16.767 7.937 1.00 0.00 H ATOM 271 HD21 ASN A 143 -15.648 16.455 6.553 1.00 0.00 H ATOM 272 H ASN A 143 -10.366 14.530 8.498 1.00 0.00 H ATOM 273 N ARG A 144 -12.088 12.460 7.583 1.00 9.75 N ATOM 274 CA ARG A 144 -12.504 11.164 7.062 1.00 11.06 C ATOM 275 C ARG A 144 -11.364 10.158 7.131 1.00 9.96 C ATOM 276 O ARG A 144 -10.186 10.508 7.055 1.00 11.68 O ATOM 277 CB ARG A 144 -13.008 11.289 5.616 1.00 14.09 C ATOM 278 CG ARG A 144 -11.971 11.855 4.676 1.00 20.20 C ATOM 279 CD ARG A 144 -12.484 12.127 3.264 1.00 26.62 C ATOM 280 NE ARG A 144 -11.385 12.623 2.430 1.00 32.03 N ATOM 281 CZ ARG A 144 -11.419 12.732 1.103 1.00 35.87 C ATOM 282 NH1 ARG A 144 -10.355 13.197 0.453 1.00 37.87 N ATOM 283 NH2 ARG A 144 -12.499 12.375 0.420 1.00 36.68 N ATOM 284 HE ARG A 144 -10.510 12.912 2.912 1.00 0.00 H ATOM 285 HH12 ARG A 144 -10.376 13.284 -0.583 1.00 0.00 H ATOM 286 HH11 ARG A 144 -9.503 13.473 0.981 1.00 0.00 H ATOM 287 HH22 ARG A 144 -12.512 12.465 -0.616 1.00 0.00 H ATOM 288 HH21 ARG A 144 -13.332 12.005 0.921 1.00 0.00 H ATOM 289 H ARG A 144 -11.075 12.690 7.624 1.00 0.00 H ATOM 290 N ILE A 145 -11.749 8.881 7.211 1.00 9.34 N ATOM 291 CA ILE A 145 -10.862 7.728 7.084 1.00 8.67 C ATOM 292 C ILE A 145 -11.574 6.760 6.155 1.00 8.86 C ATOM 293 O ILE A 145 -12.806 6.694 6.167 1.00 7.96 O ATOM 294 CB ILE A 145 -10.679 7.038 8.444 1.00 9.74 C ATOM 295 CG1 ILE A 145 -10.066 8.004 9.440 1.00 12.27 C ATOM 296 CG2 ILE A 145 -9.844 5.775 8.318 1.00 12.05 C ATOM 297 CD1 ILE A 145 -10.050 7.475 10.885 1.00 13.20 C ATOM 298 H ILE A 145 -12.759 8.694 7.377 1.00 0.00 H ATOM 299 N ALA A 146 -10.820 6.003 5.358 1.00 7.91 N ATOM 300 CA ALA A 146 -11.442 4.935 4.593 1.00 9.06 C ATOM 301 C ALA A 146 -10.575 3.697 4.516 1.00 8.08 C ATOM 302 O ALA A 146 -9.376 3.784 4.227 1.00 9.34 O ATOM 303 CB ALA A 146 -11.764 5.379 3.178 1.00 11.11 C ATOM 304 H ALA A 146 -9.797 6.175 5.284 1.00 0.00 H ATOM 305 N LEU A 147 -11.211 2.555 4.757 1.00 8.05 N ATOM 306 CA LEU A 147 -10.663 1.256 4.401 1.00 6.66 C ATOM 307 C LEU A 147 -11.421 0.748 3.185 1.00 7.64 C ATOM 308 O LEU A 147 -12.649 0.771 3.178 1.00 8.75 O ATOM 309 CB LEU A 147 -10.812 0.245 5.523 1.00 8.14 C ATOM 310 CG LEU A 147 -10.216 0.541 6.869 1.00 14.69 C ATOM 311 CD1 LEU A 147 -10.314 -0.684 7.770 1.00 15.35 C ATOM 312 CD2 LEU A 147 -8.906 1.054 6.850 1.00 17.20 C ATOM 313 H LEU A 147 -12.141 2.592 5.220 1.00 0.00 H ATOM 314 N ASP A 148 -10.688 0.296 2.170 1.00 7.11 N ATOM 315 CA ASP A 148 -11.274 -0.221 0.929 1.00 7.04 C ATOM 316 C ASP A 148 -10.730 -1.614 0.660 1.00 7.27 C ATOM 317 O ASP A 148 -9.591 -1.763 0.189 1.00 8.03 O ATOM 318 CB ASP A 148 -10.973 0.697 -0.249 1.00 8.56 C ATOM 319 CG ASP A 148 -11.708 2.007 -0.158 1.00 10.08 C ATOM 320 OD1 ASP A 148 -12.916 1.956 -0.481 1.00 10.96 O ATOM 321 OD2 ASP A 148 -11.105 3.028 0.244 1.00 12.06 O ATOM 322 H ASP A 148 -9.652 0.310 2.261 1.00 0.00 H ATOM 323 N PHE A 149 -11.551 -2.628 0.899 1.00 6.63 N ATOM 324 CA PHE A 149 -11.229 -3.993 0.497 1.00 6.11 C ATOM 325 C PHE A 149 -11.691 -4.140 -0.940 1.00 6.46 C ATOM 326 O PHE A 149 -12.894 -4.032 -1.222 1.00 7.66 O ATOM 327 CB PHE A 149 -11.957 -4.996 1.370 1.00 6.71 C ATOM 328 CG PHE A 149 -11.423 -5.090 2.770 1.00 7.31 C ATOM 329 CD1 PHE A 149 -11.889 -4.246 3.755 1.00 8.57 C ATOM 330 CD2 PHE A 149 -10.454 -6.044 3.103 1.00 9.32 C ATOM 331 CE1 PHE A 149 -11.384 -4.327 5.042 1.00 10.36 C ATOM 332 CE2 PHE A 149 -9.988 -6.141 4.381 1.00 10.43 C ATOM 333 CZ PHE A 149 -10.422 -5.313 5.348 1.00 10.96 C ATOM 334 H PHE A 149 -12.451 -2.445 1.387 1.00 0.00 H ATOM 335 N GLN A 150 -10.753 -4.331 -1.864 1.00 6.52 N ATOM 336 CA GLN A 150 -11.026 -4.250 -3.284 1.00 6.48 C ATOM 337 C GLN A 150 -10.909 -5.590 -3.996 1.00 7.05 C ATOM 338 O GLN A 150 -10.007 -6.384 -3.713 1.00 7.16 O ATOM 339 CB GLN A 150 -10.079 -3.273 -3.982 1.00 10.24 C ATOM 340 CG GLN A 150 -10.380 -1.885 -3.561 1.00 14.07 C ATOM 341 CD GLN A 150 -9.716 -0.869 -4.399 1.00 19.96 C ATOM 342 OE1 GLN A 150 -8.893 -0.145 -3.892 1.00 20.49 O ATOM 343 NE2 GLN A 150 -10.033 -0.812 -5.695 1.00 24.22 N ATOM 344 HE22 GLN A 150 -10.749 -1.458 -6.084 1.00 0.00 H ATOM 345 HE21 GLN A 150 -9.564 -0.122 -6.315 1.00 0.00 H ATOM 346 H GLN A 150 -9.784 -4.547 -1.554 1.00 0.00 H ATOM 347 N ARG A 151 -11.799 -5.796 -4.968 1.00 6.03 N ATOM 348 CA ARG A 151 -11.742 -6.894 -5.919 1.00 7.02 C ATOM 349 C ARG A 151 -11.535 -6.213 -7.274 1.00 7.07 C ATOM 350 O ARG A 151 -12.502 -5.777 -7.910 1.00 7.34 O ATOM 351 CB ARG A 151 -13.048 -7.677 -5.886 1.00 7.23 C ATOM 352 CG ARG A 151 -13.188 -8.698 -7.025 1.00 7.74 C ATOM 353 CD ARG A 151 -14.435 -9.619 -6.878 1.00 8.31 C ATOM 354 NE ARG A 151 -14.471 -10.491 -8.050 1.00 8.05 N ATOM 355 CZ ARG A 151 -15.291 -10.363 -9.099 1.00 8.29 C ATOM 356 NH1 ARG A 151 -16.266 -9.447 -9.129 1.00 9.92 N ATOM 357 NH2 ARG A 151 -15.146 -11.188 -10.142 1.00 9.16 N ATOM 358 HE ARG A 151 -13.798 -11.283 -8.070 1.00 0.00 H ATOM 359 HH12 ARG A 151 -16.886 -9.375 -9.961 1.00 0.00 H ATOM 360 HH11 ARG A 151 -16.404 -8.808 -8.320 1.00 0.00 H ATOM 361 HH22 ARG A 151 -15.776 -11.101 -10.965 1.00 0.00 H ATOM 362 HH21 ARG A 151 -14.404 -11.916 -10.130 1.00 0.00 H ATOM 363 H ARG A 151 -12.589 -5.124 -5.051 1.00 0.00 H ATOM 364 N GLY A 152 -10.270 -6.130 -7.731 1.00 7.90 N ATOM 365 CA GLY A 152 -9.985 -5.335 -8.928 1.00 7.82 C ATOM 366 C GLY A 152 -10.449 -3.906 -8.696 1.00 8.36 C ATOM 367 O GLY A 152 -10.181 -3.307 -7.647 1.00 10.05 O ATOM 368 H GLY A 152 -9.501 -6.627 -7.237 1.00 0.00 H ATOM 369 N ASN A 153 -11.206 -3.365 -9.660 1.00 8.44 N ATOM 370 CA ASN A 153 -11.769 -2.032 -9.530 1.00 8.52 C ATOM 371 C ASN A 153 -12.968 -1.979 -8.594 1.00 9.24 C ATOM 372 O ASN A 153 -13.402 -0.870 -8.243 1.00 10.13 O ATOM 373 CB ASN A 153 -12.202 -1.516 -10.912 1.00 8.72 C ATOM 374 CG ASN A 153 -12.602 -0.058 -10.889 1.00 11.40 C ATOM 375 OD1 ASN A 153 -11.792 0.823 -10.569 1.00 13.77 O ATOM 376 ND2 ASN A 153 -13.839 0.207 -11.250 1.00 12.43 N ATOM 377 HD22 ASN A 153 -14.482 -0.568 -11.510 1.00 0.00 H ATOM 378 HD21 ASN A 153 -14.174 1.191 -11.275 1.00 0.00 H ATOM 379 H ASN A 153 -11.395 -3.913 -10.523 1.00 0.00 H ATOM 380 N ASP A 154 -13.564 -3.104 -8.239 1.00 7.70 N ATOM 381 CA ASP A 154 -14.682 -3.055 -7.335 1.00 7.32 C ATOM 382 C ASP A 154 -14.222 -2.916 -5.904 1.00 6.71 C ATOM 383 O ASP A 154 -13.125 -3.336 -5.527 1.00 7.81 O ATOM 384 CB ASP A 154 -15.550 -4.285 -7.503 1.00 7.44 C ATOM 385 CG ASP A 154 -16.405 -4.257 -8.749 1.00 7.89 C ATOM 386 OD1 ASP A 154 -16.444 -3.252 -9.490 1.00 8.91 O ATOM 387 OD2 ASP A 154 -17.058 -5.308 -8.985 1.00 9.66 O ATOM 388 H ASP A 154 -13.228 -4.016 -8.610 1.00 0.00 H ATOM 389 N VAL A 155 -15.074 -2.286 -5.100 1.00 6.54 N ATOM 390 CA VAL A 155 -14.834 -2.185 -3.670 1.00 7.17 C ATOM 391 C VAL A 155 -15.825 -3.103 -2.986 1.00 6.68 C ATOM 392 O VAL A 155 -17.010 -2.800 -2.903 1.00 7.82 O ATOM 393 CB VAL A 155 -14.918 -0.752 -3.117 1.00 7.76 C ATOM 394 CG1 VAL A 155 -14.526 -0.796 -1.659 1.00 8.79 C ATOM 395 CG2 VAL A 155 -13.974 0.204 -3.881 1.00 11.04 C ATOM 396 H VAL A 155 -15.931 -1.856 -5.503 1.00 0.00 H ATOM 397 N ALA A 156 -15.323 -4.250 -2.530 1.00 6.47 N ATOM 398 CA ALA A 156 -16.182 -5.206 -1.836 1.00 6.90 C ATOM 399 C ALA A 156 -16.684 -4.637 -0.526 1.00 5.79 C ATOM 400 O ALA A 156 -17.847 -4.837 -0.150 1.00 7.00 O ATOM 401 CB ALA A 156 -15.410 -6.496 -1.559 1.00 7.09 C ATOM 402 H ALA A 156 -14.315 -4.465 -2.669 1.00 0.00 H ATOM 403 N PHE A 157 -15.813 -3.954 0.208 1.00 6.38 N ATOM 404 CA PHE A 157 -16.170 -3.414 1.518 1.00 6.30 C ATOM 405 C PHE A 157 -15.417 -2.118 1.731 1.00 5.56 C ATOM 406 O PHE A 157 -14.192 -2.112 1.864 1.00 6.26 O ATOM 407 CB PHE A 157 -15.868 -4.406 2.628 1.00 6.22 C ATOM 408 CG PHE A 157 -16.117 -3.903 4.028 1.00 6.84 C ATOM 409 CD1 PHE A 157 -17.207 -3.117 4.372 1.00 7.73 C ATOM 410 CD2 PHE A 157 -15.256 -4.287 5.043 1.00 6.35 C ATOM 411 CE1 PHE A 157 -17.392 -2.743 5.690 1.00 7.65 C ATOM 412 CE2 PHE A 157 -15.458 -3.935 6.355 1.00 7.04 C ATOM 413 CZ PHE A 157 -16.531 -3.157 6.685 1.00 7.38 C ATOM 414 H PHE A 157 -14.852 -3.800 -0.159 1.00 0.00 H ATOM 415 N HIS A 158 -16.171 -1.025 1.750 1.00 7.02 N ATOM 416 CA HIS A 158 -15.685 0.320 2.037 1.00 6.89 C ATOM 417 C HIS A 158 -16.182 0.659 3.437 1.00 6.50 C ATOM 418 O HIS A 158 -17.386 0.602 3.694 1.00 6.91 O ATOM 419 CB HIS A 158 -16.300 1.280 1.034 1.00 8.00 C ATOM 420 CG HIS A 158 -16.005 2.746 1.245 1.00 8.36 C ATOM 421 ND1 HIS A 158 -14.840 3.343 0.817 1.00 8.49 N ATOM 422 CD2 HIS A 158 -16.794 3.759 1.689 1.00 9.60 C ATOM 423 CE1 HIS A 158 -14.918 4.658 1.001 1.00 8.72 C ATOM 424 NE2 HIS A 158 -16.092 4.935 1.544 1.00 9.87 N ATOM 425 H HIS A 158 -17.184 -1.136 1.545 1.00 0.00 H ATOM 426 N PHE A 159 -15.247 0.992 4.328 1.00 6.64 N ATOM 427 CA PHE A 159 -15.508 1.301 5.736 1.00 6.52 C ATOM 428 C PHE A 159 -15.028 2.740 5.941 1.00 6.39 C ATOM 429 O PHE A 159 -13.825 3.006 5.816 1.00 7.02 O ATOM 430 CB PHE A 159 -14.723 0.343 6.647 1.00 6.46 C ATOM 431 CG PHE A 159 -14.774 0.673 8.103 1.00 6.74 C ATOM 432 CD1 PHE A 159 -15.804 0.236 8.932 1.00 6.58 C ATOM 433 CD2 PHE A 159 -13.732 1.389 8.682 1.00 7.83 C ATOM 434 CE1 PHE A 159 -15.768 0.514 10.306 1.00 7.88 C ATOM 435 CE2 PHE A 159 -13.720 1.672 10.010 1.00 8.09 C ATOM 436 CZ PHE A 159 -14.749 1.251 10.827 1.00 8.26 C ATOM 437 H PHE A 159 -14.261 1.035 3.999 1.00 0.00 H ATOM 438 N ASN A 160 -15.960 3.683 6.185 1.00 6.88 N ATOM 439 CA ASN A 160 -15.676 5.125 6.048 1.00 6.71 C ATOM 440 C ASN A 160 -16.187 5.937 7.228 1.00 6.94 C ATOM 441 O ASN A 160 -17.298 6.493 7.185 1.00 8.53 O ATOM 442 CB ASN A 160 -16.251 5.595 4.708 1.00 7.91 C ATOM 443 CG ASN A 160 -16.182 7.107 4.451 1.00 9.51 C ATOM 444 OD1 ASN A 160 -17.066 7.634 3.761 1.00 11.48 O ATOM 445 ND2 ASN A 160 -15.162 7.784 4.948 1.00 9.85 N ATOM 446 HD22 ASN A 160 -14.445 7.297 5.522 1.00 0.00 H ATOM 447 HD21 ASN A 160 -15.077 8.804 4.765 1.00 0.00 H ATOM 448 H ASN A 160 -16.912 3.384 6.480 1.00 0.00 H ATOM 449 N PRO A 161 -15.378 6.052 8.289 1.00 7.67 N ATOM 450 CA PRO A 161 -15.649 7.038 9.353 1.00 7.86 C ATOM 451 C PRO A 161 -15.633 8.449 8.776 1.00 8.26 C ATOM 452 O PRO A 161 -14.643 8.886 8.172 1.00 9.19 O ATOM 453 CB PRO A 161 -14.499 6.813 10.342 1.00 8.82 C ATOM 454 CG PRO A 161 -14.045 5.368 10.069 1.00 8.20 C ATOM 455 CD PRO A 161 -14.213 5.220 8.607 1.00 8.23 C ATOM 456 N ARG A 162 -16.755 9.143 8.953 1.00 8.72 N ATOM 457 CA ARG A 162 -16.921 10.541 8.565 1.00 8.38 C ATOM 458 C ARG A 162 -17.042 11.344 9.854 1.00 8.46 C ATOM 459 O ARG A 162 -17.964 11.115 10.656 1.00 9.78 O ATOM 460 CB ARG A 162 -18.177 10.713 7.723 1.00 9.71 C ATOM 461 CG ARG A 162 -18.076 9.992 6.423 1.00 9.65 C ATOM 462 CD ARG A 162 -19.302 10.181 5.552 1.00 10.80 C ATOM 463 NE ARG A 162 -19.166 9.378 4.350 1.00 11.14 N ATOM 464 CZ ARG A 162 -20.027 9.358 3.344 1.00 11.39 C ATOM 465 NH1 ARG A 162 -21.110 10.115 3.370 1.00 13.10 N ATOM 466 NH2 ARG A 162 -19.782 8.601 2.275 1.00 12.64 N ATOM 467 HE ARG A 162 -18.326 8.770 4.273 1.00 0.00 H ATOM 468 HH12 ARG A 162 -21.780 10.092 2.575 1.00 0.00 H ATOM 469 HH11 ARG A 162 -21.292 10.734 4.186 1.00 0.00 H ATOM 470 HH22 ARG A 162 -20.457 8.584 1.484 1.00 0.00 H ATOM 471 HH21 ARG A 162 -18.916 8.027 2.232 1.00 0.00 H ATOM 472 H ARG A 162 -17.563 8.660 9.395 1.00 0.00 H ATOM 473 N PHE A 163 -16.101 12.249 10.089 1.00 9.25 N ATOM 474 CA PHE A 163 -16.059 13.021 11.320 1.00 9.78 C ATOM 475 C PHE A 163 -16.953 14.249 11.297 1.00 10.87 C ATOM 476 O PHE A 163 -17.192 14.841 12.356 1.00 12.14 O ATOM 477 CB PHE A 163 -14.626 13.475 11.630 1.00 11.14 C ATOM 478 CG PHE A 163 -13.721 12.338 12.046 1.00 10.61 C ATOM 479 CD1 PHE A 163 -13.260 11.413 11.121 1.00 10.23 C ATOM 480 CD2 PHE A 163 -13.383 12.150 13.378 1.00 12.10 C ATOM 481 CE1 PHE A 163 -12.445 10.337 11.520 1.00 10.51 C ATOM 482 CE2 PHE A 163 -12.545 11.055 13.777 1.00 11.86 C ATOM 483 CZ PHE A 163 -12.120 10.143 12.845 1.00 10.13 C ATOM 484 H PHE A 163 -15.369 12.412 9.368 1.00 0.00 H ATOM 485 N ASN A 164 -17.455 14.654 10.127 1.00 10.27 N ATOM 486 CA ASN A 164 -18.288 15.843 10.065 1.00 11.11 C ATOM 487 C ASN A 164 -19.178 15.705 8.839 1.00 13.00 C ATOM 488 O ASN A 164 -18.916 16.265 7.769 1.00 16.23 O ATOM 489 CB ASN A 164 -17.485 17.137 10.029 1.00 14.66 C ATOM 490 CG ASN A 164 -18.376 18.361 9.984 1.00 17.21 C ATOM 491 OD1 ASN A 164 -19.609 18.257 9.985 1.00 19.04 O ATOM 492 ND2 ASN A 164 -17.762 19.527 9.908 1.00 19.31 N ATOM 493 HD22 ASN A 164 -16.723 19.569 9.910 1.00 0.00 H ATOM 494 HD21 ASN A 164 -18.317 20.404 9.846 1.00 0.00 H ATOM 495 H ASN A 164 -17.249 14.118 9.260 1.00 0.00 H ATOM 496 N GLU A 165 -20.220 14.919 8.976 1.00 12.96 N ATOM 497 CA GLU A 165 -21.264 14.843 7.966 1.00 13.37 C ATOM 498 C GLU A 165 -22.463 15.553 8.584 1.00 13.58 C ATOM 499 O GLU A 165 -23.067 15.041 9.532 1.00 13.12 O ATOM 500 CB GLU A 165 -21.598 13.398 7.613 1.00 13.79 C ATOM 501 CG GLU A 165 -22.612 13.363 6.469 1.00 15.50 C ATOM 502 CD GLU A 165 -23.171 11.980 6.207 1.00 16.80 C ATOM 503 OE1 GLU A 165 -23.913 11.483 7.094 1.00 18.34 O ATOM 504 OE2 GLU A 165 -22.853 11.377 5.142 1.00 17.07 O ATOM 505 H GLU A 165 -20.302 14.333 9.832 1.00 0.00 H ATOM 506 N ASN A 166 -22.747 16.784 8.130 1.00 15.78 N ATOM 507 CA ASN A 166 -23.817 17.603 8.728 1.00 16.72 C ATOM 508 C ASN A 166 -23.593 17.772 10.232 1.00 13.81 C ATOM 509 O ASN A 166 -24.535 17.698 11.023 1.00 14.52 O ATOM 510 CB ASN A 166 -25.204 16.995 8.436 1.00 21.80 C ATOM 511 CG ASN A 166 -26.361 17.826 8.979 1.00 27.02 C ATOM 512 OD1 ASN A 166 -26.314 19.061 8.994 1.00 29.27 O ATOM 513 ND2 ASN A 166 -27.394 17.138 9.474 1.00 29.31 N ATOM 514 HD22 ASN A 166 -27.391 16.099 9.440 1.00 0.00 H ATOM 515 HD21 ASN A 166 -28.201 17.642 9.893 1.00 0.00 H ATOM 516 H ASN A 166 -22.198 17.170 7.336 1.00 0.00 H ATOM 517 N ASN A 167 -22.330 17.934 10.641 1.00 12.30 N ATOM 518 CA ASN A 167 -21.967 18.142 12.042 1.00 11.18 C ATOM 519 C ASN A 167 -22.226 16.933 12.931 1.00 10.38 C ATOM 520 O ASN A 167 -22.302 17.059 14.156 1.00 12.99 O ATOM 521 CB ASN A 167 -22.606 19.422 12.572 1.00 13.43 C ATOM 522 CG ASN A 167 -22.116 20.595 11.835 1.00 16.56 C ATOM 523 OD1 ASN A 167 -22.853 21.243 11.095 1.00 20.31 O ATOM 524 ND2 ASN A 167 -20.856 20.891 12.018 1.00 16.77 N ATOM 525 HD22 ASN A 167 -20.273 20.311 12.655 1.00 0.00 H ATOM 526 HD21 ASN A 167 -20.437 21.706 11.527 1.00 0.00 H ATOM 527 H ASN A 167 -21.571 17.911 9.930 1.00 0.00 H ATOM 528 N ARG A 168 -22.337 15.748 12.336 1.00 10.51 N ATOM 529 CA ARG A 168 -22.417 14.487 13.053 1.00 11.06 C ATOM 530 C ARG A 168 -21.262 13.601 12.627 1.00 10.18 C ATOM 531 O ARG A 168 -20.685 13.767 11.556 1.00 11.47 O ATOM 532 CB ARG A 168 -23.742 13.776 12.745 1.00 13.41 C ATOM 533 CG ARG A 168 -24.925 14.697 13.002 1.00 16.04 C ATOM 534 CD ARG A 168 -26.277 14.070 12.792 1.00 18.14 C ATOM 535 NE ARG A 168 -27.308 15.069 13.068 1.00 22.33 N ATOM 536 CZ ARG A 168 -28.600 14.803 13.164 1.00 25.33 C ATOM 537 NH1 ARG A 168 -29.026 13.556 13.004 1.00 26.78 N ATOM 538 NH2 ARG A 168 -29.457 15.785 13.423 1.00 25.89 N ATOM 539 HE ARG A 168 -27.005 16.055 13.198 1.00 0.00 H ATOM 540 HH12 ARG A 168 -30.041 13.340 13.078 1.00 0.00 H ATOM 541 HH11 ARG A 168 -28.345 12.795 12.805 1.00 0.00 H ATOM 542 HH22 ARG A 168 -30.474 15.581 13.499 1.00 0.00 H ATOM 543 HH21 ARG A 168 -29.111 16.758 13.549 1.00 0.00 H ATOM 544 H ARG A 168 -22.368 15.723 11.297 1.00 0.00 H ATOM 545 N ARG A 169 -20.942 12.662 13.500 1.00 10.28 N ATOM 546 CA ARG A 169 -19.935 11.641 13.241 1.00 10.54 C ATOM 547 C ARG A 169 -20.659 10.333 12.950 1.00 10.26 C ATOM 548 O ARG A 169 -21.542 9.934 13.701 1.00 12.83 O ATOM 549 CB ARG A 169 -18.987 11.507 14.437 1.00 12.48 C ATOM 550 CG ARG A 169 -18.401 12.865 14.894 1.00 13.89 C ATOM 551 CD ARG A 169 -17.156 12.717 15.738 1.00 16.42 C ATOM 552 NE ARG A 169 -17.421 12.257 17.096 1.00 17.80 N ATOM 553 CZ ARG A 169 -16.471 11.887 17.955 1.00 17.43 C ATOM 554 NH1 ARG A 169 -15.185 11.892 17.594 1.00 16.44 N ATOM 555 NH2 ARG A 169 -16.808 11.490 19.173 1.00 19.41 N ATOM 556 HE ARG A 169 -18.410 12.215 17.414 1.00 0.00 H ATOM 557 HH12 ARG A 169 -14.453 11.601 18.273 1.00 0.00 H ATOM 558 HH11 ARG A 169 -14.916 12.187 16.634 1.00 0.00 H ATOM 559 HH22 ARG A 169 -16.072 11.200 19.848 1.00 0.00 H ATOM 560 HH21 ARG A 169 -17.809 11.468 19.454 1.00 0.00 H ATOM 561 H ARG A 169 -21.433 12.651 14.417 1.00 0.00 H ATOM 562 N VAL A 170 -20.319 9.699 11.840 1.00 8.94 N ATOM 563 CA VAL A 170 -21.022 8.488 11.436 1.00 10.35 C ATOM 564 C VAL A 170 -20.050 7.600 10.681 1.00 10.12 C ATOM 565 O VAL A 170 -19.101 8.080 10.066 1.00 11.94 O ATOM 566 CB VAL A 170 -22.265 8.821 10.583 1.00 11.34 C ATOM 567 CG1 VAL A 170 -21.872 9.539 9.283 1.00 11.78 C ATOM 568 CG2 VAL A 170 -23.139 7.584 10.273 1.00 13.51 C ATOM 569 H VAL A 170 -19.545 10.067 11.251 1.00 0.00 H ATOM 570 N ILE A 171 -20.254 6.297 10.767 1.00 10.05 N ATOM 571 CA ILE A 171 -19.533 5.353 9.929 1.00 10.22 C ATOM 572 C ILE A 171 -20.438 4.984 8.762 1.00 8.63 C ATOM 573 O ILE A 171 -21.550 4.475 8.975 1.00 11.27 O ATOM 574 CB ILE A 171 -19.206 4.070 10.712 1.00 13.09 C ATOM 575 CG1 ILE A 171 -18.669 4.340 12.110 1.00 16.66 C ATOM 576 CG2 ILE A 171 -18.278 3.184 9.868 1.00 13.44 C ATOM 577 CD1 ILE A 171 -17.373 4.883 12.125 1.00 16.51 C ATOM 578 H ILE A 171 -20.949 5.938 11.452 1.00 0.00 H ATOM 579 N VAL A 172 -19.947 5.154 7.533 1.00 8.52 N ATOM 580 CA VAL A 172 -20.651 4.724 6.322 1.00 8.24 C ATOM 581 C VAL A 172 -19.940 3.515 5.729 1.00 8.47 C ATOM 582 O VAL A 172 -18.723 3.579 5.486 1.00 9.10 O ATOM 583 CB VAL A 172 -20.700 5.874 5.302 1.00 10.16 C ATOM 584 CG1 VAL A 172 -21.392 5.438 4.017 1.00 11.94 C ATOM 585 CG2 VAL A 172 -21.370 7.095 5.928 1.00 11.33 C ATOM 586 H VAL A 172 -19.020 5.614 7.430 1.00 0.00 H ATOM 587 N CYS A 173 -20.686 2.438 5.462 1.00 7.77 N ATOM 588 CA CYS A 173 -20.136 1.276 4.778 1.00 7.84 C ATOM 589 C CYS A 173 -20.886 1.043 3.475 1.00 7.14 C ATOM 590 O CYS A 173 -22.097 1.263 3.404 1.00 8.96 O ATOM 591 CB CYS A 173 -20.249 0.022 5.654 1.00 9.37 C ATOM 592 SG CYS A 173 -19.263 0.167 7.183 1.00 10.55 S ATOM 593 H CYS A 173 -21.685 2.430 5.750 1.00 0.00 H ATOM 594 N ASN A 174 -20.184 0.573 2.455 1.00 7.27 N ATOM 595 CA ASN A 174 -20.835 0.336 1.176 1.00 7.91 C ATOM 596 C ASN A 174 -19.926 -0.533 0.320 1.00 7.15 C ATOM 597 O ASN A 174 -18.813 -0.912 0.705 1.00 8.11 O ATOM 598 CB ASN A 174 -21.125 1.689 0.492 1.00 9.15 C ATOM 599 CG ASN A 174 -22.280 1.664 -0.501 1.00 10.12 C ATOM 600 OD1 ASN A 174 -22.819 0.623 -0.863 1.00 9.12 O ATOM 601 ND2 ASN A 174 -22.627 2.851 -0.980 1.00 10.66 N ATOM 602 HD22 ASN A 174 -22.143 3.709 -0.645 1.00 0.00 H ATOM 603 HD21 ASN A 174 -23.383 2.924 -1.691 1.00 0.00 H ATOM 604 H ASN A 174 -19.170 0.374 2.568 1.00 0.00 H ATOM 605 N THR A 175 -20.423 -0.826 -0.876 1.00 7.71 N ATOM 606 CA THR A 175 -19.765 -1.626 -1.904 1.00 7.19 C ATOM 607 C THR A 175 -19.891 -0.874 -3.217 1.00 8.07 C ATOM 608 O THR A 175 -20.943 -0.266 -3.498 1.00 9.40 O ATOM 609 CB THR A 175 -20.481 -3.014 -2.058 1.00 8.24 C ATOM 610 OG1 THR A 175 -20.329 -3.743 -0.843 1.00 8.28 O ATOM 611 CG2 THR A 175 -20.034 -3.859 -3.284 1.00 8.75 C ATOM 612 HG1 THR A 175 -20.739 -3.233 -0.100 1.00 0.00 H ATOM 613 H THR A 175 -21.367 -0.451 -1.100 1.00 0.00 H ATOM 614 N LYS A 176 -18.829 -0.891 -4.007 1.00 7.59 N ATOM 615 CA LYS A 176 -18.795 -0.237 -5.306 1.00 7.87 C ATOM 616 C LYS A 176 -18.657 -1.309 -6.386 1.00 8.69 C ATOM 617 O LYS A 176 -17.684 -2.079 -6.371 1.00 8.60 O ATOM 618 CB LYS A 176 -17.643 0.771 -5.419 1.00 9.82 C ATOM 619 CG LYS A 176 -17.804 1.706 -6.642 1.00 13.70 C ATOM 620 CD LYS A 176 -16.784 2.779 -6.604 1.00 19.51 C ATOM 621 CE LYS A 176 -15.433 2.305 -6.975 1.00 22.79 C ATOM 622 NZ LYS A 176 -14.427 3.452 -7.034 1.00 24.82 N ATOM 623 HZ1 LYS A 176 -14.736 4.147 -7.743 1.00 0.00 H ATOM 624 HZ2 LYS A 176 -14.369 3.909 -6.102 1.00 0.00 H ATOM 625 HZ3 LYS A 176 -13.493 3.079 -7.297 1.00 0.00 H ATOM 626 H LYS A 176 -17.979 -1.396 -3.684 1.00 0.00 H ATOM 627 N LEU A 177 -19.640 -1.398 -7.286 1.00 9.16 N ATOM 628 CA LEU A 177 -19.662 -2.403 -8.351 1.00 9.25 C ATOM 629 C LEU A 177 -19.753 -1.702 -9.697 1.00 10.71 C ATOM 630 O LEU A 177 -20.632 -0.855 -9.902 1.00 11.89 O ATOM 631 CB LEU A 177 -20.848 -3.359 -8.248 1.00 11.19 C ATOM 632 CG LEU A 177 -20.972 -4.127 -6.944 1.00 10.96 C ATOM 633 CD1 LEU A 177 -22.288 -4.877 -6.895 1.00 12.53 C ATOM 634 CD2 LEU A 177 -19.804 -5.060 -6.743 1.00 11.29 C ATOM 635 H LEU A 177 -20.427 -0.721 -7.228 1.00 0.00 H ATOM 636 N ASP A 178 -18.835 -2.031 -10.611 1.00 11.04 N ATOM 637 CA ASP A 178 -18.829 -1.410 -11.929 1.00 12.28 C ATOM 638 C ASP A 178 -18.892 0.120 -11.830 1.00 12.96 C ATOM 639 O ASP A 178 -19.572 0.804 -12.609 1.00 14.74 O ATOM 640 CB ASP A 178 -19.967 -1.936 -12.801 1.00 14.96 C ATOM 641 CG ASP A 178 -19.774 -3.366 -13.219 1.00 18.59 C ATOM 642 OD1 ASP A 178 -18.645 -3.893 -13.141 1.00 17.00 O ATOM 643 OD2 ASP A 178 -20.763 -3.975 -13.663 1.00 23.66 O ATOM 644 H ASP A 178 -18.113 -2.742 -10.378 1.00 0.00 H ATOM 645 N ASN A 179 -18.168 0.659 -10.864 1.00 13.09 N ATOM 646 CA ASN A 179 -17.997 2.085 -10.638 1.00 15.74 C ATOM 647 C ASN A 179 -19.202 2.764 -10.007 1.00 16.87 C ATOM 648 O ASN A 179 -19.214 4.005 -9.931 1.00 20.67 O ATOM 649 CB ASN A 179 -17.590 2.838 -11.908 1.00 18.11 C ATOM 650 CG ASN A 179 -16.231 3.512 -11.787 1.00 21.39 C ATOM 651 OD1 ASN A 179 -15.317 3.027 -11.104 1.00 21.15 O ATOM 652 ND2 ASN A 179 -16.101 4.663 -12.440 1.00 22.76 N ATOM 653 HD22 ASN A 179 -16.893 5.034 -13.002 1.00 0.00 H ATOM 654 HD21 ASN A 179 -15.207 5.192 -12.389 1.00 0.00 H ATOM 655 H ASN A 179 -17.681 0.010 -10.213 1.00 0.00 H ATOM 656 N ASN A 180 -20.195 2.008 -9.541 1.00 13.99 N ATOM 657 CA ASN A 180 -21.374 2.548 -8.878 1.00 16.15 C ATOM 658 C ASN A 180 -21.441 2.109 -7.418 1.00 13.81 C ATOM 659 O ASN A 180 -21.370 0.904 -7.114 1.00 13.51 O ATOM 660 CB ASN A 180 -22.625 2.065 -9.593 1.00 19.86 C ATOM 661 CG ASN A 180 -22.658 2.483 -11.040 1.00 25.61 C ATOM 662 OD1 ASN A 180 -22.419 3.640 -11.362 1.00 28.68 O ATOM 663 ND2 ASN A 180 -22.936 1.535 -11.925 1.00 27.96 N ATOM 664 HD22 ASN A 180 -23.133 0.565 -11.604 1.00 0.00 H ATOM 665 HD21 ASN A 180 -22.957 1.761 -12.940 1.00 0.00 H ATOM 666 H ASN A 180 -20.125 0.977 -9.657 1.00 0.00 H ATOM 667 N TRP A 181 -21.607 3.089 -6.528 1.00 13.79 N ATOM 668 CA TRP A 181 -21.870 2.795 -5.126 1.00 12.57 C ATOM 669 C TRP A 181 -23.279 2.226 -4.933 1.00 13.91 C ATOM 670 O TRP A 181 -24.230 2.577 -5.632 1.00 16.25 O ATOM 671 CB TRP A 181 -21.688 4.051 -4.270 1.00 14.00 C ATOM 672 CG TRP A 181 -20.265 4.449 -4.153 1.00 13.03 C ATOM 673 CD1 TRP A 181 -19.671 5.530 -4.726 1.00 14.77 C ATOM 674 CD2 TRP A 181 -19.251 3.784 -3.398 1.00 11.38 C ATOM 675 NE1 TRP A 181 -18.326 5.551 -4.423 1.00 14.20 N ATOM 676 CE2 TRP A 181 -18.051 4.499 -3.580 1.00 11.67 C ATOM 677 CE3 TRP A 181 -19.237 2.633 -2.605 1.00 10.47 C ATOM 678 CZ2 TRP A 181 -16.852 4.104 -2.989 1.00 12.61 C ATOM 679 CZ3 TRP A 181 -18.052 2.268 -1.993 1.00 11.12 C ATOM 680 CH2 TRP A 181 -16.878 2.982 -2.208 1.00 10.83 C ATOM 681 HE1 TRP A 181 -17.635 6.245 -4.773 1.00 0.00 H ATOM 682 H TRP A 181 -21.548 4.079 -6.841 1.00 0.00 H ATOM 683 N GLY A 182 -23.403 1.307 -3.995 1.00 12.64 N ATOM 684 CA GLY A 182 -24.671 0.706 -3.704 1.00 13.00 C ATOM 685 C GLY A 182 -25.366 1.366 -2.531 1.00 12.65 C ATOM 686 O GLY A 182 -25.157 2.547 -2.228 1.00 13.36 O ATOM 687 H GLY A 182 -22.564 1.013 -3.456 1.00 0.00 H ATOM 688 N ARG A 183 -26.204 0.593 -1.850 1.00 13.25 N ATOM 689 CA ARG A 183 -26.928 1.093 -0.682 1.00 13.97 C ATOM 690 C ARG A 183 -26.020 1.180 0.545 1.00 12.69 C ATOM 691 O ARG A 183 -25.389 0.191 0.930 1.00 14.19 O ATOM 692 CB ARG A 183 -28.095 0.145 -0.410 1.00 18.80 C ATOM 693 CG ARG A 183 -28.677 0.146 0.985 1.00 24.32 C ATOM 694 CD ARG A 183 -29.621 -1.041 1.227 1.00 27.86 C ATOM 695 NE ARG A 183 -29.039 -2.310 0.797 1.00 30.30 N ATOM 696 CZ ARG A 183 -28.366 -3.153 1.576 1.00 32.65 C ATOM 697 NH1 ARG A 183 -28.161 -2.895 2.864 1.00 33.33 N ATOM 698 NH2 ARG A 183 -27.882 -4.264 1.055 1.00 33.96 N ATOM 699 HE ARG A 183 -29.161 -2.577 -0.201 1.00 0.00 H ATOM 700 HH12 ARG A 183 -27.632 -3.570 3.452 1.00 0.00 H ATOM 701 HH11 ARG A 183 -28.530 -2.018 3.284 1.00 0.00 H ATOM 702 HH22 ARG A 183 -27.354 -4.932 1.653 1.00 0.00 H ATOM 703 HH21 ARG A 183 -28.028 -4.472 0.047 1.00 0.00 H ATOM 704 H ARG A 183 -26.349 -0.391 -2.154 1.00 0.00 H ATOM 705 N GLU A 184 -25.966 2.356 1.174 1.00 12.75 N ATOM 706 CA GLU A 184 -25.083 2.548 2.309 1.00 12.14 C ATOM 707 C GLU A 184 -25.658 1.860 3.532 1.00 11.94 C ATOM 708 O GLU A 184 -26.880 1.787 3.714 1.00 13.61 O ATOM 709 CB GLU A 184 -24.919 4.041 2.606 1.00 12.87 C ATOM 710 CG GLU A 184 -24.116 4.775 1.548 1.00 13.85 C ATOM 711 CD GLU A 184 -23.999 6.268 1.770 1.00 15.49 C ATOM 712 OE1 GLU A 184 -24.723 6.853 2.610 1.00 18.20 O ATOM 713 OE2 GLU A 184 -23.151 6.854 1.071 1.00 15.43 O ATOM 714 H GLU A 184 -26.563 3.143 0.847 1.00 0.00 H ATOM 715 N GLU A 185 -24.759 1.356 4.374 1.00 11.36 N ATOM 716 CA GLU A 185 -25.098 0.928 5.722 1.00 11.18 C ATOM 717 C GLU A 185 -24.425 1.873 6.705 1.00 12.25 C ATOM 718 O GLU A 185 -23.207 2.051 6.655 1.00 13.44 O ATOM 719 CB GLU A 185 -24.689 -0.528 6.008 1.00 12.40 C ATOM 720 CG GLU A 185 -25.363 -1.486 5.063 1.00 13.18 C ATOM 721 CD GLU A 185 -24.947 -2.935 5.235 1.00 11.76 C ATOM 722 OE1 GLU A 185 -24.573 -3.353 6.353 1.00 14.22 O ATOM 723 OE2 GLU A 185 -24.954 -3.690 4.239 1.00 14.04 O ATOM 724 H GLU A 185 -23.773 1.264 4.055 1.00 0.00 H ATOM 725 N ARG A 186 -25.196 2.448 7.618 1.00 11.06 N ATOM 726 CA ARG A 186 -24.697 3.491 8.500 1.00 11.72 C ATOM 727 C ARG A 186 -24.747 3.084 9.963 1.00 14.19 C ATOM 728 O ARG A 186 -25.745 2.530 10.423 1.00 16.98 O ATOM 729 CB ARG A 186 -25.468 4.777 8.266 1.00 13.55 C ATOM 730 CG ARG A 186 -25.080 5.403 6.968 1.00 15.50 C ATOM 731 CD ARG A 186 -26.106 6.443 6.543 1.00 15.76 C ATOM 732 NE ARG A 186 -25.541 7.198 5.437 1.00 16.73 N ATOM 733 CZ ARG A 186 -24.931 8.363 5.590 1.00 16.57 C ATOM 734 NH1 ARG A 186 -24.860 8.936 6.787 1.00 16.93 N ATOM 735 NH2 ARG A 186 -24.410 8.961 4.543 1.00 16.18 N ATOM 736 HE ARG A 186 -25.620 6.804 4.478 1.00 0.00 H ATOM 737 HH12 ARG A 186 -24.379 9.851 6.898 1.00 0.00 H ATOM 738 HH11 ARG A 186 -25.286 8.469 7.613 1.00 0.00 H ATOM 739 HH22 ARG A 186 -23.929 9.876 4.653 1.00 0.00 H ATOM 740 HH21 ARG A 186 -24.479 8.519 3.604 1.00 0.00 H ATOM 741 H ARG A 186 -26.187 2.144 7.706 1.00 0.00 H ATOM 742 N GLN A 187 -23.645 3.354 10.674 1.00 14.56 N ATOM 743 CA GLN A 187 -23.472 3.068 12.096 1.00 14.12 C ATOM 744 C GLN A 187 -23.145 4.379 12.792 1.00 15.09 C ATOM 745 O GLN A 187 -22.103 4.991 12.522 1.00 15.52 O ATOM 746 CB GLN A 187 -22.342 2.060 12.256 1.00 13.81 C ATOM 747 CG GLN A 187 -21.861 1.843 13.683 1.00 13.47 C ATOM 748 CD GLN A 187 -22.931 1.336 14.626 1.00 15.06 C ATOM 749 OE1 GLN A 187 -23.896 2.044 14.919 1.00 16.97 O ATOM 750 NE2 GLN A 187 -22.779 0.084 15.089 1.00 18.54 N ATOM 751 HE22 GLN A 187 -21.947 -0.475 14.813 1.00 0.00 H ATOM 752 HE21 GLN A 187 -23.494 -0.326 15.723 1.00 0.00 H ATOM 753 H GLN A 187 -22.850 3.802 10.175 1.00 0.00 H ATOM 754 N SER A 188 -24.045 4.822 13.665 1.00 15.68 N ATOM 755 CA SER A 188 -23.843 6.050 14.428 1.00 16.04 C ATOM 756 C SER A 188 -22.988 5.853 15.674 1.00 15.46 C ATOM 757 O SER A 188 -22.533 6.840 16.261 1.00 15.99 O ATOM 758 CB SER A 188 -25.189 6.643 14.841 1.00 18.65 C ATOM 759 OG SER A 188 -25.930 5.716 15.621 1.00 20.98 O ATOM 760 HG SER A 188 -26.797 6.120 15.877 1.00 0.00 H ATOM 761 H SER A 188 -24.919 4.277 13.808 1.00 0.00 H ATOM 762 N VAL A 189 -22.763 4.623 16.111 1.00 13.15 N ATOM 763 CA VAL A 189 -21.749 4.394 17.125 1.00 12.40 C ATOM 764 C VAL A 189 -20.405 4.735 16.505 1.00 11.22 C ATOM 765 O VAL A 189 -20.058 4.217 15.438 1.00 12.05 O ATOM 766 CB VAL A 189 -21.777 2.948 17.610 1.00 13.30 C ATOM 767 CG1 VAL A 189 -20.626 2.699 18.608 1.00 15.36 C ATOM 768 CG2 VAL A 189 -23.104 2.603 18.236 1.00 16.18 C ATOM 769 H VAL A 189 -23.310 3.825 15.730 1.00 0.00 H ATOM 770 N PHE A 190 -19.666 5.646 17.140 1.00 11.53 N ATOM 771 CA PHE A 190 -18.493 6.250 16.503 1.00 10.39 C ATOM 772 C PHE A 190 -17.336 6.239 17.485 1.00 10.84 C ATOM 773 O PHE A 190 -17.273 7.097 18.387 1.00 12.63 O ATOM 774 CB PHE A 190 -18.775 7.665 16.028 1.00 10.92 C ATOM 775 CG PHE A 190 -17.748 8.206 15.091 1.00 9.66 C ATOM 776 CD1 PHE A 190 -16.691 8.897 15.581 1.00 9.75 C ATOM 777 CD2 PHE A 190 -17.877 8.064 13.720 1.00 9.10 C ATOM 778 CE1 PHE A 190 -15.750 9.413 14.740 1.00 9.17 C ATOM 779 CE2 PHE A 190 -16.941 8.572 12.866 1.00 10.62 C ATOM 780 CZ PHE A 190 -15.866 9.280 13.390 1.00 9.18 C ATOM 781 H PHE A 190 -19.927 5.933 18.105 1.00 0.00 H ATOM 782 N PRO A 191 -16.440 5.254 17.377 1.00 9.48 N ATOM 783 CA PRO A 191 -15.435 5.050 18.419 1.00 11.46 C ATOM 784 C PRO A 191 -14.155 5.814 18.214 1.00 10.89 C ATOM 785 O PRO A 191 -13.289 5.735 19.087 1.00 14.00 O ATOM 786 CB PRO A 191 -15.128 3.544 18.307 1.00 12.62 C ATOM 787 CG PRO A 191 -15.350 3.203 16.846 1.00 13.04 C ATOM 788 CD PRO A 191 -16.565 4.077 16.488 1.00 10.27 C ATOM 789 N PHE A 192 -13.991 6.490 17.087 1.00 10.02 N ATOM 790 CA PHE A 192 -12.776 7.229 16.793 1.00 10.56 C ATOM 791 C PHE A 192 -12.851 8.608 17.402 1.00 10.49 C ATOM 792 O PHE A 192 -13.932 9.210 17.525 1.00 12.35 O ATOM 793 CB PHE A 192 -12.573 7.368 15.277 1.00 9.32 C ATOM 794 CG PHE A 192 -12.512 6.057 14.563 1.00 8.03 C ATOM 795 CD1 PHE A 192 -11.329 5.367 14.522 1.00 9.07 C ATOM 796 CD2 PHE A 192 -13.634 5.489 13.986 1.00 8.52 C ATOM 797 CE1 PHE A 192 -11.234 4.136 13.887 1.00 9.05 C ATOM 798 CE2 PHE A 192 -13.558 4.260 13.341 1.00 9.26 C ATOM 799 CZ PHE A 192 -12.362 3.567 13.305 1.00 8.24 C ATOM 800 H PHE A 192 -14.760 6.492 16.387 1.00 0.00 H ATOM 801 N GLU A 193 -11.673 9.132 17.720 1.00 10.32 N ATOM 802 CA GLU A 193 -11.550 10.458 18.289 1.00 11.56 C ATOM 803 C GLU A 193 -10.376 11.166 17.641 1.00 10.63 C ATOM 804 O GLU A 193 -9.270 10.616 17.569 1.00 10.38 O ATOM 805 CB GLU A 193 -11.426 10.422 19.819 1.00 13.83 C ATOM 806 CG GLU A 193 -12.712 9.869 20.483 1.00 16.98 C ATOM 807 CD GLU A 193 -12.649 9.702 22.015 1.00 19.30 C ATOM 808 OE1 GLU A 193 -11.805 8.917 22.546 1.00 18.06 O ATOM 809 OE2 GLU A 193 -13.473 10.367 22.696 1.00 21.99 O ATOM 810 H GLU A 193 -10.812 8.573 17.555 1.00 0.00 H ATOM 811 N SER A 194 -10.605 12.387 17.168 1.00 11.47 N ATOM 812 CA SER A 194 -9.523 13.129 16.550 1.00 11.34 C ATOM 813 C SER A 194 -8.349 13.249 17.504 1.00 10.65 C ATOM 814 O SER A 194 -8.512 13.493 18.702 1.00 11.22 O ATOM 815 CB SER A 194 -10.003 14.516 16.172 1.00 17.00 C ATOM 816 OG SER A 194 -10.930 14.395 15.132 1.00 22.48 O ATOM 817 HG SER A 194 -11.253 15.294 14.873 1.00 0.00 H ATOM 818 H SER A 194 -11.554 12.807 17.241 1.00 0.00 H ATOM 819 N GLY A 195 -7.155 13.078 16.965 1.00 9.93 N ATOM 820 CA GLY A 195 -5.937 13.158 17.726 1.00 9.45 C ATOM 821 C GLY A 195 -5.527 11.905 18.478 1.00 8.65 C ATOM 822 O GLY A 195 -4.423 11.891 19.027 1.00 9.62 O ATOM 823 H GLY A 195 -7.093 12.877 15.947 1.00 0.00 H ATOM 824 N LYS A 196 -6.343 10.822 18.477 1.00 7.43 N ATOM 825 CA LYS A 196 -6.063 9.697 19.371 1.00 7.40 C ATOM 826 C LYS A 196 -5.681 8.430 18.614 1.00 7.67 C ATOM 827 O LYS A 196 -6.134 8.186 17.495 1.00 7.99 O ATOM 828 CB LYS A 196 -7.259 9.344 20.267 1.00 7.37 C ATOM 829 CG LYS A 196 -7.725 10.447 21.179 1.00 8.06 C ATOM 830 CD LYS A 196 -8.565 9.922 22.344 1.00 9.40 C ATOM 831 CE LYS A 196 -9.359 11.015 23.047 1.00 10.60 C ATOM 832 NZ LYS A 196 -10.078 10.420 24.196 1.00 10.50 N ATOM 833 HZ1 LYS A 196 -10.724 9.680 23.854 1.00 0.00 H ATOM 834 HZ2 LYS A 196 -9.390 10.004 24.856 1.00 0.00 H ATOM 835 HZ3 LYS A 196 -10.624 11.160 24.683 1.00 0.00 H ATOM 836 H LYS A 196 -7.166 10.791 17.842 1.00 0.00 H ATOM 837 N PRO A 197 -4.847 7.602 19.249 1.00 7.80 N ATOM 838 CA PRO A 197 -4.483 6.305 18.673 1.00 8.02 C ATOM 839 C PRO A 197 -5.651 5.357 18.664 1.00 6.91 C ATOM 840 O PRO A 197 -6.460 5.319 19.585 1.00 8.42 O ATOM 841 CB PRO A 197 -3.390 5.801 19.619 1.00 9.91 C ATOM 842 CG PRO A 197 -3.543 6.575 20.839 1.00 10.99 C ATOM 843 CD PRO A 197 -4.153 7.864 20.518 1.00 8.69 C ATOM 844 N PHE A 198 -5.695 4.544 17.610 1.00 7.66 N ATOM 845 CA PHE A 198 -6.761 3.584 17.400 1.00 7.66 C ATOM 846 C PHE A 198 -6.194 2.269 16.889 1.00 7.21 C ATOM 847 O PHE A 198 -5.092 2.200 16.349 1.00 7.91 O ATOM 848 CB PHE A 198 -7.803 4.067 16.370 1.00 9.05 C ATOM 849 CG PHE A 198 -7.261 4.210 14.993 1.00 8.79 C ATOM 850 CD1 PHE A 198 -7.200 3.127 14.136 1.00 9.02 C ATOM 851 CD2 PHE A 198 -6.780 5.414 14.557 1.00 12.67 C ATOM 852 CE1 PHE A 198 -6.684 3.247 12.889 1.00 10.03 C ATOM 853 CE2 PHE A 198 -6.232 5.534 13.288 1.00 13.34 C ATOM 854 CZ PHE A 198 -6.192 4.454 12.445 1.00 12.72 C ATOM 855 H PHE A 198 -4.931 4.600 16.907 1.00 0.00 H ATOM 856 N LYS A 199 -6.984 1.223 17.077 1.00 7.96 N ATOM 857 CA LYS A 199 -6.768 -0.078 16.457 1.00 7.50 C ATOM 858 C LYS A 199 -8.066 -0.478 15.772 1.00 7.14 C ATOM 859 O LYS A 199 -9.109 -0.503 16.413 1.00 8.97 O ATOM 860 CB LYS A 199 -6.412 -1.107 17.531 1.00 8.79 C ATOM 861 CG LYS A 199 -6.199 -2.501 16.936 1.00 9.60 C ATOM 862 CD LYS A 199 -5.636 -3.497 17.927 1.00 12.45 C ATOM 863 CE LYS A 199 -6.598 -3.734 19.088 1.00 14.60 C ATOM 864 NZ LYS A 199 -6.002 -4.650 20.121 1.00 18.79 N ATOM 865 HZ1 LYS A 199 -5.782 -5.567 19.683 1.00 0.00 H ATOM 866 HZ2 LYS A 199 -5.130 -4.226 20.497 1.00 0.00 H ATOM 867 HZ3 LYS A 199 -6.683 -4.788 20.894 1.00 0.00 H ATOM 868 H LYS A 199 -7.806 1.337 17.703 1.00 0.00 H ATOM 869 N ILE A 200 -8.012 -0.772 14.477 1.00 6.77 N ATOM 870 CA ILE A 200 -9.138 -1.363 13.760 1.00 7.03 C ATOM 871 C ILE A 200 -8.783 -2.820 13.479 1.00 8.18 C ATOM 872 O ILE A 200 -7.704 -3.104 12.930 1.00 8.65 O ATOM 873 CB ILE A 200 -9.434 -0.651 12.426 1.00 7.43 C ATOM 874 CG1 ILE A 200 -9.710 0.833 12.631 1.00 8.57 C ATOM 875 CG2 ILE A 200 -10.641 -1.335 11.744 1.00 9.00 C ATOM 876 CD1 ILE A 200 -9.759 1.626 11.320 1.00 9.65 C ATOM 877 H ILE A 200 -7.135 -0.574 13.955 1.00 0.00 H ATOM 878 N GLN A 201 -9.645 -3.748 13.887 1.00 7.58 N ATOM 879 CA GLN A 201 -9.497 -5.165 13.560 1.00 7.90 C ATOM 880 C GLN A 201 -10.659 -5.575 12.676 1.00 6.80 C ATOM 881 O GLN A 201 -11.817 -5.329 13.027 1.00 9.74 O ATOM 882 CB GLN A 201 -9.522 -6.038 14.814 1.00 10.24 C ATOM 883 CG GLN A 201 -8.347 -5.785 15.752 1.00 13.54 C ATOM 884 CD GLN A 201 -8.547 -6.419 17.096 1.00 16.09 C ATOM 885 OE1 GLN A 201 -9.594 -6.244 17.730 1.00 17.98 O ATOM 886 NE2 GLN A 201 -7.569 -7.233 17.520 1.00 17.43 N ATOM 887 HE22 GLN A 201 -6.706 -7.348 16.952 1.00 0.00 H ATOM 888 HE21 GLN A 201 -7.674 -7.749 18.417 1.00 0.00 H ATOM 889 H GLN A 201 -10.459 -3.452 14.463 1.00 0.00 H ATOM 890 N VAL A 202 -10.355 -6.145 11.513 1.00 6.50 N ATOM 891 CA VAL A 202 -11.382 -6.647 10.599 1.00 6.52 C ATOM 892 C VAL A 202 -11.185 -8.146 10.508 1.00 6.86 C ATOM 893 O VAL A 202 -10.145 -8.601 10.030 1.00 7.73 O ATOM 894 CB VAL A 202 -11.315 -6.013 9.209 1.00 6.67 C ATOM 895 CG1 VAL A 202 -12.461 -6.552 8.365 1.00 8.81 C ATOM 896 CG2 VAL A 202 -11.307 -4.503 9.285 1.00 7.52 C ATOM 897 H VAL A 202 -9.354 -6.237 11.244 1.00 0.00 H ATOM 898 N LEU A 203 -12.130 -8.893 11.053 1.00 6.21 N ATOM 899 CA LEU A 203 -12.075 -10.344 11.048 1.00 7.52 C ATOM 900 C LEU A 203 -13.012 -10.811 9.958 1.00 7.79 C ATOM 901 O LEU A 203 -14.204 -10.475 9.977 1.00 9.19 O ATOM 902 CB LEU A 203 -12.498 -10.907 12.399 1.00 9.65 C ATOM 903 CG LEU A 203 -12.522 -12.432 12.479 1.00 12.00 C ATOM 904 CD1 LEU A 203 -11.169 -13.039 12.102 1.00 10.79 C ATOM 905 CD2 LEU A 203 -12.975 -12.878 13.845 1.00 15.16 C ATOM 906 H LEU A 203 -12.943 -8.424 11.502 1.00 0.00 H ATOM 907 N VAL A 204 -12.475 -11.535 8.989 1.00 7.34 N ATOM 908 CA VAL A 204 -13.325 -12.105 7.949 1.00 7.70 C ATOM 909 C VAL A 204 -14.021 -13.338 8.518 1.00 8.69 C ATOM 910 O VAL A 204 -13.380 -14.286 8.987 1.00 10.09 O ATOM 911 CB VAL A 204 -12.519 -12.447 6.697 1.00 8.67 C ATOM 912 CG1 VAL A 204 -13.431 -12.987 5.570 1.00 9.22 C ATOM 913 CG2 VAL A 204 -11.682 -11.218 6.274 1.00 8.54 C ATOM 914 H VAL A 204 -11.448 -11.698 8.969 1.00 0.00 H ATOM 915 N GLU A 205 -15.334 -13.329 8.459 1.00 8.99 N ATOM 916 CA GLU A 205 -16.179 -14.449 8.860 1.00 9.99 C ATOM 917 C GLU A 205 -16.929 -14.978 7.642 1.00 10.39 C ATOM 918 O GLU A 205 -16.890 -14.371 6.559 1.00 9.46 O ATOM 919 CB GLU A 205 -17.125 -13.980 9.967 1.00 10.87 C ATOM 920 CG GLU A 205 -16.372 -13.534 11.210 1.00 11.61 C ATOM 921 CD GLU A 205 -17.240 -13.393 12.430 1.00 14.54 C ATOM 922 OE1 GLU A 205 -18.409 -12.971 12.303 1.00 14.83 O ATOM 923 OE2 GLU A 205 -16.737 -13.701 13.528 1.00 16.18 O ATOM 924 H GLU A 205 -15.800 -12.470 8.104 1.00 0.00 H ATOM 925 N PRO A 206 -17.597 -16.143 7.758 1.00 10.84 N ATOM 926 CA PRO A 206 -18.231 -16.740 6.565 1.00 11.20 C ATOM 927 C PRO A 206 -19.235 -15.839 5.883 1.00 9.83 C ATOM 928 O PRO A 206 -19.293 -15.858 4.653 1.00 11.93 O ATOM 929 CB PRO A 206 -18.842 -18.051 7.089 1.00 12.49 C ATOM 930 CG PRO A 206 -17.889 -18.403 8.245 1.00 13.16 C ATOM 931 CD PRO A 206 -17.548 -17.074 8.901 1.00 11.68 C ATOM 932 N ASP A 207 -19.994 -15.035 6.624 1.00 10.71 N ATOM 933 CA ASP A 207 -21.032 -14.242 6.010 1.00 10.84 C ATOM 934 C ASP A 207 -20.792 -12.749 6.079 1.00 8.82 C ATOM 935 O ASP A 207 -21.569 -12.009 5.472 1.00 9.22 O ATOM 936 CB ASP A 207 -22.399 -14.498 6.656 1.00 14.06 C ATOM 937 CG ASP A 207 -23.046 -15.780 6.229 1.00 16.62 C ATOM 938 OD1 ASP A 207 -22.548 -16.421 5.260 1.00 17.48 O ATOM 939 OD2 ASP A 207 -24.093 -16.107 6.902 1.00 17.86 O ATOM 940 H ASP A 207 -19.838 -14.978 7.651 1.00 0.00 H ATOM 941 N HIS A 208 -19.724 -12.289 6.723 1.00 7.93 N ATOM 942 CA HIS A 208 -19.583 -10.852 6.891 1.00 8.07 C ATOM 943 C HIS A 208 -18.155 -10.551 7.277 1.00 7.84 C ATOM 944 O HIS A 208 -17.427 -11.409 7.788 1.00 8.28 O ATOM 945 CB HIS A 208 -20.537 -10.324 7.969 1.00 9.91 C ATOM 946 CG HIS A 208 -20.546 -11.158 9.205 1.00 13.03 C ATOM 947 ND1 HIS A 208 -21.566 -12.034 9.508 1.00 14.69 N ATOM 948 CD2 HIS A 208 -19.631 -11.282 10.193 1.00 14.70 C ATOM 949 CE1 HIS A 208 -21.276 -12.655 10.637 1.00 16.40 C ATOM 950 NE2 HIS A 208 -20.114 -12.208 11.079 1.00 16.99 N ATOM 951 H HIS A 208 -19.006 -12.942 7.098 1.00 0.00 H ATOM 952 N PHE A 209 -17.781 -9.293 7.039 1.00 7.48 N ATOM 953 CA PHE A 209 -16.641 -8.694 7.713 1.00 7.42 C ATOM 954 C PHE A 209 -17.112 -8.217 9.084 1.00 7.79 C ATOM 955 O PHE A 209 -18.139 -7.523 9.199 1.00 9.76 O ATOM 956 CB PHE A 209 -16.104 -7.490 6.954 1.00 6.81 C ATOM 957 CG PHE A 209 -15.558 -7.807 5.603 1.00 7.37 C ATOM 958 CD1 PHE A 209 -14.245 -8.169 5.476 1.00 8.54 C ATOM 959 CD2 PHE A 209 -16.332 -7.691 4.466 1.00 8.36 C ATOM 960 CE1 PHE A 209 -13.703 -8.373 4.215 1.00 9.90 C ATOM 961 CE2 PHE A 209 -15.806 -7.938 3.227 1.00 9.00 C ATOM 962 CZ PHE A 209 -14.494 -8.294 3.093 1.00 10.84 C ATOM 963 H PHE A 209 -18.319 -8.726 6.353 1.00 0.00 H ATOM 964 N LYS A 210 -16.353 -8.557 10.115 1.00 8.07 N ATOM 965 CA LYS A 210 -16.635 -8.166 11.489 1.00 8.13 C ATOM 966 C LYS A 210 -15.583 -7.162 11.950 1.00 8.51 C ATOM 967 O LYS A 210 -14.386 -7.474 11.964 1.00 8.57 O ATOM 968 CB LYS A 210 -16.651 -9.412 12.387 1.00 10.51 C ATOM 969 CG LYS A 210 -17.144 -9.115 13.815 1.00 13.66 C ATOM 970 CD LYS A 210 -17.187 -10.370 14.682 1.00 15.84 C ATOM 971 CE LYS A 210 -15.809 -10.831 15.117 1.00 15.75 C ATOM 972 NZ LYS A 210 -15.840 -12.174 15.763 1.00 15.10 N ATOM 973 HZ1 LYS A 210 -16.449 -12.138 16.605 1.00 0.00 H ATOM 974 HZ2 LYS A 210 -16.217 -12.872 15.091 1.00 0.00 H ATOM 975 HZ3 LYS A 210 -14.876 -12.445 16.043 1.00 0.00 H ATOM 976 H LYS A 210 -15.508 -9.136 9.933 1.00 0.00 H ATOM 977 N VAL A 211 -16.028 -5.960 12.332 1.00 7.78 N ATOM 978 CA VAL A 211 -15.124 -4.866 12.665 1.00 7.05 C ATOM 979 C VAL A 211 -15.202 -4.567 14.155 1.00 6.81 C ATOM 980 O VAL A 211 -16.288 -4.336 14.692 1.00 8.92 O ATOM 981 CB VAL A 211 -15.418 -3.589 11.869 1.00 7.28 C ATOM 982 CG1 VAL A 211 -14.408 -2.498 12.229 1.00 8.18 C ATOM 983 CG2 VAL A 211 -15.413 -3.858 10.402 1.00 9.03 C ATOM 984 H VAL A 211 -17.054 -5.800 12.394 1.00 0.00 H ATOM 985 N ALA A 212 -14.040 -4.552 14.809 1.00 7.26 N ATOM 986 CA ALA A 212 -13.897 -4.088 16.176 1.00 6.92 C ATOM 987 C ALA A 212 -12.905 -2.940 16.178 1.00 7.36 C ATOM 988 O ALA A 212 -11.901 -2.963 15.451 1.00 9.12 O ATOM 989 CB ALA A 212 -13.378 -5.195 17.122 1.00 8.30 C ATOM 990 H ALA A 212 -13.191 -4.891 14.313 1.00 0.00 H ATOM 991 N VAL A 213 -13.154 -1.937 17.002 1.00 7.44 N ATOM 992 CA VAL A 213 -12.255 -0.795 17.139 1.00 8.16 C ATOM 993 C VAL A 213 -11.864 -0.696 18.605 1.00 8.36 C ATOM 994 O VAL A 213 -12.722 -0.752 19.496 1.00 8.26 O ATOM 995 CB VAL A 213 -12.872 0.524 16.636 1.00 7.73 C ATOM 996 CG1 VAL A 213 -11.929 1.698 16.911 1.00 9.01 C ATOM 997 CG2 VAL A 213 -13.203 0.401 15.168 1.00 9.36 C ATOM 998 H VAL A 213 -14.022 -1.962 17.574 1.00 0.00 H ATOM 999 N ASN A 214 -10.567 -0.643 18.858 1.00 8.19 N ATOM 1000 CA ASN A 214 -10.050 -0.562 20.227 1.00 8.31 C ATOM 1001 C ASN A 214 -10.601 -1.690 21.086 1.00 10.25 C ATOM 1002 O ASN A 214 -10.994 -1.492 22.238 1.00 11.35 O ATOM 1003 CB ASN A 214 -10.308 0.807 20.858 1.00 8.95 C ATOM 1004 CG ASN A 214 -9.733 1.935 20.038 1.00 9.13 C ATOM 1005 OD1 ASN A 214 -8.780 1.743 19.297 1.00 9.11 O ATOM 1006 ND2 ASN A 214 -10.247 3.149 20.239 1.00 10.57 N ATOM 1007 HD22 ASN A 214 -11.059 3.271 20.878 1.00 0.00 H ATOM 1008 HD21 ASN A 214 -9.836 3.974 19.757 1.00 0.00 H ATOM 1009 H ASN A 214 -9.896 -0.659 18.064 1.00 0.00 H ATOM 1010 N ASP A 215 -10.644 -2.895 20.500 1.00 9.95 N ATOM 1011 CA ASP A 215 -11.080 -4.135 21.163 1.00 11.46 C ATOM 1012 C ASP A 215 -12.574 -4.191 21.468 1.00 10.96 C ATOM 1013 O ASP A 215 -13.025 -5.090 22.187 1.00 13.30 O ATOM 1014 CB ASP A 215 -10.224 -4.476 22.377 1.00 13.63 C ATOM 1015 CG ASP A 215 -8.813 -4.783 21.984 1.00 15.92 C ATOM 1016 OD1 ASP A 215 -8.608 -5.715 21.176 1.00 16.90 O ATOM 1017 OD2 ASP A 215 -7.912 -4.079 22.476 1.00 19.15 O ATOM 1018 H ASP A 215 -10.348 -2.958 19.505 1.00 0.00 H ATOM 1019 N ALA A 216 -13.377 -3.304 20.900 1.00 10.23 N ATOM 1020 CA ALA A 216 -14.822 -3.332 21.105 1.00 10.60 C ATOM 1021 C ALA A 216 -15.536 -3.551 19.782 1.00 10.07 C ATOM 1022 O ALA A 216 -15.297 -2.812 18.817 1.00 9.32 O ATOM 1023 CB ALA A 216 -15.317 -2.023 21.738 1.00 12.99 C ATOM 1024 H ALA A 216 -12.967 -2.567 20.291 1.00 0.00 H ATOM 1025 N HIS A 217 -16.405 -4.551 19.728 1.00 10.06 N ATOM 1026 CA HIS A 217 -17.159 -4.799 18.509 1.00 9.99 C ATOM 1027 C HIS A 217 -17.867 -3.535 18.064 1.00 8.85 C ATOM 1028 O HIS A 217 -18.562 -2.905 18.862 1.00 11.24 O ATOM 1029 CB HIS A 217 -18.204 -5.868 18.761 1.00 10.79 C ATOM 1030 CG HIS A 217 -19.042 -6.146 17.570 1.00 12.98 C ATOM 1031 ND1 HIS A 217 -18.535 -6.717 16.416 1.00 14.81 N ATOM 1032 CD2 HIS A 217 -20.321 -5.815 17.305 1.00 12.83 C ATOM 1033 CE1 HIS A 217 -19.514 -6.824 15.536 1.00 15.80 C ATOM 1034 NE2 HIS A 217 -20.604 -6.277 16.049 1.00 14.15 N ATOM 1035 H HIS A 217 -16.548 -5.160 20.559 1.00 0.00 H ATOM 1036 N LEU A 218 -17.793 -3.231 16.763 1.00 9.08 N ATOM 1037 CA LEU A 218 -18.471 -2.074 16.184 1.00 9.51 C ATOM 1038 C LEU A 218 -19.589 -2.442 15.220 1.00 9.07 C ATOM 1039 O LEU A 218 -20.703 -1.925 15.354 1.00 11.30 O ATOM 1040 CB LEU A 218 -17.438 -1.223 15.449 1.00 10.52 C ATOM 1041 CG LEU A 218 -17.995 0.025 14.776 1.00 10.82 C ATOM 1042 CD1 LEU A 218 -18.721 0.961 15.789 1.00 11.09 C ATOM 1043 CD2 LEU A 218 -16.920 0.755 13.954 1.00 11.08 C ATOM 1044 H LEU A 218 -17.230 -3.843 16.139 1.00 0.00 H ATOM 1045 N LEU A 219 -19.316 -3.279 14.220 1.00 9.24 N ATOM 1046 CA LEU A 219 -20.319 -3.580 13.203 1.00 9.14 C ATOM 1047 C LEU A 219 -19.946 -4.841 12.440 1.00 8.83 C ATOM 1048 O LEU A 219 -18.794 -5.290 12.462 1.00 9.55 O ATOM 1049 CB LEU A 219 -20.527 -2.376 12.263 1.00 9.91 C ATOM 1050 CG LEU A 219 -19.342 -1.961 11.386 1.00 9.31 C ATOM 1051 CD1 LEU A 219 -19.133 -2.840 10.150 1.00 9.40 C ATOM 1052 CD2 LEU A 219 -19.556 -0.520 10.910 1.00 10.82 C ATOM 1053 H LEU A 219 -18.377 -3.723 14.163 1.00 0.00 H ATOM 1054 N GLN A 220 -20.927 -5.377 11.728 1.00 9.15 N ATOM 1055 CA GLN A 220 -20.711 -6.422 10.744 1.00 9.49 C ATOM 1056 C GLN A 220 -21.225 -5.937 9.397 1.00 9.89 C ATOM 1057 O GLN A 220 -22.213 -5.193 9.319 1.00 13.37 O ATOM 1058 CB GLN A 220 -21.439 -7.704 11.129 1.00 13.06 C ATOM 1059 CG GLN A 220 -20.914 -8.366 12.382 1.00 19.14 C ATOM 1060 CD GLN A 220 -21.717 -9.541 12.832 1.00 24.26 C ATOM 1061 OE1 GLN A 220 -22.664 -9.970 12.170 1.00 25.83 O ATOM 1062 NE2 GLN A 220 -21.338 -10.083 13.971 1.00 27.15 N ATOM 1063 HE22 GLN A 220 -20.532 -9.685 14.494 1.00 0.00 H ATOM 1064 HE21 GLN A 220 -21.845 -10.909 14.348 1.00 0.00 H ATOM 1065 H GLN A 220 -21.896 -5.033 11.881 1.00 0.00 H ATOM 1066 N TYR A 221 -20.559 -6.369 8.336 1.00 8.62 N ATOM 1067 CA TYR A 221 -20.950 -6.025 6.972 1.00 8.45 C ATOM 1068 C TYR A 221 -21.091 -7.297 6.160 1.00 7.59 C ATOM 1069 O TYR A 221 -20.098 -7.976 5.889 1.00 8.42 O ATOM 1070 CB TYR A 221 -19.927 -5.095 6.345 1.00 7.61 C ATOM 1071 CG TYR A 221 -20.353 -4.512 5.031 1.00 8.17 C ATOM 1072 CD1 TYR A 221 -21.123 -3.361 4.987 1.00 8.99 C ATOM 1073 CD2 TYR A 221 -19.951 -5.088 3.819 1.00 8.56 C ATOM 1074 CE1 TYR A 221 -21.510 -2.814 3.787 1.00 8.92 C ATOM 1075 CE2 TYR A 221 -20.343 -4.540 2.591 1.00 8.91 C ATOM 1076 CZ TYR A 221 -21.108 -3.378 2.587 1.00 7.76 C ATOM 1077 OH TYR A 221 -21.479 -2.782 1.389 1.00 8.67 O ATOM 1078 HH TYR A 221 -20.667 -2.531 0.881 1.00 0.00 H ATOM 1079 H TYR A 221 -19.727 -6.976 8.480 1.00 0.00 H ATOM 1080 N ASN A 222 -22.322 -7.627 5.777 1.00 9.15 N ATOM 1081 CA ASN A 222 -22.587 -8.864 5.041 1.00 9.18 C ATOM 1082 C ASN A 222 -21.870 -8.843 3.694 1.00 8.17 C ATOM 1083 O ASN A 222 -21.822 -7.818 3.010 1.00 10.12 O ATOM 1084 CB ASN A 222 -24.104 -9.014 4.823 1.00 12.04 C ATOM 1085 CG ASN A 222 -24.483 -10.392 4.194 1.00 17.88 C ATOM 1086 OD1 ASN A 222 -24.710 -10.537 2.979 1.00 21.85 O ATOM 1087 ND2 ASN A 222 -24.596 -11.391 5.053 1.00 19.58 N ATOM 1088 HD22 ASN A 222 -24.398 -11.234 6.062 1.00 0.00 H ATOM 1089 HD21 ASN A 222 -24.882 -12.334 4.720 1.00 0.00 H ATOM 1090 H ASN A 222 -23.113 -6.992 6.006 1.00 0.00 H ATOM 1091 N HIS A 223 -21.343 -10.002 3.289 1.00 8.25 N ATOM 1092 CA HIS A 223 -20.596 -10.071 2.039 1.00 7.93 C ATOM 1093 C HIS A 223 -21.542 -9.898 0.856 1.00 8.18 C ATOM 1094 O HIS A 223 -22.371 -10.779 0.574 1.00 11.18 O ATOM 1095 CB HIS A 223 -19.893 -11.411 1.890 1.00 7.88 C ATOM 1096 CG HIS A 223 -18.796 -11.654 2.849 1.00 7.10 C ATOM 1097 ND1 HIS A 223 -17.752 -10.774 3.031 1.00 6.92 N ATOM 1098 CD2 HIS A 223 -18.588 -12.686 3.694 1.00 8.36 C ATOM 1099 CE1 HIS A 223 -16.943 -11.257 3.961 1.00 7.39 C ATOM 1100 NE2 HIS A 223 -17.423 -12.433 4.366 1.00 8.81 N ATOM 1101 H HIS A 223 -21.466 -10.858 3.867 1.00 0.00 H ATOM 1102 N ARG A 224 -21.402 -8.792 0.136 1.00 7.30 N ATOM 1103 CA ARG A 224 -22.091 -8.558 -1.127 1.00 7.45 C ATOM 1104 C ARG A 224 -21.295 -9.126 -2.289 1.00 8.27 C ATOM 1105 O ARG A 224 -21.873 -9.689 -3.227 1.00 8.65 O ATOM 1106 CB ARG A 224 -22.330 -7.058 -1.351 1.00 8.39 C ATOM 1107 CG ARG A 224 -23.152 -6.421 -0.245 1.00 8.84 C ATOM 1108 CD ARG A 224 -23.555 -5.038 -0.598 1.00 10.12 C ATOM 1109 NE ARG A 224 -24.055 -4.322 0.565 1.00 10.15 N ATOM 1110 CZ ARG A 224 -24.272 -3.012 0.591 1.00 10.29 C ATOM 1111 NH1 ARG A 224 -24.183 -2.280 -0.515 1.00 11.66 N ATOM 1112 NH2 ARG A 224 -24.650 -2.426 1.718 1.00 12.02 N ATOM 1113 HE ARG A 224 -24.254 -4.868 1.427 1.00 0.00 H ATOM 1114 HH12 ARG A 224 -24.356 -1.255 -0.476 1.00 0.00 H ATOM 1115 HH11 ARG A 224 -23.940 -2.732 -1.420 1.00 0.00 H ATOM 1116 HH22 ARG A 224 -24.820 -1.400 1.739 1.00 0.00 H ATOM 1117 HH21 ARG A 224 -24.777 -2.992 2.581 1.00 0.00 H ATOM 1118 H ARG A 224 -20.765 -8.051 0.493 1.00 0.00 H ATOM 1119 N VAL A 225 -19.976 -8.960 -2.233 1.00 8.17 N ATOM 1120 CA VAL A 225 -19.044 -9.582 -3.168 1.00 8.40 C ATOM 1121 C VAL A 225 -18.683 -10.952 -2.606 1.00 8.59 C ATOM 1122 O VAL A 225 -18.170 -11.056 -1.486 1.00 10.31 O ATOM 1123 CB VAL A 225 -17.797 -8.701 -3.353 1.00 9.47 C ATOM 1124 CG1 VAL A 225 -16.755 -9.400 -4.176 1.00 10.05 C ATOM 1125 CG2 VAL A 225 -18.193 -7.328 -3.982 1.00 8.80 C ATOM 1126 H VAL A 225 -19.588 -8.354 -1.482 1.00 0.00 H ATOM 1127 N LYS A 226 -19.010 -12.000 -3.340 1.00 8.36 N ATOM 1128 CA LYS A 226 -18.966 -13.349 -2.793 1.00 8.70 C ATOM 1129 C LYS A 226 -17.696 -14.098 -3.122 1.00 7.81 C ATOM 1130 O LYS A 226 -17.445 -15.143 -2.505 1.00 8.74 O ATOM 1131 CB LYS A 226 -20.217 -14.093 -3.228 1.00 11.28 C ATOM 1132 CG LYS A 226 -21.398 -13.317 -2.509 1.00 15.37 C ATOM 1133 CD LYS A 226 -22.715 -13.825 -2.749 1.00 14.39 C ATOM 1134 CE LYS A 226 -23.747 -12.851 -2.242 1.00 9.35 C ATOM 1135 NZ LYS A 226 -23.901 -12.778 -0.791 1.00 8.87 N ATOM 1136 HZ1 LYS A 226 -24.180 -13.711 -0.426 1.00 0.00 H ATOM 1137 HZ2 LYS A 226 -22.998 -12.492 -0.362 1.00 0.00 H ATOM 1138 HZ3 LYS A 226 -24.635 -12.079 -0.556 1.00 0.00 H ATOM 1139 H LYS A 226 -19.305 -11.859 -4.327 1.00 0.00 H ATOM 1140 N LYS A 227 -16.920 -13.619 -4.098 1.00 8.30 N ATOM 1141 CA LYS A 227 -15.649 -14.232 -4.481 1.00 8.45 C ATOM 1142 C LYS A 227 -14.582 -13.684 -3.539 1.00 6.78 C ATOM 1143 O LYS A 227 -13.785 -12.801 -3.880 1.00 7.62 O ATOM 1144 CB LYS A 227 -15.342 -13.922 -5.939 1.00 8.36 C ATOM 1145 CG LYS A 227 -16.321 -14.601 -6.898 1.00 9.04 C ATOM 1146 CD LYS A 227 -16.132 -14.162 -8.333 1.00 10.63 C ATOM 1147 CE LYS A 227 -16.998 -14.924 -9.282 1.00 13.52 C ATOM 1148 NZ LYS A 227 -16.941 -14.390 -10.624 1.00 14.93 N ATOM 1149 HZ1 LYS A 227 -17.262 -13.401 -10.616 1.00 0.00 H ATOM 1150 HZ2 LYS A 227 -15.962 -14.435 -10.972 1.00 0.00 H ATOM 1151 HZ3 LYS A 227 -17.558 -14.951 -11.246 1.00 0.00 H ATOM 1152 H LYS A 227 -17.235 -12.770 -4.610 1.00 0.00 H ATOM 1153 N LEU A 228 -14.571 -14.241 -2.321 1.00 7.28 N ATOM 1154 CA LEU A 228 -13.664 -13.769 -1.283 1.00 7.68 C ATOM 1155 C LEU A 228 -12.225 -13.886 -1.737 1.00 7.60 C ATOM 1156 O LEU A 228 -11.397 -13.025 -1.417 1.00 7.26 O ATOM 1157 CB LEU A 228 -13.885 -14.519 0.018 1.00 8.06 C ATOM 1158 CG LEU A 228 -15.261 -14.401 0.654 1.00 8.81 C ATOM 1159 CD1 LEU A 228 -15.256 -15.115 1.988 1.00 10.50 C ATOM 1160 CD2 LEU A 228 -15.723 -12.999 0.802 1.00 10.11 C ATOM 1161 H LEU A 228 -15.222 -15.025 -2.112 1.00 0.00 H ATOM 1162 N ASN A 229 -11.902 -14.946 -2.491 1.00 7.96 N ATOM 1163 CA ASN A 229 -10.540 -15.190 -2.947 1.00 8.99 C ATOM 1164 C ASN A 229 -10.103 -14.206 -4.015 1.00 8.73 C ATOM 1165 O ASN A 229 -8.947 -14.274 -4.437 1.00 10.72 O ATOM 1166 CB ASN A 229 -10.377 -16.613 -3.478 1.00 11.90 C ATOM 1167 CG ASN A 229 -11.120 -16.810 -4.750 1.00 18.16 C ATOM 1168 OD1 ASN A 229 -12.259 -16.419 -4.856 1.00 22.23 O ATOM 1169 ND2 ASN A 229 -10.463 -17.344 -5.749 1.00 25.67 N ATOM 1170 HD22 ASN A 229 -9.484 -17.667 -5.614 1.00 0.00 H ATOM 1171 HD21 ASN A 229 -10.920 -17.445 -6.678 1.00 0.00 H ATOM 1172 H ASN A 229 -12.649 -15.617 -2.760 1.00 0.00 H ATOM 1173 N GLU A 230 -10.971 -13.279 -4.430 1.00 6.95 N ATOM 1174 CA GLU A 230 -10.594 -12.244 -5.378 1.00 6.87 C ATOM 1175 C GLU A 230 -10.492 -10.867 -4.729 1.00 6.46 C ATOM 1176 O GLU A 230 -10.137 -9.893 -5.407 1.00 7.56 O ATOM 1177 CB GLU A 230 -11.555 -12.249 -6.566 1.00 6.86 C ATOM 1178 CG GLU A 230 -11.485 -13.541 -7.362 1.00 8.60 C ATOM 1179 CD GLU A 230 -12.323 -13.569 -8.597 1.00 8.77 C ATOM 1180 OE1 GLU A 230 -12.902 -12.514 -8.966 1.00 10.00 O ATOM 1181 OE2 GLU A 230 -12.405 -14.655 -9.220 1.00 10.71 O ATOM 1182 H GLU A 230 -11.944 -13.299 -4.064 1.00 0.00 H ATOM 1183 N ILE A 231 -10.760 -10.770 -3.432 1.00 5.77 N ATOM 1184 CA ILE A 231 -10.710 -9.487 -2.704 1.00 5.90 C ATOM 1185 C ILE A 231 -9.284 -9.377 -2.194 1.00 6.02 C ATOM 1186 O ILE A 231 -8.971 -9.716 -1.048 1.00 7.81 O ATOM 1187 CB ILE A 231 -11.728 -9.436 -1.563 1.00 6.46 C ATOM 1188 CG1 ILE A 231 -13.136 -9.676 -2.110 1.00 7.34 C ATOM 1189 CG2 ILE A 231 -11.676 -8.101 -0.852 1.00 7.75 C ATOM 1190 CD1 ILE A 231 -14.216 -9.849 -1.067 1.00 8.21 C ATOM 1191 H ILE A 231 -11.015 -11.632 -2.909 1.00 0.00 H ATOM 1192 N SER A 232 -8.403 -8.903 -3.062 1.00 6.85 N ATOM 1193 CA SER A 232 -6.973 -9.122 -2.857 1.00 7.44 C ATOM 1194 C SER A 232 -6.185 -7.848 -2.576 1.00 7.13 C ATOM 1195 O SER A 232 -4.951 -7.857 -2.658 1.00 7.32 O ATOM 1196 CB SER A 232 -6.369 -9.895 -4.017 1.00 10.28 C ATOM 1197 OG SER A 232 -6.495 -9.136 -5.182 1.00 10.70 O ATOM 1198 HG SER A 232 -7.453 -8.961 -5.359 1.00 0.00 H ATOM 1199 H SER A 232 -8.731 -8.372 -3.894 1.00 0.00 H ATOM 1200 N LYS A 233 -6.855 -6.774 -2.221 1.00 6.93 N ATOM 1201 CA LYS A 233 -6.183 -5.556 -1.797 1.00 8.32 C ATOM 1202 C LYS A 233 -6.976 -4.901 -0.674 1.00 7.23 C ATOM 1203 O LYS A 233 -8.206 -4.862 -0.718 1.00 7.72 O ATOM 1204 CB LYS A 233 -6.083 -4.551 -2.956 1.00 11.65 C ATOM 1205 CG LYS A 233 -5.806 -3.118 -2.485 1.00 13.91 C ATOM 1206 CD LYS A 233 -5.823 -2.131 -3.639 1.00 15.84 C ATOM 1207 CE LYS A 233 -5.602 -0.718 -3.118 1.00 17.36 C ATOM 1208 NZ LYS A 233 -6.078 0.287 -4.133 1.00 17.48 N ATOM 1209 HZ1 LYS A 233 -5.547 0.162 -5.018 1.00 0.00 H ATOM 1210 HZ2 LYS A 233 -7.092 0.143 -4.312 1.00 0.00 H ATOM 1211 HZ3 LYS A 233 -5.922 1.248 -3.767 1.00 0.00 H ATOM 1212 H LYS A 233 -7.895 -6.796 -2.244 1.00 0.00 H ATOM 1213 N LEU A 234 -6.253 -4.351 0.309 1.00 7.29 N ATOM 1214 CA LEU A 234 -6.801 -3.404 1.274 1.00 8.04 C ATOM 1215 C LEU A 234 -6.113 -2.063 1.073 1.00 8.39 C ATOM 1216 O LEU A 234 -4.893 -1.961 1.235 1.00 9.41 O ATOM 1217 CB LEU A 234 -6.622 -3.901 2.706 1.00 8.76 C ATOM 1218 CG LEU A 234 -7.038 -2.855 3.739 1.00 10.16 C ATOM 1219 CD1 LEU A 234 -8.508 -2.451 3.638 1.00 10.66 C ATOM 1220 CD2 LEU A 234 -6.720 -3.378 5.128 1.00 13.15 C ATOM 1221 H LEU A 234 -5.249 -4.612 0.389 1.00 0.00 H ATOM 1222 N GLY A 235 -6.897 -1.041 0.728 1.00 7.66 N ATOM 1223 CA GLY A 235 -6.432 0.345 0.741 1.00 8.45 C ATOM 1224 C GLY A 235 -6.773 1.021 2.050 1.00 8.10 C ATOM 1225 O GLY A 235 -7.864 0.839 2.595 1.00 9.11 O ATOM 1226 H GLY A 235 -7.876 -1.237 0.439 1.00 0.00 H ATOM 1227 N ILE A 236 -5.838 1.817 2.564 1.00 8.59 N ATOM 1228 CA ILE A 236 -6.028 2.578 3.799 1.00 8.36 C ATOM 1229 C ILE A 236 -5.756 4.040 3.489 1.00 9.49 C ATOM 1230 O ILE A 236 -4.651 4.382 3.059 1.00 11.01 O ATOM 1231 CB ILE A 236 -5.128 2.082 4.936 1.00 9.65 C ATOM 1232 CG1 ILE A 236 -5.379 0.595 5.176 1.00 11.58 C ATOM 1233 CG2 ILE A 236 -5.387 2.876 6.220 1.00 11.71 C ATOM 1234 CD1 ILE A 236 -4.268 -0.071 5.897 1.00 16.54 C ATOM 1235 H ILE A 236 -4.930 1.902 2.064 1.00 0.00 H ATOM 1236 N SER A 237 -6.774 4.880 3.670 1.00 8.91 N ATOM 1237 CA SER A 237 -6.691 6.272 3.265 1.00 8.93 C ATOM 1238 C SER A 237 -7.306 7.183 4.317 1.00 9.15 C ATOM 1239 O SER A 237 -8.036 6.740 5.208 1.00 9.68 O ATOM 1240 CB SER A 237 -7.329 6.523 1.884 1.00 8.91 C ATOM 1241 OG SER A 237 -8.687 6.158 1.871 1.00 8.05 O ATOM 1242 HG SER A 237 -8.771 5.195 2.086 1.00 0.00 H ATOM 1243 H SER A 237 -7.648 4.531 4.112 1.00 0.00 H ATOM 1244 N GLY A 238 -6.991 8.477 4.180 1.00 10.93 N ATOM 1245 CA GLY A 238 -7.611 9.508 4.985 1.00 11.62 C ATOM 1246 C GLY A 238 -6.721 10.112 6.051 1.00 9.95 C ATOM 1247 O GLY A 238 -5.493 10.095 5.973 1.00 9.98 O ATOM 1248 H GLY A 238 -6.279 8.750 3.473 1.00 0.00 H ATOM 1249 N ASP A 239 -7.377 10.662 7.065 1.00 9.20 N ATOM 1250 CA ASP A 239 -6.746 11.636 7.950 1.00 9.60 C ATOM 1251 C ASP A 239 -6.161 10.958 9.186 1.00 10.07 C ATOM 1252 O ASP A 239 -6.565 11.193 10.336 1.00 10.90 O ATOM 1253 CB ASP A 239 -7.754 12.726 8.297 1.00 10.60 C ATOM 1254 CG ASP A 239 -8.290 13.435 7.060 1.00 12.22 C ATOM 1255 OD1 ASP A 239 -7.567 13.541 6.036 1.00 15.72 O ATOM 1256 OD2 ASP A 239 -9.473 13.841 7.127 1.00 12.20 O ATOM 1257 H ASP A 239 -8.367 10.392 7.234 1.00 0.00 H ATOM 1258 N ILE A 240 -5.164 10.099 8.912 1.00 10.83 N ATOM 1259 CA ILE A 240 -4.477 9.344 9.948 1.00 10.05 C ATOM 1260 C ILE A 240 -2.968 9.408 9.764 1.00 9.97 C ATOM 1261 O ILE A 240 -2.462 9.622 8.657 1.00 11.21 O ATOM 1262 CB ILE A 240 -4.922 7.867 9.987 1.00 10.11 C ATOM 1263 CG1 ILE A 240 -4.596 7.187 8.670 1.00 11.79 C ATOM 1264 CG2 ILE A 240 -6.388 7.831 10.242 1.00 11.29 C ATOM 1265 CD1 ILE A 240 -4.820 5.674 8.733 1.00 12.37 C ATOM 1266 H ILE A 240 -4.873 9.969 7.922 1.00 0.00 H ATOM 1267 N ASP A 241 -2.265 9.181 10.859 1.00 10.05 N ATOM 1268 CA ASP A 241 -0.896 8.701 10.835 1.00 11.15 C ATOM 1269 C ASP A 241 -0.985 7.188 10.978 1.00 11.39 C ATOM 1270 O ASP A 241 -1.550 6.687 11.960 1.00 14.04 O ATOM 1271 CB ASP A 241 -0.109 9.307 11.993 1.00 15.23 C ATOM 1272 CG ASP A 241 0.039 10.815 11.881 1.00 19.62 C ATOM 1273 OD1 ASP A 241 0.197 11.354 10.758 1.00 21.67 O ATOM 1274 OD2 ASP A 241 0.022 11.471 12.948 1.00 22.96 O ATOM 1275 H ASP A 241 -2.714 9.354 11.781 1.00 0.00 H ATOM 1276 N LEU A 242 -0.469 6.467 10.001 1.00 9.13 N ATOM 1277 CA LEU A 242 -0.596 5.021 9.976 1.00 10.13 C ATOM 1278 C LEU A 242 0.673 4.374 10.497 1.00 11.40 C ATOM 1279 O LEU A 242 1.771 4.645 9.993 1.00 12.74 O ATOM 1280 CB LEU A 242 -0.862 4.595 8.545 1.00 10.12 C ATOM 1281 CG LEU A 242 -1.012 3.113 8.263 1.00 10.25 C ATOM 1282 CD1 LEU A 242 -2.199 2.501 9.013 1.00 9.89 C ATOM 1283 CD2 LEU A 242 -1.162 2.848 6.761 1.00 11.09 C ATOM 1284 H LEU A 242 0.041 6.946 9.231 1.00 0.00 H ATOM 1285 N THR A 243 0.522 3.566 11.532 1.00 10.40 N ATOM 1286 CA THR A 243 1.637 2.919 12.200 1.00 11.03 C ATOM 1287 C THR A 243 1.886 1.513 11.674 1.00 11.00 C ATOM 1288 O THR A 243 3.043 1.176 11.403 1.00 14.00 O ATOM 1289 CB THR A 243 1.366 2.882 13.709 1.00 14.91 C ATOM 1290 OG1 THR A 243 1.240 4.228 14.198 1.00 17.73 O ATOM 1291 CG2 THR A 243 2.458 2.141 14.444 1.00 18.09 C ATOM 1292 HG1 THR A 243 1.065 4.209 15.172 1.00 0.00 H ATOM 1293 H THR A 243 -0.440 3.385 11.884 1.00 0.00 H ATOM 1294 N SER A 244 0.838 0.709 11.457 1.00 10.89 N ATOM 1295 CA SER A 244 1.022 -0.655 10.985 1.00 12.86 C ATOM 1296 C SER A 244 -0.253 -1.152 10.328 1.00 10.86 C ATOM 1297 O SER A 244 -1.348 -0.736 10.698 1.00 10.79 O ATOM 1298 CB SER A 244 1.489 -1.620 12.077 1.00 16.42 C ATOM 1299 OG SER A 244 0.592 -1.738 13.129 1.00 16.96 O ATOM 1300 HG SER A 244 -0.274 -2.073 12.786 1.00 0.00 H ATOM 1301 H SER A 244 -0.124 1.065 11.629 1.00 0.00 H ATOM 1302 N ALA A 245 -0.093 -2.069 9.371 1.00 10.60 N ATOM 1303 CA ALA A 245 -1.204 -2.712 8.681 1.00 10.65 C ATOM 1304 C ALA A 245 -0.726 -4.126 8.395 1.00 11.46 C ATOM 1305 O ALA A 245 0.288 -4.320 7.707 1.00 13.38 O ATOM 1306 CB ALA A 245 -1.530 -1.990 7.371 1.00 12.35 C ATOM 1307 H ALA A 245 0.875 -2.339 9.104 1.00 0.00 H ATOM 1308 N SER A 246 -1.437 -5.107 8.915 1.00 10.93 N ATOM 1309 CA SER A 246 -0.968 -6.472 8.770 1.00 11.71 C ATOM 1310 C SER A 246 -2.151 -7.416 8.866 1.00 10.14 C ATOM 1311 O SER A 246 -3.267 -7.002 9.169 1.00 10.38 O ATOM 1312 CB SER A 246 0.044 -6.824 9.848 1.00 14.18 C ATOM 1313 OG SER A 246 -0.524 -6.717 11.131 1.00 16.55 O ATOM 1314 HG SER A 246 -0.833 -5.788 11.277 1.00 0.00 H ATOM 1315 H SER A 246 -2.322 -4.905 9.422 1.00 0.00 H ATOM 1316 N TYR A 247 -1.896 -8.700 8.609 1.00 10.44 N ATOM 1317 CA TYR A 247 -2.927 -9.728 8.727 1.00 10.26 C ATOM 1318 C TYR A 247 -2.318 -11.009 9.295 1.00 10.15 C ATOM 1319 O TYR A 247 -1.106 -11.248 9.223 1.00 11.52 O ATOM 1320 CB TYR A 247 -3.604 -10.023 7.377 1.00 11.90 C ATOM 1321 CG TYR A 247 -2.635 -10.247 6.260 1.00 11.00 C ATOM 1322 CD1 TYR A 247 -1.932 -11.438 6.129 1.00 11.35 C ATOM 1323 CD2 TYR A 247 -2.422 -9.275 5.319 1.00 10.45 C ATOM 1324 CE1 TYR A 247 -1.056 -11.623 5.104 1.00 11.64 C ATOM 1325 CE2 TYR A 247 -1.527 -9.462 4.296 1.00 12.37 C ATOM 1326 CZ TYR A 247 -0.840 -10.644 4.185 1.00 11.41 C ATOM 1327 OH TYR A 247 0.065 -10.805 3.162 1.00 14.00 O ATOM 1328 HH TYR A 247 0.772 -10.116 3.237 1.00 0.00 H ATOM 1329 H TYR A 247 -0.937 -8.977 8.317 1.00 0.00 H ATOM 1330 N THR A 248 -3.189 -11.845 9.846 1.00 11.30 N ATOM 1331 CA THR A 248 -2.805 -13.137 10.389 1.00 11.77 C ATOM 1332 C THR A 248 -4.044 -14.019 10.421 1.00 12.15 C ATOM 1333 O THR A 248 -5.171 -13.535 10.302 1.00 13.72 O ATOM 1334 CB THR A 248 -2.204 -12.956 11.786 1.00 13.34 C ATOM 1335 OG1 THR A 248 -1.421 -14.110 12.114 1.00 15.60 O ATOM 1336 CG2 THR A 248 -3.309 -12.637 12.868 1.00 13.89 C ATOM 1337 HG1 THR A 248 -1.031 -13.997 13.017 1.00 0.00 H ATOM 1338 H THR A 248 -4.189 -11.563 9.891 1.00 0.00 H ATOM 1339 N MET A 249 -3.836 -15.322 10.539 1.00 12.96 N ATOM 1340 CA MET A 249 -4.943 -16.256 10.667 1.00 14.25 C ATOM 1341 C MET A 249 -5.166 -16.596 12.135 1.00 14.94 C ATOM 1342 O MET A 249 -4.216 -16.887 12.866 1.00 16.83 O ATOM 1343 CB MET A 249 -4.667 -17.554 9.902 1.00 14.68 C ATOM 1344 CG MET A 249 -4.425 -17.377 8.422 1.00 15.35 C ATOM 1345 SD MET A 249 -5.785 -16.560 7.557 1.00 16.14 S ATOM 1346 CE MET A 249 -7.126 -17.690 7.913 1.00 16.41 C ATOM 1347 H MET A 249 -2.861 -15.684 10.540 1.00 0.00 H ATOM 1348 N ILE A 250 -6.418 -16.614 12.551 1.00 13.81 N ATOM 1349 CA ILE A 250 -6.755 -17.029 13.907 1.00 16.50 C ATOM 1350 C ILE A 250 -7.646 -18.264 13.851 1.00 18.85 C ATOM 1351 O ILE A 250 -7.899 -18.798 12.765 1.00 20.77 O ATOM 1352 CB ILE A 250 -7.379 -15.899 14.710 1.00 16.41 C ATOM 1353 CG1 ILE A 250 -8.692 -15.456 14.106 1.00 18.69 C ATOM 1354 CG2 ILE A 250 -6.420 -14.719 14.780 1.00 17.39 C ATOM 1355 CD1 ILE A 250 -9.448 -14.530 15.030 1.00 20.40 C ATOM 1356 OXT ILE A 250 -8.078 -18.791 14.886 1.00 21.97 O ATOM 1357 H ILE A 250 -7.177 -16.327 11.900 1.00 0.00 H TER 1358 ILE A 250 HETATM 1359 O HOH 1 -10.150 3.943 -5.034 1.00 35.11 O HETATM 1360 O HOH 2 -17.341 12.313 -1.388 1.00 33.15 O HETATM 1361 O HOH 3 -22.814 9.397 1.155 1.00 19.93 O HETATM 1362 O HOH 4 -0.937 -4.114 12.300 1.00 16.27 O HETATM 1363 O HOH 5 -14.905 11.645 1.071 1.00 38.02 O HETATM 1364 O HOH 6 -29.094 0.803 4.653 1.00 29.62 O HETATM 1365 O HOH 7 -9.964 -3.664 17.812 1.00 12.73 O HETATM 1366 O HOH 8 1.241 7.856 8.188 1.00 20.32 O HETATM 1367 O HOH 9 -12.953 -16.861 -7.877 1.00 29.82 O HETATM 1368 O HOH 10 -8.724 3.465 1.308 1.00 11.69 O HETATM 1369 O HOH 11 -24.705 12.803 9.248 1.00 19.69 O HETATM 1370 O HOH 12 -11.902 5.391 -0.686 1.00 30.43 O HETATM 1371 O HOH 13 -13.217 13.633 17.158 1.00 30.30 O HETATM 1372 O HOH 14 -12.501 16.004 13.698 1.00 25.15 O HETATM 1373 O HOH 15 -23.856 -5.823 3.050 1.00 11.57 O HETATM 1374 O HOH 16 -22.804 -2.620 8.229 1.00 17.31 O HETATM 1375 O HOH 17 -21.959 1.038 8.822 1.00 29.89 O HETATM 1376 O HOH 18 -0.484 10.503 7.034 1.00 31.39 O HETATM 1377 O HOH 19 -3.994 -9.099 12.397 1.00 14.46 O HETATM 1378 O HOH 20 -8.489 12.757 3.602 1.00 33.54 O HETATM 1379 O HOH 21 -18.537 -5.990 -11.166 1.00 18.50 O HETATM 1380 O HOH 22 -10.904 6.766 21.141 1.00 20.32 O HETATM 1381 O HOH 23 -24.581 -6.072 6.525 1.00 13.62 O HETATM 1382 O HOH 24 -10.754 -17.451 -0.039 1.00 28.22 O HETATM 1383 O HOH 25 -3.381 11.484 4.946 1.00 32.75 O HETATM 1384 O HOH 26 -17.295 -11.833 18.051 1.00 25.41 O HETATM 1385 O HOH 27 -17.104 -7.472 -7.313 1.00 10.46 O HETATM 1386 O HOH 28 -12.263 1.214 -6.886 1.00 27.88 O HETATM 1387 O HOH 29 -22.141 -18.825 6.507 1.00 22.37 O HETATM 1388 O HOH 30 0.753 -8.321 1.833 1.00 20.41 O HETATM 1389 O HOH 31 -1.295 -9.142 12.195 1.00 16.97 O HETATM 1390 O HOH 32 -2.438 -4.708 -3.824 1.00 25.28 O HETATM 1391 O HOH 33 -15.423 -2.081 -11.771 1.00 12.34 O HETATM 1392 O HOH 34 -9.173 5.777 19.348 1.00 11.43 O HETATM 1393 O HOH 35 -18.948 -7.371 0.013 1.00 7.49 O HETATM 1394 O HOH 36 -7.365 6.971 -1.488 1.00 21.31 O HETATM 1395 O HOH 37 -19.020 -3.227 21.598 1.00 32.85 O HETATM 1396 O HOH 38 -16.419 -0.484 -8.993 1.00 11.86 O HETATM 1397 O HOH 39 -0.413 5.116 16.287 1.00 25.99 O HETATM 1398 O HOH 40 -16.741 13.914 7.441 1.00 14.16 O HETATM 1399 O HOH 41 -3.748 14.357 20.200 1.00 11.44 O HETATM 1400 O HOH 42 -17.245 -9.385 0.630 1.00 8.09 O HETATM 1401 O HOH 43 -21.913 -8.347 -5.708 1.00 19.69 O HETATM 1402 O HOH 44 -10.730 14.225 20.306 1.00 25.26 O HETATM 1403 O HOH 45 -25.591 -14.301 8.491 1.00 27.07 O HETATM 1404 O HOH 46 -2.870 -8.994 -4.213 1.00 19.98 O HETATM 1405 O HOH 47 -23.374 -1.390 -10.390 1.00 31.80 O HETATM 1406 O HOH 48 -12.956 3.884 21.212 1.00 15.90 O HETATM 1407 O HOH 49 -8.178 -6.959 -5.889 1.00 12.81 O HETATM 1408 O HOH 50 -8.028 0.944 -6.687 1.00 36.40 O HETATM 1409 O HOH 51 -28.011 2.084 7.420 1.00 21.19 O HETATM 1410 O HOH 52 -16.541 -6.508 21.791 1.00 23.43 O HETATM 1411 O HOH 53 -24.350 9.996 13.223 1.00 23.72 O HETATM 1412 O HOH 54 -13.679 5.081 -4.818 1.00 32.78 O HETATM 1413 O HOH 55 -3.597 0.360 -6.115 1.00 32.84 O HETATM 1414 O HOH 56 -22.182 12.715 16.070 1.00 23.50 O HETATM 1415 O HOH 57 -24.655 -9.047 -3.144 1.00 25.69 O HETATM 1416 O HOH 58 -18.542 -18.355 3.481 1.00 12.83 O HETATM 1417 O HOH 59 -23.087 -6.309 14.623 1.00 22.15 O HETATM 1418 O HOH 60 -4.737 13.967 5.888 1.00 32.52 O HETATM 1419 O HOH 61 -18.274 -0.103 19.447 1.00 29.53 O HETATM 1420 O HOH 62 -26.706 -2.006 -2.989 1.00 20.30 O HETATM 1421 O HOH 63 -9.369 7.455 17.262 1.00 10.02 O HETATM 1422 O HOH 64 -13.212 3.903 -2.610 1.00 29.75 O HETATM 1423 O HOH 65 -5.386 9.520 1.998 1.00 20.06 O HETATM 1424 O HOH 66 -26.937 6.681 11.165 1.00 29.95 O HETATM 1425 O HOH 67 -26.674 17.884 13.455 1.00 36.57 O HETATM 1426 O HOH 68 -28.658 4.035 3.135 1.00 25.32 O HETATM 1427 O HOH 69 -22.774 -1.664 -5.304 1.00 16.85 O HETATM 1428 O HOH 70 -17.017 -11.818 -12.304 1.00 33.31 O HETATM 1429 O HOH 71 -21.893 5.862 -7.450 1.00 24.26 O HETATM 1430 O HOH 72 -2.167 2.957 17.313 1.00 18.72 O HETATM 1431 O HOH 73 -20.441 -15.804 9.429 1.00 26.72 O HETATM 1432 O HOH 74 -22.728 13.242 2.868 1.00 36.58 O HETATM 1433 O HOH 75 5.364 2.992 11.513 1.00 28.68 O HETATM 1434 O HOH 76 4.885 3.038 3.621 1.00 17.10 O HETATM 1435 O HOH 77 -23.605 -4.320 12.466 1.00 19.64 O HETATM 1436 O HOH 78 -26.431 8.613 9.300 1.00 21.41 O HETATM 1437 O HOH 79 -15.739 -7.781 16.530 1.00 21.09 O HETATM 1438 O HOH 80 2.803 -2.662 8.886 1.00 25.04 O HETATM 1439 O HOH 81 4.737 -0.981 10.193 1.00 31.42 O HETATM 1440 O HOH 82 -27.688 6.395 2.587 1.00 32.14 O HETATM 1441 O HOH 83 -3.131 10.966 2.439 1.00 31.95 O HETATM 1442 O HOH 84 -27.522 4.748 0.218 1.00 30.74 O HETATM 1443 O HOH 85 -13.666 -8.110 14.816 1.00 15.50 O HETATM 1444 O HOH 86 1.111 10.254 15.482 1.00 33.16 O HETATM 1445 O HOH 87 -10.904 -20.931 6.817 1.00 32.16 O HETATM 1446 O HOH 88 1.454 1.589 -0.370 1.00 23.93 O HETATM 1447 O HOH 89 -20.838 6.863 19.668 1.00 30.39 O HETATM 1448 O HOH 90 -15.895 0.190 18.921 1.00 21.29 O HETATM 1449 O HOH 91 -24.017 -3.146 -3.464 1.00 15.13 O HETATM 1450 O HOH 92 -0.405 8.282 19.458 1.00 24.72 O HETATM 1451 O HOH 93 0.891 -9.408 7.436 1.00 30.34 O HETATM 1452 O HOH 94 -15.887 7.264 -5.299 1.00 36.52 O HETATM 1453 O HOH 95 -4.154 -6.772 18.803 1.00 20.09 O HETATM 1454 O HOH 96 -16.048 10.496 2.970 1.00 28.40 O HETATM 1455 O HOH 97 2.918 -0.972 0.454 1.00 30.39 O HETATM 1456 O HOH 98 -25.721 -7.716 1.985 1.00 31.06 O HETATM 1457 O HOH 99 -26.747 -2.808 8.598 1.00 40.63 O HETATM 1458 O HOH 100 -19.021 -12.086 -9.960 1.00 17.81 O HETATM 1459 O HOH 101 -14.565 1.458 20.839 1.00 30.75 O HETATM 1460 O HOH 102 -24.994 -6.736 9.233 1.00 36.10 O HETATM 1461 O HOH 103 -13.202 -22.724 10.787 1.00 33.33 O HETATM 1462 O HOH 104 2.728 6.883 12.132 1.00 25.44 O HETATM 1463 O HOH 105 -22.006 -2.111 18.330 1.00 36.75 O HETATM 1464 O HOH 106 -18.766 -11.770 -6.592 1.00 9.63 O HETATM 1465 O HOH 107 -30.570 -1.090 4.234 1.00 36.74 O HETATM 1466 O HOH 108 3.190 -11.399 2.203 1.00 34.07 O HETATM 1467 O HOH 109 -24.228 -0.951 -7.421 1.00 33.25 O HETATM 1468 O HOH 110 -11.433 -8.611 15.959 1.00 28.83 O HETATM 1469 O HOH 111 -18.768 13.826 5.218 1.00 32.06 O HETATM 1470 O HOH 112 -16.979 -17.889 -11.221 1.00 34.97 O HETATM 1471 O HOH 113 -17.802 5.048 21.261 1.00 34.88 O HETATM 1472 O HOH 114 -28.468 4.258 5.742 1.00 36.60 O HETATM 1473 O HOH 115 -9.662 6.403 -2.703 1.00 27.94 O HETATM 1474 O HOH 116 -6.550 16.229 8.911 1.00 30.96 O HETATM 1475 O HOH 117 -26.992 -6.688 5.261 1.00 30.70 O HETATM 1476 O HOH 118 -19.620 -8.821 -7.209 1.00 14.04 O HETATM 1477 O HOH 119 -0.549 -5.942 15.027 1.00 33.28 O HETATM 1478 O HOH 120 -23.435 -0.699 10.032 1.00 30.39 O HETATM 1479 O HOH 121 -25.476 6.723 -2.255 1.00 35.01 O HETATM 1480 O HOH 122 -15.584 6.874 22.489 1.00 34.36 O HETATM 1481 O HOH 123 -15.163 -19.661 10.396 1.00 36.06 O HETATM 1482 O HOH 124 -5.499 6.351 -3.458 1.00 33.10 O HETATM 1483 O HOH 125 -25.496 10.800 10.923 1.00 19.97 O HETATM 1484 O HOH 126 -6.514 9.595 -0.301 1.00 31.38 O HETATM 1485 O HOH 127 -20.288 -8.048 -9.882 1.00 30.57 O HETATM 1486 O HOH 128 -20.127 -13.935 -7.202 1.00 19.93 O HETATM 1487 O HOH 129 -24.811 -5.712 -4.215 1.00 28.50 O HETATM 1488 O HOH 130 -16.034 -19.270 2.871 1.00 30.34 O HETATM 1489 C20 J A 5 -12.556 8.573 0.449 1.00 0.01 C HETATM 1490 C21 J A 5 -11.280 8.775 -0.094 1.00 -0.06 C HETATM 1491 C22 J A 5 -10.150 9.123 0.625 1.00 -0.07 C HETATM 1492 C23 J A 5 -10.239 9.224 1.990 1.00 -0.07 C HETATM 1493 C24 J A 5 -11.463 9.022 2.562 1.00 -0.03 C HETATM 1494 C25 J A 5 -12.571 8.682 1.784 1.00 0.14 C HETATM 1495 F30 J A 5 -13.682 8.478 2.458 1.00 -0.19 F HETATM 1496 H3 J A 5 -11.575 9.127 3.635 1.00 0.06 H HETATM 1497 H19 J A 5 -9.369 9.456 2.594 1.00 0.06 H HETATM 1498 H2 J A 5 -9.211 9.312 0.118 1.00 0.06 H HETATM 1499 H1 J A 5 -11.169 8.648 -1.165 1.00 0.06 H HETATM 1500 C19 J A 5 -13.723 8.208 -0.324 1.00 0.07 C HETATM 1501 C18 J A 5 -15.097 8.318 -0.059 1.00 0.09 C HETATM 1502 N17 J A 5 -15.781 7.825 -1.157 1.00 -0.16 N HETATM 1503 C16 J A 5 -17.138 7.712 -1.360 1.00 0.15 C HETATM 1504 C28 J A 5 -17.961 9.065 -1.252 1.00 0.13 C HETATM 1505 C09 J A 5 -19.398 8.747 -1.645 1.00 0.15 C HETATM 1506 O10 J A 5 -19.976 7.744 -0.763 1.00 -0.35 O HETATM 1507 C11 J A 5 -19.301 6.426 -0.718 1.00 0.11 C HETATM 1508 C12 J A 5 -20.063 5.565 0.324 1.00 0.07 C HETATM 1509 O13 J A 5 -21.384 5.297 -0.230 1.00 -0.39 O HETATM 1510 H20 J A 5 -21.835 6.119 -0.382 1.00 0.21 H HETATM 1511 H14 J A 5 -20.155 6.114 1.273 1.00 0.06 H HETATM 1512 H15 J A 5 -19.527 4.620 0.498 1.00 0.06 H HETATM 1513 C14 J A 5 -17.811 6.593 -0.345 1.00 0.12 C HETATM 1514 O15 J A 5 -17.728 7.055 0.895 1.00 -0.39 O HETATM 1515 H21 J A 5 -16.815 7.193 1.120 1.00 0.21 H HETATM 1516 H16 J A 5 -17.285 5.630 -0.431 1.00 0.07 H HETATM 1517 H13 J A 5 -19.364 5.945 -1.705 1.00 0.06 H HETATM 1518 S08 J A 5 -20.375 10.161 -1.651 1.00 -0.07 S HETATM 1519 C07 J A 5 -21.676 9.863 -2.855 1.00 0.01 C HETATM 1520 C04 J A 5 -22.135 8.562 -3.176 1.00 -0.06 C HETATM 1521 C03 J A 5 -23.099 8.326 -4.135 1.00 -0.07 C HETATM 1522 C02 J A 5 -23.635 9.343 -4.886 1.00 -0.05 C HETATM 1523 C01 J A 5 -24.667 9.054 -5.824 1.00 -0.03 C HETATM 1524 H5 J A 5 -24.827 7.967 -5.870 1.00 0.04 H HETATM 1525 H6 J A 5 -24.373 9.424 -6.818 1.00 0.04 H HETATM 1526 H7 J A 5 -25.598 9.548 -5.509 1.00 0.04 H HETATM 1527 C05 J A 5 -23.177 10.649 -4.582 1.00 -0.07 C HETATM 1528 C06 J A 5 -22.193 10.906 -3.607 1.00 -0.06 C HETATM 1529 H11 J A 5 -21.841 11.918 -3.445 1.00 0.05 H HETATM 1530 H10 J A 5 -23.602 11.487 -5.123 1.00 0.05 H HETATM 1531 H8 J A 5 -23.442 7.311 -4.300 1.00 0.05 H HETATM 1532 H9 J A 5 -21.711 7.716 -2.646 1.00 0.05 H HETATM 1533 H12 J A 5 -19.385 8.337 -2.666 1.00 0.08 H HETATM 1534 O29 J A 5 -17.468 9.903 -2.252 1.00 -0.38 O HETATM 1535 H22 J A 5 -17.933 10.731 -2.227 1.00 0.21 H HETATM 1536 H4 J A 5 -17.891 9.517 -0.252 1.00 0.07 H HETATM 1537 H17 J A 5 -17.265 7.345 -2.389 1.00 0.07 H HETATM 1538 N27 J A 5 -14.839 7.432 -2.050 1.00 -0.09 N HETATM 1539 N26 J A 5 -13.689 7.647 -1.603 1.00 -0.22 N HETATM 1540 H18 J A 5 -15.545 8.720 0.849 1.00 0.11 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 1489 1490 1494 1500 CONECT 1490 1489 1491 1499 CONECT 1491 1490 1492 1498 CONECT 1492 1491 1493 1497 CONECT 1493 1492 1494 1496 CONECT 1494 1489 1493 1495 CONECT 1495 1494 CONECT 1496 1493 CONECT 1497 1492 CONECT 1498 1491 CONECT 1499 1490 CONECT 1500 1489 1501 1539 CONECT 1501 1500 1502 1540 CONECT 1502 1501 1503 1538 CONECT 1503 1502 1504 1513 1537 CONECT 1504 1503 1505 1534 1536 CONECT 1505 1504 1506 1518 1533 CONECT 1506 1505 1507 CONECT 1507 1506 1508 1513 1517 CONECT 1508 1507 1509 1511 1512 CONECT 1509 1508 1510 CONECT 1510 1509 CONECT 1511 1508 CONECT 1512 1508 CONECT 1513 1503 1507 1514 1516 CONECT 1514 1513 1515 CONECT 1515 1514 CONECT 1516 1513 CONECT 1517 1507 CONECT 1518 1505 1519 CONECT 1519 1518 1520 1528 CONECT 1520 1519 1521 1532 CONECT 1521 1520 1522 1531 CONECT 1522 1521 1523 1527 CONECT 1523 1522 1524 1525 1526 CONECT 1524 1523 CONECT 1525 1523 CONECT 1526 1523 CONECT 1527 1522 1528 1530 CONECT 1528 1519 1527 1529 CONECT 1529 1528 CONECT 1530 1527 CONECT 1531 1521 CONECT 1532 1520 CONECT 1533 1505 CONECT 1534 1504 1535 CONECT 1535 1534 CONECT 1536 1504 CONECT 1537 1503 CONECT 1538 1502 1539 CONECT 1539 1500 1538 CONECT 1540 1501 MASTER 0 0 0 0 0 0 0 0 1539 1 56 11 END
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Related entries of code: 6qlt
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
1kjr
RCSB PDB
PDBbind
146aa, >1KJR_1|Chain... at 99%
2nn8
RCSB PDB
PDBbind
138aa, >2NN8_1|Chain... at 100%
2xg3
RCSB PDB
PDBbind
138aa, >2XG3_1|Chain... at 99%
3aya
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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%
6eog
RCSB PDB
PDBbind
138aa, >6EOG_1|Chain... at 99%
6eol
RCSB PDB
PDBbind
138aa, >6EOL_1|Chain... at 99%
6g0v
RCSB PDB
PDBbind
138aa, >6G0V_1|Chain... at 99%
6qlu
RCSB PDB
PDBbind
138aa, >6QLU_1|Chain... at 100%
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
6qlt
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
Galectin-3C
Ligand Name
J5W
EC.Number
E.C.-.-.-.-
Resolution
1.15(Å)
Affinity (Kd/Ki/IC50)
Kd=92uM
Release Year
2019
Protein/NA Sequence
Check fasta file
Primary Reference
(2019) Chemmedchem Vol. 14: pp. 1528-1536
Ligand Properties
Formula
C
2
1
H
2
2
FN
3
O
4
S
Molecular Weight
431.480
Exact Mass
431.132
No. of atoms
52
No. of bonds
55
Polar Surface Area
125.93
LOGP Value
2.48 (
Computed with XLOGP3
)
2.17 (
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](Sc2ccc(cc2)C)[C@@H]([C@H]([C@H]1O)n1nnc(c1)c1ccccc1F)O
InChI String
InChI=1S/C21H22FN3O4S/c1-12-6-8-13(9-7-12)30-21-20(28)18(19(27)17(11-26)29-21)25-10-16(23-24-25)14-4-2-3-5-15(14)22/h2-10,17-21,26-28H,11H2,1H3/t17-,18+,19+,20-,21+/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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