Browse entries in the PDBbind-CN Database
HEADER 5GGJ_COMPLEX COMPND 5GGJ_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 153 ARG VAL LEU ASP VAL GLU VAL TYR SER SER ARG SER LYS SEQRES 2 A 153 VAL TYR VAL ALA VAL ASP GLY THR THR VAL LEU GLU ASP SEQRES 3 A 153 GLU ALA ARG GLU GLN GLY ARG GLY ILE HIS VAL ILE VAL SEQRES 4 A 153 LEU ASN GLN ALA THR GLY HIS VAL MET ALA LYS ARG VAL SEQRES 5 A 153 PHE ASP THR TYR SER PRO HIS GLU ASP GLU ALA MET VAL SEQRES 6 A 153 LEU PHE LEU ASN MET VAL ALA PRO GLY ARG VAL LEU ILE SEQRES 7 A 153 CYS THR VAL LYS ASP GLU GLY SER PHE HIS LEU LYS ASP SEQRES 8 A 153 THR ALA LYS ALA LEU LEU ARG SER LEU GLY SER GLN ALA SEQRES 9 A 153 GLY PRO ALA LEU GLY TRP ARG ASP THR TRP ALA PHE VAL SEQRES 10 A 153 GLY ARG LYS GLY GLY PRO VAL PHE GLY GLU LYS HIS SER SEQRES 11 A 153 LYS SER PRO ALA LEU SER SER TRP GLY ASP PRO VAL LEU SEQRES 12 A 153 LEU LYS THR ASP VAL PRO LEU SER SER ALA HET PNA A 378 36 ATOM 1 N ARG A 97 8.180 25.703 19.305 1.00 46.55 N ATOM 2 CA ARG A 97 8.929 25.004 20.352 1.00 30.39 C ATOM 3 C ARG A 97 8.856 23.493 20.157 1.00 23.12 C ATOM 4 O ARG A 97 9.127 22.711 21.072 1.00 23.45 O ATOM 5 CB ARG A 97 8.379 25.375 21.731 1.00 40.62 C ATOM 6 HN3 ARG A 97 7.183 25.409 19.338 1.00 0.00 H ATOM 7 HN2 ARG A 97 8.582 25.465 18.376 1.00 0.00 H ATOM 8 HN1 ARG A 97 8.245 26.729 19.460 1.00 0.00 H ATOM 9 N VAL A 98 8.515 23.072 18.943 1.00 22.52 N ATOM 10 CA VAL A 98 8.229 21.672 18.675 1.00 21.67 C ATOM 11 C VAL A 98 8.478 21.414 17.202 1.00 20.85 C ATOM 12 O VAL A 98 8.299 22.303 16.368 1.00 22.89 O ATOM 13 CB VAL A 98 6.781 21.340 19.134 1.00 31.85 C ATOM 14 CG1 VAL A 98 5.757 22.157 18.352 1.00 34.51 C ATOM 15 CG2 VAL A 98 6.490 19.874 19.014 1.00 25.96 C ATOM 16 H VAL A 98 8.451 23.761 18.166 1.00 0.00 H ATOM 17 N LEU A 99 8.962 20.216 16.911 1.00 19.71 N ATOM 18 CA LEU A 99 9.127 19.734 15.544 1.00 19.00 C ATOM 19 C LEU A 99 8.079 18.668 15.299 1.00 24.63 C ATOM 20 O LEU A 99 7.900 17.772 16.121 1.00 24.13 O ATOM 21 CB LEU A 99 10.484 19.051 15.337 1.00 20.17 C ATOM 22 CG LEU A 99 11.761 19.874 15.355 1.00 22.38 C ATOM 23 CD1 LEU A 99 12.945 18.926 15.229 1.00 28.14 C ATOM 24 CD2 LEU A 99 11.776 20.846 14.198 1.00 24.37 C ATOM 25 H LEU A 99 9.237 19.589 17.694 1.00 0.00 H ATOM 26 N ASP A 100 7.419 18.749 14.159 1.00 19.49 N ATOM 27 CA ASP A 100 6.494 17.717 13.707 1.00 19.70 C ATOM 28 C ASP A 100 7.278 16.730 12.848 1.00 19.78 C ATOM 29 O ASP A 100 7.649 17.055 11.716 1.00 21.79 O ATOM 30 CB ASP A 100 5.441 18.422 12.860 1.00 21.06 C ATOM 31 CG ASP A 100 4.457 17.482 12.216 1.00 36.17 C ATOM 32 OD1 ASP A 100 4.321 16.328 12.675 1.00 35.89 O ATOM 33 OD2 ASP A 100 3.806 17.926 11.236 1.00 48.66 O ATOM 34 H ASP A 100 7.565 19.585 13.557 1.00 0.00 H ATOM 35 N VAL A 101 7.515 15.521 13.365 1.00 17.78 N ATOM 36 CA VAL A 101 8.388 14.532 12.729 1.00 16.65 C ATOM 37 C VAL A 101 7.555 13.337 12.276 1.00 18.20 C ATOM 38 O VAL A 101 6.763 12.783 13.053 1.00 19.44 O ATOM 39 CB VAL A 101 9.517 14.083 13.681 1.00 17.57 C ATOM 40 CG1 VAL A 101 10.355 12.994 13.037 1.00 19.22 C ATOM 41 CG2 VAL A 101 10.399 15.292 14.073 1.00 19.07 C ATOM 42 H VAL A 101 7.057 15.270 14.264 1.00 0.00 H ATOM 43 N GLU A 102 7.716 12.941 11.014 1.00 16.64 N ATOM 44 CA GLU A 102 7.026 11.774 10.489 1.00 16.95 C ATOM 45 C GLU A 102 8.080 10.804 9.987 1.00 17.67 C ATOM 46 O GLU A 102 8.997 11.210 9.263 1.00 19.54 O ATOM 47 CB GLU A 102 6.102 12.202 9.340 1.00 20.38 C ATOM 48 CG GLU A 102 5.094 11.173 8.883 1.00 34.55 C ATOM 49 CD GLU A 102 4.024 11.780 7.965 1.00 32.74 C ATOM 50 OE1 GLU A 102 3.456 12.839 8.333 1.00 41.02 O ATOM 51 OE2 GLU A 102 3.761 11.203 6.886 1.00 43.30 O ATOM 52 H GLU A 102 8.350 13.479 10.390 1.00 0.00 H ATOM 53 N VAL A 103 7.951 9.528 10.360 1.00 15.62 N ATOM 54 CA VAL A 103 8.937 8.502 10.023 1.00 14.66 C ATOM 55 C VAL A 103 8.201 7.279 9.492 1.00 17.12 C ATOM 56 O VAL A 103 7.268 6.777 10.134 1.00 18.46 O ATOM 57 CB VAL A 103 9.806 8.110 11.234 1.00 18.43 C ATOM 58 CG1 VAL A 103 10.914 7.147 10.782 1.00 19.24 C ATOM 59 CG2 VAL A 103 10.412 9.345 11.902 1.00 18.04 C ATOM 60 H VAL A 103 7.114 9.253 10.913 1.00 0.00 H ATOM 61 N TYR A 104 8.615 6.791 8.325 1.00 15.14 N ATOM 62 CA TYR A 104 7.952 5.661 7.694 1.00 15.57 C ATOM 63 C TYR A 104 8.977 4.561 7.448 1.00 14.88 C ATOM 64 O TYR A 104 10.057 4.829 6.919 1.00 17.18 O ATOM 65 CB TYR A 104 7.333 6.116 6.364 1.00 16.52 C ATOM 66 CG TYR A 104 6.472 5.103 5.655 1.00 18.89 C ATOM 67 CD1 TYR A 104 5.145 4.936 6.002 1.00 25.14 C ATOM 68 CD2 TYR A 104 6.981 4.345 4.607 1.00 25.45 C ATOM 69 CE1 TYR A 104 4.349 4.018 5.344 1.00 30.54 C ATOM 70 CE2 TYR A 104 6.198 3.424 3.955 1.00 21.19 C ATOM 71 CZ TYR A 104 4.885 3.267 4.321 1.00 22.87 C ATOM 72 OH TYR A 104 4.090 2.349 3.662 1.00 27.25 O ATOM 73 HH TYR A 104 3.179 2.365 4.049 1.00 0.00 H ATOM 74 H TYR A 104 9.432 7.228 7.853 1.00 0.00 H ATOM 75 N SER A 105 8.626 3.322 7.811 1.00 16.71 N ATOM 76 CA SER A 105 9.487 2.152 7.623 1.00 14.70 C ATOM 77 C SER A 105 8.661 1.061 6.965 1.00 17.73 C ATOM 78 O SER A 105 7.554 0.753 7.429 1.00 18.15 O ATOM 79 CB SER A 105 9.991 1.630 8.988 1.00 16.27 C ATOM 80 OG SER A 105 10.719 0.397 8.874 1.00 16.26 O ATOM 81 HG SER A 105 11.507 0.533 8.290 1.00 0.00 H ATOM 82 H SER A 105 7.693 3.182 8.249 1.00 0.00 H ATOM 83 N SER A 106 9.213 0.437 5.925 1.00 16.21 N ATOM 84 CA SER A 106 8.494 -0.619 5.229 1.00 18.19 C ATOM 85 C SER A 106 9.475 -1.418 4.377 1.00 18.52 C ATOM 86 O SER A 106 10.665 -1.096 4.285 1.00 18.91 O ATOM 87 CB SER A 106 7.393 -0.030 4.349 1.00 18.79 C ATOM 88 OG SER A 106 7.964 0.561 3.187 1.00 22.15 O ATOM 89 HG SER A 106 8.587 1.282 3.457 1.00 0.00 H ATOM 90 H SER A 106 10.166 0.707 5.608 1.00 0.00 H ATOM 91 N ARG A 107 8.938 -2.466 3.742 1.00 19.48 N ATOM 92 CA ARG A 107 9.721 -3.332 2.866 1.00 16.99 C ATOM 93 C ARG A 107 10.414 -2.542 1.770 1.00 17.80 C ATOM 94 O ARG A 107 11.597 -2.766 1.475 1.00 19.73 O ATOM 95 CB ARG A 107 8.788 -4.371 2.244 1.00 19.56 C ATOM 96 CG ARG A 107 9.452 -5.267 1.217 1.00 19.15 C ATOM 97 CD ARG A 107 8.411 -5.977 0.402 1.00 26.63 C ATOM 98 NE ARG A 107 9.062 -6.681 -0.702 1.00 34.11 N ATOM 99 CZ ARG A 107 8.469 -7.548 -1.509 1.00 35.40 C ATOM 100 NH1 ARG A 107 7.179 -7.816 -1.354 1.00 38.01 N ATOM 101 NH2 ARG A 107 9.178 -8.132 -2.473 1.00 38.53 N ATOM 102 HE ARG A 107 10.070 -6.486 -0.867 1.00 0.00 H ATOM 103 HH12 ARG A 107 6.710 -8.496 -1.985 1.00 0.00 H ATOM 104 HH11 ARG A 107 6.637 -7.346 -0.601 1.00 0.00 H ATOM 105 HH22 ARG A 107 8.723 -8.814 -3.113 1.00 0.00 H ATOM 106 HH21 ARG A 107 10.187 -7.906 -2.586 1.00 0.00 H ATOM 107 H ARG A 107 7.927 -2.671 3.877 1.00 0.00 H ATOM 108 N SER A 108 9.670 -1.664 1.097 1.00 20.44 N ATOM 109 CA SER A 108 10.159 -1.055 -0.125 1.00 20.71 C ATOM 110 C SER A 108 10.363 0.445 -0.042 1.00 27.41 C ATOM 111 O SER A 108 10.750 1.047 -1.049 1.00 24.50 O ATOM 112 CB SER A 108 9.221 -1.361 -1.301 1.00 25.87 C ATOM 113 OG SER A 108 7.973 -0.721 -1.115 1.00 38.57 O ATOM 114 HG SER A 108 7.558 -1.047 -0.277 1.00 0.00 H ATOM 115 H SER A 108 8.726 -1.412 1.453 1.00 0.00 H ATOM 116 N LYS A 109 10.111 1.076 1.105 1.00 20.20 N ATOM 117 CA LYS A 109 10.122 2.534 1.132 1.00 22.79 C ATOM 118 C LYS A 109 10.392 3.032 2.546 1.00 20.35 C ATOM 119 O LYS A 109 9.825 2.518 3.512 1.00 19.86 O ATOM 120 CB LYS A 109 8.766 3.075 0.664 1.00 24.17 C ATOM 121 CG LYS A 109 8.645 4.591 0.655 1.00 28.56 C ATOM 122 CD LYS A 109 7.280 5.012 0.117 1.00 27.01 C ATOM 123 CE LYS A 109 7.127 6.535 0.119 1.00 34.07 C ATOM 124 NZ LYS A 109 5.824 6.965 -0.474 1.00 40.17 N ATOM 125 HZ1 LYS A 109 5.766 6.632 -1.458 1.00 0.00 H ATOM 126 HZ2 LYS A 109 5.042 6.558 0.078 1.00 0.00 H ATOM 127 HZ3 LYS A 109 5.761 8.003 -0.453 1.00 0.00 H ATOM 128 H LYS A 109 9.909 0.535 1.970 1.00 0.00 H ATOM 129 N VAL A 110 11.250 4.044 2.657 1.00 18.35 N ATOM 130 CA VAL A 110 11.386 4.833 3.876 1.00 15.10 C ATOM 131 C VAL A 110 11.268 6.310 3.529 1.00 18.31 C ATOM 132 O VAL A 110 11.606 6.750 2.425 1.00 17.53 O ATOM 133 CB VAL A 110 12.727 4.580 4.608 1.00 14.88 C ATOM 134 CG1 VAL A 110 12.768 3.183 5.234 1.00 18.93 C ATOM 135 CG2 VAL A 110 13.918 4.774 3.637 1.00 18.11 C ATOM 136 H VAL A 110 11.848 4.282 1.840 1.00 0.00 H ATOM 137 N TYR A 111 10.781 7.086 4.493 1.00 17.69 N ATOM 138 CA TYR A 111 10.896 8.530 4.412 1.00 16.76 C ATOM 139 C TYR A 111 10.869 9.113 5.814 1.00 17.49 C ATOM 140 O TYR A 111 10.440 8.465 6.782 1.00 16.32 O ATOM 141 CB TYR A 111 9.825 9.196 3.533 1.00 20.33 C ATOM 142 CG TYR A 111 8.406 9.122 4.041 1.00 22.09 C ATOM 143 CD1 TYR A 111 7.937 10.005 5.010 1.00 24.77 C ATOM 144 CD2 TYR A 111 7.518 8.210 3.500 1.00 21.19 C ATOM 145 CE1 TYR A 111 6.628 9.951 5.450 1.00 26.80 C ATOM 146 CE2 TYR A 111 6.204 8.161 3.908 1.00 29.15 C ATOM 147 CZ TYR A 111 5.766 9.021 4.890 1.00 25.18 C ATOM 148 OH TYR A 111 4.450 8.953 5.304 1.00 33.44 O ATOM 149 HH TYR A 111 4.292 9.630 6.009 1.00 0.00 H ATOM 150 H TYR A 111 10.312 6.653 5.314 1.00 0.00 H ATOM 151 N VAL A 112 11.407 10.326 5.916 1.00 16.05 N ATOM 152 CA VAL A 112 11.348 11.136 7.132 1.00 17.03 C ATOM 153 C VAL A 112 10.969 12.539 6.702 1.00 17.96 C ATOM 154 O VAL A 112 11.559 13.083 5.758 1.00 17.27 O ATOM 155 CB VAL A 112 12.696 11.165 7.874 1.00 16.95 C ATOM 156 CG1 VAL A 112 12.656 12.118 9.099 1.00 16.11 C ATOM 157 CG2 VAL A 112 13.092 9.763 8.305 1.00 17.87 C ATOM 158 H VAL A 112 11.896 10.719 5.086 1.00 0.00 H ATOM 159 N ALA A 113 9.981 13.115 7.381 1.00 16.78 N ATOM 160 CA ALA A 113 9.582 14.493 7.169 1.00 16.68 C ATOM 161 C ALA A 113 9.711 15.241 8.485 1.00 18.13 C ATOM 162 O ALA A 113 9.472 14.679 9.572 1.00 16.69 O ATOM 163 CB ALA A 113 8.139 14.597 6.646 1.00 18.04 C ATOM 164 H ALA A 113 9.473 12.553 8.094 1.00 0.00 H ATOM 165 N VAL A 114 10.140 16.492 8.389 1.00 17.27 N ATOM 166 CA VAL A 114 10.312 17.371 9.541 1.00 17.04 C ATOM 167 C VAL A 114 9.582 18.667 9.225 1.00 18.40 C ATOM 168 O VAL A 114 9.908 19.343 8.237 1.00 18.99 O ATOM 169 CB VAL A 114 11.795 17.649 9.857 1.00 16.37 C ATOM 170 CG1 VAL A 114 11.908 18.592 11.057 1.00 20.42 C ATOM 171 CG2 VAL A 114 12.548 16.364 10.119 1.00 17.27 C ATOM 172 H VAL A 114 10.365 16.866 7.445 1.00 0.00 H ATOM 173 N ASP A 115 8.566 18.991 10.027 1.00 19.09 N ATOM 174 CA ASP A 115 7.795 20.214 9.832 1.00 20.56 C ATOM 175 C ASP A 115 7.207 20.300 8.420 1.00 21.58 C ATOM 176 O ASP A 115 7.092 21.383 7.833 1.00 22.76 O ATOM 177 CB ASP A 115 8.609 21.461 10.186 1.00 21.27 C ATOM 178 CG ASP A 115 8.725 21.673 11.688 1.00 30.66 C ATOM 179 OD1 ASP A 115 7.984 20.999 12.437 1.00 26.22 O ATOM 180 OD2 ASP A 115 9.541 22.525 12.098 1.00 28.95 O ATOM 181 H ASP A 115 8.317 18.355 10.811 1.00 0.00 H ATOM 182 N GLY A 116 6.798 19.149 7.891 1.00 21.34 N ATOM 183 CA GLY A 116 6.126 19.122 6.603 1.00 22.55 C ATOM 184 C GLY A 116 7.056 19.129 5.419 1.00 22.36 C ATOM 185 O GLY A 116 6.593 19.311 4.284 1.00 23.66 O ATOM 186 H GLY A 116 6.961 18.260 8.405 1.00 0.00 H ATOM 187 N THR A 117 8.350 18.944 5.633 1.00 15.92 N ATOM 188 CA THR A 117 9.331 18.913 4.554 1.00 16.75 C ATOM 189 C THR A 117 10.007 17.551 4.573 1.00 18.32 C ATOM 190 O THR A 117 10.494 17.106 5.617 1.00 15.64 O ATOM 191 CB THR A 117 10.380 20.007 4.795 1.00 18.36 C ATOM 192 OG1 THR A 117 9.789 21.299 4.615 1.00 22.85 O ATOM 193 CG2 THR A 117 11.554 19.843 3.862 1.00 22.02 C ATOM 194 HG1 THR A 117 9.443 21.376 3.691 1.00 0.00 H ATOM 195 H THR A 117 8.680 18.816 6.611 1.00 0.00 H ATOM 196 N THR A 118 10.044 16.879 3.430 1.00 17.08 N ATOM 197 CA THR A 118 10.676 15.574 3.349 1.00 16.65 C ATOM 198 C THR A 118 12.188 15.741 3.356 1.00 18.67 C ATOM 199 O THR A 118 12.750 16.373 2.455 1.00 18.95 O ATOM 200 CB THR A 118 10.236 14.894 2.054 1.00 18.51 C ATOM 201 OG1 THR A 118 8.828 14.648 2.134 1.00 23.36 O ATOM 202 CG2 THR A 118 10.977 13.599 1.844 1.00 18.25 C ATOM 203 HG1 THR A 118 8.523 14.207 1.302 1.00 0.00 H ATOM 204 H THR A 118 9.614 17.293 2.579 1.00 0.00 H ATOM 205 N VAL A 119 12.844 15.206 4.382 1.00 15.00 N ATOM 206 CA VAL A 119 14.298 15.271 4.444 1.00 17.88 C ATOM 207 C VAL A 119 14.978 13.971 4.040 1.00 16.92 C ATOM 208 O VAL A 119 16.206 13.956 3.871 1.00 20.94 O ATOM 209 CB VAL A 119 14.784 15.767 5.822 1.00 18.62 C ATOM 210 CG1 VAL A 119 14.185 17.123 6.087 1.00 23.26 C ATOM 211 CG2 VAL A 119 14.390 14.792 6.920 1.00 22.20 C ATOM 212 H VAL A 119 12.315 14.738 5.145 1.00 0.00 H ATOM 213 N LEU A 120 14.234 12.879 3.898 1.00 14.01 N ATOM 214 CA LEU A 120 14.785 11.600 3.473 1.00 17.40 C ATOM 215 C LEU A 120 13.658 10.889 2.752 1.00 16.02 C ATOM 216 O LEU A 120 12.532 10.859 3.257 1.00 18.80 O ATOM 217 CB LEU A 120 15.214 10.777 4.700 1.00 18.60 C ATOM 218 CG LEU A 120 15.830 9.388 4.542 1.00 25.12 C ATOM 219 CD1 LEU A 120 16.601 9.010 5.797 1.00 33.46 C ATOM 220 CD2 LEU A 120 14.815 8.313 4.255 1.00 24.64 C ATOM 221 H LEU A 120 13.215 12.941 4.099 1.00 0.00 H ATOM 222 N GLU A 121 13.940 10.353 1.564 1.00 19.32 N ATOM 223 CA GLU A 121 12.944 9.554 0.861 1.00 21.47 C ATOM 224 C GLU A 121 13.690 8.580 -0.031 1.00 23.03 C ATOM 225 O GLU A 121 14.486 9.011 -0.866 1.00 25.31 O ATOM 226 CB GLU A 121 11.964 10.422 0.047 1.00 25.62 C ATOM 227 CG GLU A 121 10.848 9.616 -0.647 1.00 30.84 C ATOM 228 CD GLU A 121 9.575 10.411 -0.986 1.00 38.99 C ATOM 229 OE1 GLU A 121 9.609 11.658 -1.107 1.00 28.58 O ATOM 230 OE2 GLU A 121 8.515 9.762 -1.153 1.00 48.09 O ATOM 231 H GLU A 121 14.876 10.506 1.137 1.00 0.00 H ATOM 232 N ASP A 122 13.447 7.286 0.176 1.00 19.15 N ATOM 233 CA ASP A 122 14.060 6.235 -0.637 1.00 20.04 C ATOM 234 C ASP A 122 12.978 5.210 -0.950 1.00 22.10 C ATOM 235 O ASP A 122 12.627 4.386 -0.103 1.00 20.39 O ATOM 236 CB ASP A 122 15.245 5.594 0.069 1.00 24.22 C ATOM 237 CG ASP A 122 15.996 4.624 -0.818 1.00 32.73 C ATOM 238 OD1 ASP A 122 15.379 4.043 -1.745 1.00 25.56 O ATOM 239 OD2 ASP A 122 17.210 4.446 -0.577 1.00 29.37 O ATOM 240 H ASP A 122 12.799 7.014 0.942 1.00 0.00 H ATOM 241 N GLU A 123 12.496 5.234 -2.194 1.00 23.61 N ATOM 242 CA GLU A 123 11.540 4.257 -2.699 1.00 31.34 C ATOM 243 C GLU A 123 12.129 3.438 -3.838 1.00 32.38 C ATOM 244 O GLU A 123 11.385 2.782 -4.569 1.00 32.97 O ATOM 245 CB GLU A 123 10.246 4.943 -3.152 1.00 31.10 C ATOM 246 CG GLU A 123 10.476 6.237 -3.931 1.00 43.55 C ATOM 247 CD GLU A 123 9.184 6.930 -4.370 1.00 51.46 C ATOM 248 OE1 GLU A 123 9.150 7.428 -5.512 1.00 52.82 O ATOM 249 OE2 GLU A 123 8.210 6.986 -3.583 1.00 44.39 O ATOM 250 H GLU A 123 12.818 5.987 -2.835 1.00 0.00 H ATOM 251 N ALA A 124 13.450 3.463 -4.005 1.00 25.74 N ATOM 252 CA ALA A 124 14.083 2.783 -5.135 1.00 27.23 C ATOM 253 C ALA A 124 14.160 1.287 -4.869 1.00 27.14 C ATOM 254 O ALA A 124 14.584 0.862 -3.786 1.00 29.17 O ATOM 255 CB ALA A 124 15.491 3.330 -5.351 1.00 32.69 C ATOM 256 H ALA A 124 14.042 3.975 -3.320 1.00 0.00 H ATOM 257 N ARG A 125 13.764 0.484 -5.853 1.00 36.01 N ATOM 258 CA ARG A 125 13.859 -0.958 -5.694 1.00 35.70 C ATOM 259 C ARG A 125 15.323 -1.375 -5.596 1.00 32.92 C ATOM 260 O ARG A 125 16.191 -0.817 -6.271 1.00 44.01 O ATOM 261 CB ARG A 125 13.189 -1.641 -6.887 1.00 49.79 C ATOM 262 CG ARG A 125 11.688 -1.407 -6.930 1.00 55.26 C ATOM 263 CD ARG A 125 11.112 -1.645 -8.304 1.00 64.57 C ATOM 264 NE ARG A 125 10.032 -2.639 -8.276 1.00 71.93 N ATOM 265 CZ ARG A 125 8.804 -2.433 -7.802 1.00 70.94 C ATOM 266 NH1 ARG A 125 7.908 -3.421 -7.840 1.00 71.27 N ATOM 267 NH2 ARG A 125 8.476 -1.254 -7.287 1.00 69.80 N ATOM 268 HE ARG A 125 10.243 -3.583 -8.658 1.00 0.00 H ATOM 269 HH12 ARG A 125 6.948 -3.267 -7.472 1.00 0.00 H ATOM 270 HH11 ARG A 125 8.170 -4.345 -8.238 1.00 0.00 H ATOM 271 HH22 ARG A 125 7.517 -1.097 -6.918 1.00 0.00 H ATOM 272 HH21 ARG A 125 9.179 -0.488 -7.253 1.00 0.00 H ATOM 273 H ARG A 125 13.387 0.887 -6.735 1.00 0.00 H ATOM 274 N GLU A 126 15.603 -2.329 -4.711 1.00 34.00 N ATOM 275 CA GLU A 126 16.922 -2.961 -4.639 1.00 48.22 C ATOM 276 C GLU A 126 18.018 -1.994 -4.190 1.00 45.06 C ATOM 277 O GLU A 126 19.198 -2.196 -4.495 1.00 41.50 O ATOM 278 CB GLU A 126 17.301 -3.620 -5.971 1.00 46.17 C ATOM 279 CG GLU A 126 16.443 -4.815 -6.363 1.00 55.59 C ATOM 280 CD GLU A 126 16.216 -5.784 -5.214 1.00 58.83 C ATOM 281 OE1 GLU A 126 17.171 -6.522 -4.866 1.00 55.09 O ATOM 282 OE2 GLU A 126 15.091 -5.803 -4.660 1.00 56.81 O ATOM 283 H GLU A 126 14.861 -2.635 -4.049 1.00 0.00 H ATOM 284 N GLN A 127 17.653 -0.936 -3.466 1.00 28.73 N ATOM 285 CA GLN A 127 18.620 0.034 -2.980 1.00 25.78 C ATOM 286 C GLN A 127 18.200 0.505 -1.601 1.00 21.72 C ATOM 287 O GLN A 127 17.021 0.461 -1.243 1.00 27.15 O ATOM 288 CB GLN A 127 18.671 1.280 -3.863 1.00 43.25 C ATOM 289 CG GLN A 127 19.357 1.092 -5.181 1.00 33.18 C ATOM 290 CD GLN A 127 19.284 2.352 -6.019 1.00 46.47 C ATOM 291 OE1 GLN A 127 19.084 3.456 -5.492 1.00 41.00 O ATOM 292 NE2 GLN A 127 19.436 2.198 -7.327 1.00 45.62 N ATOM 293 HE22 GLN A 127 19.602 1.251 -7.723 1.00 0.00 H ATOM 294 HE21 GLN A 127 19.389 3.024 -7.957 1.00 0.00 H ATOM 295 H GLN A 127 16.646 -0.801 -3.242 1.00 0.00 H ATOM 296 N GLY A 128 19.182 1.004 -0.845 1.00 20.72 N ATOM 297 CA GLY A 128 18.899 1.623 0.436 1.00 20.54 C ATOM 298 C GLY A 128 18.497 0.659 1.527 1.00 18.39 C ATOM 299 O GLY A 128 17.812 1.061 2.477 1.00 15.66 O ATOM 300 H GLY A 128 20.165 0.948 -1.180 1.00 0.00 H ATOM 301 N ARG A 129 18.875 -0.612 1.414 1.00 19.33 N ATOM 302 CA ARG A 129 18.548 -1.578 2.460 1.00 16.15 C ATOM 303 C ARG A 129 19.231 -1.196 3.770 1.00 12.75 C ATOM 304 O ARG A 129 20.368 -0.717 3.766 1.00 14.23 O ATOM 305 CB ARG A 129 19.041 -2.964 2.048 1.00 15.44 C ATOM 306 CG ARG A 129 18.638 -4.067 3.049 1.00 14.05 C ATOM 307 CD ARG A 129 19.044 -5.432 2.527 1.00 16.62 C ATOM 308 NE ARG A 129 20.453 -5.433 2.165 1.00 15.26 N ATOM 309 CZ ARG A 129 20.970 -6.143 1.167 1.00 16.94 C ATOM 310 NH1 ARG A 129 20.195 -6.947 0.432 1.00 19.17 N ATOM 311 NH2 ARG A 129 22.264 -6.061 0.906 1.00 19.64 N ATOM 312 HE ARG A 129 21.098 -4.839 2.724 1.00 0.00 H ATOM 313 HH12 ARG A 129 20.609 -7.498 -0.347 1.00 0.00 H ATOM 314 HH11 ARG A 129 19.178 -7.021 0.639 1.00 0.00 H ATOM 315 HH22 ARG A 129 22.673 -6.614 0.126 1.00 0.00 H ATOM 316 HH21 ARG A 129 22.872 -5.443 1.480 1.00 0.00 H ATOM 317 H ARG A 129 19.407 -0.920 0.575 1.00 0.00 H ATOM 318 N GLY A 130 18.519 -1.390 4.889 1.00 16.30 N ATOM 319 CA GLY A 130 19.124 -1.331 6.209 1.00 12.77 C ATOM 320 C GLY A 130 18.486 -0.265 7.091 1.00 13.73 C ATOM 321 O GLY A 130 17.307 0.084 6.950 1.00 14.31 O ATOM 322 H GLY A 130 17.501 -1.589 4.810 1.00 0.00 H ATOM 323 N ILE A 131 19.284 0.255 8.008 1.00 12.93 N ATOM 324 CA ILE A 131 18.839 1.272 8.952 1.00 11.05 C ATOM 325 C ILE A 131 19.300 2.636 8.455 1.00 14.05 C ATOM 326 O ILE A 131 20.506 2.894 8.314 1.00 15.45 O ATOM 327 CB ILE A 131 19.368 0.990 10.367 1.00 14.04 C ATOM 328 CG1 ILE A 131 18.872 -0.388 10.834 1.00 13.81 C ATOM 329 CG2 ILE A 131 18.918 2.108 11.315 1.00 16.09 C ATOM 330 CD1 ILE A 131 19.563 -0.940 12.070 1.00 13.90 C ATOM 331 H ILE A 131 20.269 -0.075 8.058 1.00 0.00 H ATOM 332 N HIS A 132 18.328 3.499 8.160 1.00 15.47 N ATOM 333 CA HIS A 132 18.597 4.892 7.834 1.00 14.80 C ATOM 334 C HIS A 132 18.626 5.696 9.116 1.00 15.27 C ATOM 335 O HIS A 132 17.789 5.492 10.005 1.00 16.39 O ATOM 336 CB HIS A 132 17.502 5.435 6.936 1.00 14.01 C ATOM 337 CG HIS A 132 17.474 4.779 5.599 1.00 13.88 C ATOM 338 ND1 HIS A 132 17.781 5.451 4.439 1.00 19.47 N ATOM 339 CD2 HIS A 132 17.223 3.494 5.242 1.00 13.71 C ATOM 340 CE1 HIS A 132 17.705 4.611 3.420 1.00 16.95 C ATOM 341 NE2 HIS A 132 17.370 3.417 3.881 1.00 13.43 N ATOM 342 H HIS A 132 17.343 3.165 8.163 1.00 0.00 H ATOM 343 N VAL A 133 19.605 6.594 9.223 1.00 13.19 N ATOM 344 CA VAL A 133 19.809 7.386 10.440 1.00 13.95 C ATOM 345 C VAL A 133 19.883 8.857 10.061 1.00 15.48 C ATOM 346 O VAL A 133 20.654 9.233 9.170 1.00 17.63 O ATOM 347 CB VAL A 133 21.086 6.970 11.193 1.00 15.43 C ATOM 348 CG1 VAL A 133 21.199 7.805 12.459 1.00 16.40 C ATOM 349 CG2 VAL A 133 21.050 5.495 11.529 1.00 17.72 C ATOM 350 H VAL A 133 20.246 6.738 8.416 1.00 0.00 H ATOM 351 N ILE A 134 19.038 9.678 10.680 1.00 14.19 N ATOM 352 CA ILE A 134 19.075 11.128 10.526 1.00 13.62 C ATOM 353 C ILE A 134 19.337 11.751 11.895 1.00 14.03 C ATOM 354 O ILE A 134 18.746 11.334 12.901 1.00 16.95 O ATOM 355 CB ILE A 134 17.761 11.675 9.942 1.00 17.44 C ATOM 356 CG1 ILE A 134 17.510 11.142 8.531 1.00 27.13 C ATOM 357 CG2 ILE A 134 17.803 13.192 9.884 1.00 20.93 C ATOM 358 CD1 ILE A 134 16.334 11.811 7.890 1.00 35.41 C ATOM 359 H ILE A 134 18.316 9.265 11.304 1.00 0.00 H ATOM 360 N VAL A 135 20.238 12.736 11.929 1.00 12.66 N ATOM 361 CA VAL A 135 20.572 13.499 13.133 1.00 14.06 C ATOM 362 C VAL A 135 20.120 14.936 12.912 1.00 13.41 C ATOM 363 O VAL A 135 20.487 15.557 11.907 1.00 13.82 O ATOM 364 CB VAL A 135 22.083 13.468 13.427 1.00 12.98 C ATOM 365 CG1 VAL A 135 22.407 14.263 14.707 1.00 15.75 C ATOM 366 CG2 VAL A 135 22.578 12.043 13.565 1.00 15.75 C ATOM 367 H VAL A 135 20.733 12.976 11.046 1.00 0.00 H ATOM 368 N LEU A 136 19.308 15.469 13.839 1.00 12.47 N ATOM 369 CA LEU A 136 18.855 16.844 13.723 1.00 13.07 C ATOM 370 C LEU A 136 19.414 17.689 14.861 1.00 16.39 C ATOM 371 O LEU A 136 19.550 17.220 15.992 1.00 15.14 O ATOM 372 CB LEU A 136 17.323 16.947 13.800 1.00 15.11 C ATOM 373 CG LEU A 136 16.461 16.033 12.932 1.00 12.29 C ATOM 374 CD1 LEU A 136 14.991 16.341 13.160 1.00 15.47 C ATOM 375 CD2 LEU A 136 16.830 16.264 11.486 1.00 15.42 C ATOM 376 H LEU A 136 19.001 14.892 14.648 1.00 0.00 H ATOM 377 N ASN A 137 19.697 18.954 14.548 1.00 16.03 N ATOM 378 CA ASN A 137 19.946 19.958 15.581 1.00 15.16 C ATOM 379 C ASN A 137 18.718 20.132 16.462 1.00 13.33 C ATOM 380 O ASN A 137 17.603 20.339 15.967 1.00 16.19 O ATOM 381 CB ASN A 137 20.332 21.292 14.934 1.00 16.42 C ATOM 382 CG ASN A 137 20.572 22.393 15.966 1.00 15.31 C ATOM 383 OD1 ASN A 137 19.628 22.953 16.513 1.00 15.50 O ATOM 384 ND2 ASN A 137 21.840 22.699 16.239 1.00 16.19 N ATOM 385 HD22 ASN A 137 22.612 22.200 15.752 1.00 0.00 H ATOM 386 HD21 ASN A 137 22.058 23.437 16.939 1.00 0.00 H ATOM 387 H ASN A 137 19.742 19.232 13.547 1.00 0.00 H ATOM 388 N GLN A 138 18.934 20.091 17.781 1.00 14.09 N ATOM 389 CA GLN A 138 17.832 20.029 18.731 1.00 15.01 C ATOM 390 C GLN A 138 17.156 21.370 18.966 1.00 18.38 C ATOM 391 O GLN A 138 16.118 21.400 19.639 1.00 18.77 O ATOM 392 CB GLN A 138 18.337 19.467 20.064 1.00 19.40 C ATOM 393 CG GLN A 138 19.449 20.298 20.696 1.00 19.56 C ATOM 394 CD GLN A 138 20.851 19.794 20.371 1.00 19.44 C ATOM 395 OE1 GLN A 138 21.152 19.457 19.235 1.00 18.55 O ATOM 396 NE2 GLN A 138 21.716 19.749 21.380 1.00 23.51 N ATOM 397 HE22 GLN A 138 21.420 20.045 22.332 1.00 0.00 H ATOM 398 HE21 GLN A 138 22.688 19.418 21.217 1.00 0.00 H ATOM 399 H GLN A 138 19.911 20.104 18.137 1.00 0.00 H ATOM 400 N ALA A 139 17.699 22.468 18.437 1.00 18.92 N ATOM 401 CA ALA A 139 17.054 23.772 18.552 1.00 15.89 C ATOM 402 C ALA A 139 16.354 24.214 17.276 1.00 19.38 C ATOM 403 O ALA A 139 15.315 24.881 17.356 1.00 22.27 O ATOM 404 CB ALA A 139 18.080 24.843 18.933 1.00 16.10 C ATOM 405 H ALA A 139 18.604 22.393 17.930 1.00 0.00 H ATOM 406 N THR A 140 16.886 23.853 16.100 1.00 17.58 N ATOM 407 CA THR A 140 16.349 24.301 14.818 1.00 20.30 C ATOM 408 C THR A 140 15.721 23.194 13.982 1.00 19.93 C ATOM 409 O THR A 140 15.001 23.506 13.022 1.00 19.48 O ATOM 410 CB THR A 140 17.460 24.924 13.957 1.00 16.30 C ATOM 411 OG1 THR A 140 18.421 23.907 13.670 1.00 16.70 O ATOM 412 CG2 THR A 140 18.150 26.080 14.671 1.00 21.26 C ATOM 413 HG1 THR A 140 18.798 23.562 14.518 1.00 0.00 H ATOM 414 H THR A 140 17.717 23.227 16.100 1.00 0.00 H ATOM 415 N GLY A 141 16.016 21.925 14.269 1.00 15.96 N ATOM 416 CA GLY A 141 15.608 20.826 13.410 1.00 14.66 C ATOM 417 C GLY A 141 16.405 20.655 12.130 1.00 17.79 C ATOM 418 O GLY A 141 16.062 19.786 11.318 1.00 17.50 O ATOM 419 H GLY A 141 16.554 21.716 15.134 1.00 0.00 H ATOM 420 N HIS A 142 17.446 21.449 11.908 1.00 14.72 N ATOM 421 CA HIS A 142 18.245 21.284 10.699 1.00 16.38 C ATOM 422 C HIS A 142 18.943 19.930 10.710 1.00 15.33 C ATOM 423 O HIS A 142 19.377 19.433 11.755 1.00 14.38 O ATOM 424 CB HIS A 142 19.298 22.391 10.628 1.00 16.28 C ATOM 425 CG HIS A 142 18.732 23.753 10.376 1.00 19.66 C ATOM 426 ND1 HIS A 142 19.523 24.836 10.056 1.00 21.27 N ATOM 427 CD2 HIS A 142 17.453 24.204 10.366 1.00 21.09 C ATOM 428 CE1 HIS A 142 18.760 25.903 9.898 1.00 22.01 C ATOM 429 NE2 HIS A 142 17.502 25.548 10.083 1.00 24.07 N ATOM 430 H HIS A 142 17.692 22.189 12.596 1.00 0.00 H ATOM 431 N VAL A 143 19.063 19.329 9.528 1.00 13.01 N ATOM 432 CA VAL A 143 19.714 18.034 9.404 1.00 13.88 C ATOM 433 C VAL A 143 21.222 18.192 9.545 1.00 14.62 C ATOM 434 O VAL A 143 21.864 18.901 8.760 1.00 16.02 O ATOM 435 CB VAL A 143 19.362 17.367 8.067 1.00 12.76 C ATOM 436 CG1 VAL A 143 20.169 16.080 7.929 1.00 13.70 C ATOM 437 CG2 VAL A 143 17.857 17.118 7.994 1.00 14.68 C ATOM 438 H VAL A 143 18.685 19.794 8.678 1.00 0.00 H ATOM 439 N MET A 144 21.802 17.503 10.534 1.00 13.70 N ATOM 440 CA MET A 144 23.242 17.542 10.743 1.00 12.90 C ATOM 441 C MET A 144 23.964 16.383 10.077 1.00 15.29 C ATOM 442 O MET A 144 25.145 16.512 9.751 1.00 19.04 O ATOM 443 CB MET A 144 23.548 17.503 12.244 1.00 14.01 C ATOM 444 CG MET A 144 22.947 18.646 13.026 1.00 14.90 C ATOM 445 SD MET A 144 23.760 20.225 12.698 1.00 19.00 S ATOM 446 CE MET A 144 22.718 20.969 11.429 1.00 20.48 C ATOM 447 H MET A 144 21.211 16.927 11.167 1.00 0.00 H ATOM 448 N ALA A 145 23.289 15.251 9.887 1.00 13.73 N ATOM 449 CA ALA A 145 23.900 14.084 9.278 1.00 16.64 C ATOM 450 C ALA A 145 22.803 13.155 8.790 1.00 13.74 C ATOM 451 O ALA A 145 21.716 13.075 9.386 1.00 12.98 O ATOM 452 CB ALA A 145 24.787 13.321 10.265 1.00 15.40 C ATOM 453 H ALA A 145 22.294 15.202 10.184 1.00 0.00 H ATOM 454 N LYS A 146 23.090 12.480 7.676 1.00 16.03 N ATOM 455 CA LYS A 146 22.183 11.484 7.128 1.00 16.12 C ATOM 456 C LYS A 146 23.025 10.310 6.660 1.00 19.42 C ATOM 457 O LYS A 146 23.991 10.498 5.912 1.00 24.60 O ATOM 458 CB LYS A 146 21.345 12.090 5.988 1.00 18.97 C ATOM 459 CG LYS A 146 20.339 11.114 5.378 1.00 23.01 C ATOM 460 CD LYS A 146 19.271 11.820 4.532 1.00 33.17 C ATOM 461 CE LYS A 146 19.825 12.425 3.258 1.00 39.06 C ATOM 462 NZ LYS A 146 18.716 12.906 2.370 1.00 40.12 N ATOM 463 HZ1 LYS A 146 18.101 12.105 2.121 1.00 0.00 H ATOM 464 HZ2 LYS A 146 18.161 13.629 2.871 1.00 0.00 H ATOM 465 HZ3 LYS A 146 19.120 13.316 1.504 1.00 0.00 H ATOM 466 H LYS A 146 23.987 12.671 7.186 1.00 0.00 H ATOM 467 N ARG A 147 22.677 9.105 7.115 1.00 14.56 N ATOM 468 CA ARG A 147 23.458 7.913 6.844 1.00 14.92 C ATOM 469 C ARG A 147 22.517 6.751 6.587 1.00 13.53 C ATOM 470 O ARG A 147 21.360 6.763 7.016 1.00 15.48 O ATOM 471 CB ARG A 147 24.345 7.543 8.055 1.00 16.61 C ATOM 472 CG ARG A 147 25.353 8.629 8.488 1.00 19.40 C ATOM 473 CD ARG A 147 26.313 8.988 7.345 1.00 34.03 C ATOM 474 NE ARG A 147 27.382 9.900 7.765 1.00 26.28 N ATOM 475 CZ ARG A 147 28.496 9.478 8.340 1.00 26.05 C ATOM 476 NH1 ARG A 147 28.662 8.185 8.559 1.00 33.22 N ATOM 477 NH2 ARG A 147 29.435 10.338 8.702 1.00 24.03 N ATOM 478 HE ARG A 147 27.259 10.920 7.604 1.00 0.00 H ATOM 479 HH12 ARG A 147 29.534 7.842 9.010 1.00 0.00 H ATOM 480 HH11 ARG A 147 27.921 7.511 8.280 1.00 0.00 H ATOM 481 HH22 ARG A 147 30.307 9.996 9.153 1.00 0.00 H ATOM 482 HH21 ARG A 147 29.300 11.356 8.535 1.00 0.00 H ATOM 483 H ARG A 147 21.812 9.017 7.686 1.00 0.00 H ATOM 484 N VAL A 148 23.032 5.727 5.909 1.00 13.10 N ATOM 485 CA VAL A 148 22.336 4.450 5.795 1.00 12.88 C ATOM 486 C VAL A 148 23.331 3.330 6.092 1.00 14.06 C ATOM 487 O VAL A 148 24.414 3.267 5.489 1.00 15.74 O ATOM 488 CB VAL A 148 21.645 4.258 4.426 1.00 19.45 C ATOM 489 CG1 VAL A 148 22.623 4.435 3.287 1.00 29.46 C ATOM 490 CG2 VAL A 148 20.935 2.902 4.376 1.00 18.74 C ATOM 491 H VAL A 148 23.957 5.841 5.448 1.00 0.00 H ATOM 492 N PHE A 149 22.975 2.459 7.043 1.00 13.50 N ATOM 493 CA PHE A 149 23.807 1.315 7.395 1.00 13.82 C ATOM 494 C PHE A 149 23.099 0.034 6.980 1.00 14.83 C ATOM 495 O PHE A 149 22.018 -0.270 7.486 1.00 16.05 O ATOM 496 CB PHE A 149 24.106 1.330 8.893 1.00 14.31 C ATOM 497 CG PHE A 149 24.789 2.589 9.329 1.00 16.83 C ATOM 498 CD1 PHE A 149 26.154 2.753 9.116 1.00 17.08 C ATOM 499 CD2 PHE A 149 24.060 3.637 9.888 1.00 15.52 C ATOM 500 CE1 PHE A 149 26.793 3.923 9.493 1.00 16.11 C ATOM 501 CE2 PHE A 149 24.705 4.822 10.240 1.00 14.97 C ATOM 502 CZ PHE A 149 26.073 4.953 10.049 1.00 17.18 C ATOM 503 H PHE A 149 22.077 2.603 7.547 1.00 0.00 H ATOM 504 N ASP A 150 23.695 -0.696 6.037 1.00 14.56 N ATOM 505 CA ASP A 150 23.103 -1.940 5.543 1.00 11.60 C ATOM 506 C ASP A 150 23.429 -3.061 6.524 1.00 12.24 C ATOM 507 O ASP A 150 24.278 -3.922 6.288 1.00 13.14 O ATOM 508 CB ASP A 150 23.636 -2.257 4.153 1.00 17.50 C ATOM 509 CG ASP A 150 23.093 -3.564 3.602 1.00 18.21 C ATOM 510 OD1 ASP A 150 22.055 -4.031 4.082 1.00 15.58 O ATOM 511 OD2 ASP A 150 23.692 -4.123 2.659 1.00 20.91 O ATOM 512 H ASP A 150 24.602 -0.374 5.643 1.00 0.00 H ATOM 513 N THR A 151 22.706 -3.057 7.640 1.00 12.31 N ATOM 514 CA THR A 151 22.938 -4.015 8.714 1.00 13.42 C ATOM 515 C THR A 151 22.382 -5.402 8.417 1.00 14.01 C ATOM 516 O THR A 151 22.504 -6.294 9.249 1.00 14.12 O ATOM 517 CB THR A 151 22.396 -3.441 10.020 1.00 13.30 C ATOM 518 OG1 THR A 151 21.080 -2.914 9.780 1.00 13.81 O ATOM 519 CG2 THR A 151 23.312 -2.316 10.465 1.00 14.54 C ATOM 520 HG1 THR A 151 20.488 -3.640 9.460 1.00 0.00 H ATOM 521 H THR A 151 21.952 -2.349 7.750 1.00 0.00 H ATOM 522 N TYR A 152 21.800 -5.616 7.243 1.00 14.16 N ATOM 523 CA TYR A 152 21.647 -6.962 6.722 1.00 15.48 C ATOM 524 C TYR A 152 22.988 -7.589 6.359 1.00 13.99 C ATOM 525 O TYR A 152 23.074 -8.819 6.237 1.00 16.09 O ATOM 526 CB TYR A 152 20.750 -6.879 5.487 1.00 16.93 C ATOM 527 CG TYR A 152 20.707 -8.094 4.611 1.00 19.34 C ATOM 528 CD1 TYR A 152 19.806 -9.124 4.841 1.00 18.47 C ATOM 529 CD2 TYR A 152 21.533 -8.186 3.502 1.00 19.04 C ATOM 530 CE1 TYR A 152 19.759 -10.222 3.998 1.00 21.15 C ATOM 531 CE2 TYR A 152 21.497 -9.245 2.692 1.00 19.43 C ATOM 532 CZ TYR A 152 20.618 -10.257 2.913 1.00 18.21 C ATOM 533 OH TYR A 152 20.625 -11.305 2.017 1.00 23.19 O ATOM 534 HH TYR A 152 20.415 -10.965 1.111 1.00 0.00 H ATOM 535 H TYR A 152 21.449 -4.809 6.689 1.00 0.00 H ATOM 536 N SER A 153 24.038 -6.767 6.140 1.00 12.27 N ATOM 537 CA SER A 153 25.359 -7.235 5.719 1.00 13.85 C ATOM 538 C SER A 153 26.381 -7.056 6.832 1.00 14.43 C ATOM 539 O SER A 153 26.276 -6.103 7.609 1.00 15.65 O ATOM 540 CB SER A 153 25.852 -6.397 4.544 1.00 16.35 C ATOM 541 OG SER A 153 25.030 -6.594 3.421 1.00 18.34 O ATOM 542 HG SER A 153 25.047 -7.550 3.165 1.00 0.00 H ATOM 543 H SER A 153 23.900 -5.746 6.278 1.00 0.00 H ATOM 544 N PRO A 154 27.413 -7.910 6.890 1.00 15.32 N ATOM 545 CA PRO A 154 28.409 -7.794 7.973 1.00 12.88 C ATOM 546 C PRO A 154 29.142 -6.461 7.918 1.00 15.86 C ATOM 547 O PRO A 154 29.304 -5.857 6.850 1.00 17.58 O ATOM 548 CB PRO A 154 29.382 -8.949 7.700 1.00 16.52 C ATOM 549 CG PRO A 154 28.673 -9.878 6.793 1.00 26.31 C ATOM 550 CD PRO A 154 27.660 -9.075 6.025 1.00 17.19 C ATOM 551 N HIS A 155 29.582 -6.010 9.096 1.00 13.24 N ATOM 552 CA HIS A 155 30.455 -4.853 9.300 1.00 15.87 C ATOM 553 C HIS A 155 29.727 -3.515 9.358 1.00 14.76 C ATOM 554 O HIS A 155 30.262 -2.548 9.897 1.00 16.14 O ATOM 555 CB HIS A 155 31.625 -4.801 8.310 1.00 13.78 C ATOM 556 CG HIS A 155 32.536 -5.986 8.400 1.00 14.64 C ATOM 557 ND1 HIS A 155 32.570 -6.976 7.439 1.00 25.27 N ATOM 558 CD2 HIS A 155 33.448 -6.339 9.338 1.00 18.41 C ATOM 559 CE1 HIS A 155 33.471 -7.879 7.771 1.00 21.47 C ATOM 560 NE2 HIS A 155 34.017 -7.518 8.918 1.00 27.58 N ATOM 561 H HIS A 155 29.277 -6.528 9.945 1.00 0.00 H ATOM 562 N GLU A 156 28.514 -3.439 8.806 1.00 13.40 N ATOM 563 CA GLU A 156 27.797 -2.173 8.785 1.00 14.35 C ATOM 564 C GLU A 156 27.360 -1.746 10.183 1.00 15.83 C ATOM 565 O GLU A 156 27.333 -0.544 10.475 1.00 14.78 O ATOM 566 CB GLU A 156 26.598 -2.266 7.828 1.00 11.95 C ATOM 567 CG GLU A 156 27.040 -2.378 6.388 1.00 14.39 C ATOM 568 CD GLU A 156 27.424 -1.033 5.827 1.00 22.72 C ATOM 569 OE1 GLU A 156 26.532 -0.169 5.696 1.00 21.84 O ATOM 570 OE2 GLU A 156 28.623 -0.835 5.536 1.00 36.46 O ATOM 571 H GLU A 156 28.080 -4.287 8.390 1.00 0.00 H ATOM 572 N ASP A 157 27.032 -2.709 11.052 1.00 13.12 N ATOM 573 CA ASP A 157 26.683 -2.379 12.435 1.00 14.17 C ATOM 574 C ASP A 157 27.858 -1.753 13.182 1.00 13.74 C ATOM 575 O ASP A 157 27.663 -0.835 13.982 1.00 16.65 O ATOM 576 CB ASP A 157 26.102 -3.609 13.170 1.00 14.82 C ATOM 577 CG ASP A 157 27.118 -4.724 13.382 1.00 21.19 C ATOM 578 OD1 ASP A 157 28.071 -4.855 12.573 1.00 16.08 O ATOM 579 OD2 ASP A 157 26.961 -5.488 14.377 1.00 17.83 O ATOM 580 H ASP A 157 27.025 -3.702 10.742 1.00 0.00 H ATOM 581 N GLU A 158 29.081 -2.243 12.942 1.00 14.08 N ATOM 582 CA GLU A 158 30.264 -1.626 13.536 1.00 14.54 C ATOM 583 C GLU A 158 30.425 -0.176 13.087 1.00 15.65 C ATOM 584 O GLU A 158 30.823 0.692 13.880 1.00 15.14 O ATOM 585 CB GLU A 158 31.516 -2.428 13.176 1.00 17.51 C ATOM 586 CG GLU A 158 31.473 -3.884 13.550 1.00 27.26 C ATOM 587 CD GLU A 158 32.659 -4.661 12.964 1.00 24.97 C ATOM 588 OE1 GLU A 158 33.152 -4.306 11.854 1.00 34.64 O ATOM 589 OE2 GLU A 158 33.104 -5.621 13.620 1.00 32.83 O ATOM 590 H GLU A 158 29.190 -3.073 12.325 1.00 0.00 H ATOM 591 N ALA A 159 30.133 0.110 11.818 1.00 13.94 N ATOM 592 CA ALA A 159 30.189 1.487 11.352 1.00 12.76 C ATOM 593 C ALA A 159 29.092 2.322 11.987 1.00 12.09 C ATOM 594 O ALA A 159 29.310 3.490 12.316 1.00 15.11 O ATOM 595 CB ALA A 159 30.042 1.521 9.823 1.00 14.81 C ATOM 596 H ALA A 159 29.865 -0.651 11.162 1.00 0.00 H ATOM 597 N MET A 160 27.909 1.737 12.160 1.00 13.47 N ATOM 598 CA MET A 160 26.828 2.455 12.826 1.00 13.92 C ATOM 599 C MET A 160 27.197 2.804 14.269 1.00 14.20 C ATOM 600 O MET A 160 26.931 3.919 14.731 1.00 15.29 O ATOM 601 CB MET A 160 25.534 1.651 12.775 1.00 14.40 C ATOM 602 CG MET A 160 24.317 2.443 13.269 1.00 15.12 C ATOM 603 SD MET A 160 22.827 1.461 13.120 1.00 18.11 S ATOM 604 CE MET A 160 23.086 0.263 14.432 1.00 23.50 C ATOM 605 H MET A 160 27.755 0.766 11.820 1.00 0.00 H ATOM 606 N VAL A 161 27.828 1.868 14.985 1.00 13.11 N ATOM 607 CA VAL A 161 28.261 2.127 16.362 1.00 13.61 C ATOM 608 C VAL A 161 29.272 3.270 16.408 1.00 16.15 C ATOM 609 O VAL A 161 29.171 4.176 17.243 1.00 15.66 O ATOM 610 CB VAL A 161 28.824 0.844 17.000 1.00 17.17 C ATOM 611 CG1 VAL A 161 29.582 1.169 18.280 1.00 17.73 C ATOM 612 CG2 VAL A 161 27.700 -0.160 17.283 1.00 16.95 C ATOM 613 H VAL A 161 28.015 0.939 14.557 1.00 0.00 H ATOM 614 N LEU A 162 30.268 3.243 15.517 1.00 14.27 N ATOM 615 CA LEU A 162 31.277 4.296 15.532 1.00 15.46 C ATOM 616 C LEU A 162 30.653 5.651 15.239 1.00 14.86 C ATOM 617 O LEU A 162 31.011 6.662 15.869 1.00 17.82 O ATOM 618 CB LEU A 162 32.370 3.967 14.506 1.00 19.29 C ATOM 619 CG LEU A 162 33.368 2.900 14.965 1.00 18.27 C ATOM 620 CD1 LEU A 162 34.078 2.224 13.775 1.00 20.24 C ATOM 621 CD2 LEU A 162 34.404 3.505 15.889 1.00 22.00 C ATOM 622 H LEU A 162 30.323 2.476 14.817 1.00 0.00 H ATOM 623 N PHE A 163 29.705 5.689 14.296 1.00 14.13 N ATOM 624 CA PHE A 163 29.034 6.940 13.957 1.00 13.18 C ATOM 625 C PHE A 163 28.171 7.454 15.098 1.00 17.94 C ATOM 626 O PHE A 163 28.252 8.632 15.468 1.00 17.99 O ATOM 627 CB PHE A 163 28.159 6.741 12.722 1.00 17.40 C ATOM 628 CG PHE A 163 27.251 7.899 12.438 1.00 15.29 C ATOM 629 CD1 PHE A 163 27.763 9.064 11.873 1.00 20.20 C ATOM 630 CD2 PHE A 163 25.895 7.821 12.692 1.00 14.82 C ATOM 631 CE1 PHE A 163 26.928 10.145 11.596 1.00 22.16 C ATOM 632 CE2 PHE A 163 25.060 8.890 12.430 1.00 23.37 C ATOM 633 CZ PHE A 163 25.579 10.052 11.876 1.00 21.75 C ATOM 634 H PHE A 163 29.442 4.815 13.797 1.00 0.00 H ATOM 635 N LEU A 164 27.320 6.591 15.644 1.00 16.24 N ATOM 636 CA LEU A 164 26.418 7.025 16.709 1.00 13.97 C ATOM 637 C LEU A 164 27.173 7.471 17.949 1.00 17.04 C ATOM 638 O LEU A 164 26.737 8.402 18.637 1.00 15.70 O ATOM 639 CB LEU A 164 25.428 5.909 17.058 1.00 16.83 C ATOM 640 CG LEU A 164 24.327 5.665 16.020 1.00 16.59 C ATOM 641 CD1 LEU A 164 23.441 4.487 16.408 1.00 22.65 C ATOM 642 CD2 LEU A 164 23.512 6.955 15.805 1.00 21.43 C ATOM 643 H LEU A 164 27.296 5.605 15.313 1.00 0.00 H ATOM 644 N ASN A 165 28.314 6.851 18.246 1.00 15.61 N ATOM 645 CA ASN A 165 29.043 7.254 19.444 1.00 19.43 C ATOM 646 C ASN A 165 29.621 8.663 19.330 1.00 24.96 C ATOM 647 O ASN A 165 29.933 9.273 20.361 1.00 24.26 O ATOM 648 CB ASN A 165 30.133 6.240 19.807 1.00 20.22 C ATOM 649 CG ASN A 165 29.580 4.992 20.486 1.00 21.90 C ATOM 650 OD1 ASN A 165 28.489 5.006 21.060 1.00 25.33 O ATOM 651 ND2 ASN A 165 30.345 3.909 20.437 1.00 22.19 N ATOM 652 HD22 ASN A 165 31.259 3.940 19.942 1.00 0.00 H ATOM 653 HD21 ASN A 165 30.031 3.029 20.894 1.00 0.00 H ATOM 654 H ASN A 165 28.679 6.093 17.635 1.00 0.00 H ATOM 655 N MET A 166 29.763 9.199 18.109 1.00 18.53 N ATOM 656 CA MET A 166 30.231 10.577 17.936 1.00 18.14 C ATOM 657 C MET A 166 29.110 11.617 17.912 1.00 16.91 C ATOM 658 O MET A 166 29.406 12.817 17.871 1.00 24.16 O ATOM 659 CB MET A 166 31.054 10.689 16.642 1.00 24.35 C ATOM 660 CG MET A 166 32.360 9.920 16.659 1.00 30.91 C ATOM 661 SD MET A 166 33.487 10.463 15.340 1.00 33.40 S ATOM 662 CE MET A 166 32.668 9.817 13.886 1.00 33.51 C ATOM 663 H MET A 166 29.537 8.627 17.270 1.00 0.00 H ATOM 664 N VAL A 167 27.842 11.193 17.879 1.00 17.81 N ATOM 665 CA VAL A 167 26.723 12.129 17.936 1.00 16.98 C ATOM 666 C VAL A 167 26.651 12.731 19.334 1.00 16.87 C ATOM 667 O VAL A 167 26.804 12.027 20.338 1.00 20.53 O ATOM 668 CB VAL A 167 25.421 11.393 17.576 1.00 15.78 C ATOM 669 CG1 VAL A 167 24.209 12.314 17.716 1.00 14.12 C ATOM 670 CG2 VAL A 167 25.503 10.821 16.148 1.00 19.16 C ATOM 671 H VAL A 167 27.649 10.173 17.811 1.00 0.00 H ATOM 672 N ALA A 168 26.440 14.037 19.404 1.00 17.89 N ATOM 673 CA ALA A 168 26.404 14.710 20.698 1.00 19.71 C ATOM 674 C ALA A 168 25.121 14.336 21.446 1.00 21.01 C ATOM 675 O ALA A 168 24.081 14.117 20.830 1.00 20.80 O ATOM 676 CB ALA A 168 26.471 16.220 20.499 1.00 21.98 C ATOM 677 H ALA A 168 26.299 14.586 18.532 1.00 0.00 H ATOM 678 N PRO A 169 25.169 14.252 22.779 1.00 19.98 N ATOM 679 CA PRO A 169 23.964 13.828 23.530 1.00 20.44 C ATOM 680 C PRO A 169 22.701 14.658 23.301 1.00 22.61 C ATOM 681 O PRO A 169 21.596 14.113 23.411 1.00 26.93 O ATOM 682 CB PRO A 169 24.422 13.858 24.998 1.00 23.31 C ATOM 683 CG PRO A 169 25.747 14.555 25.002 1.00 30.61 C ATOM 684 CD PRO A 169 26.353 14.337 23.648 1.00 24.37 C ATOM 685 N GLY A 170 22.803 15.935 22.980 1.00 21.53 N ATOM 686 CA GLY A 170 21.544 16.665 22.813 1.00 25.23 C ATOM 687 C GLY A 170 20.797 16.456 21.496 1.00 17.50 C ATOM 688 O GLY A 170 19.648 16.892 21.365 1.00 16.44 O ATOM 689 H GLY A 170 23.726 16.397 22.853 1.00 0.00 H ATOM 690 N ARG A 171 21.410 15.803 20.522 1.00 18.71 N ATOM 691 CA ARG A 171 20.831 15.763 19.190 1.00 13.25 C ATOM 692 C ARG A 171 19.548 14.937 19.148 1.00 16.57 C ATOM 693 O ARG A 171 19.336 14.032 19.948 1.00 17.23 O ATOM 694 CB ARG A 171 21.813 15.107 18.215 1.00 13.12 C ATOM 695 CG ARG A 171 23.155 15.830 18.049 1.00 18.11 C ATOM 696 CD ARG A 171 22.971 17.261 17.668 1.00 19.03 C ATOM 697 NE ARG A 171 24.161 17.794 17.003 1.00 17.80 N ATOM 698 CZ ARG A 171 24.419 19.084 16.854 1.00 18.71 C ATOM 699 NH1 ARG A 171 23.585 20.004 17.329 1.00 16.22 N ATOM 700 NH2 ARG A 171 25.514 19.453 16.208 1.00 20.70 N ATOM 701 HE ARG A 171 24.850 17.114 16.622 1.00 0.00 H ATOM 702 HH12 ARG A 171 23.800 21.014 17.205 1.00 0.00 H ATOM 703 HH11 ARG A 171 22.718 19.714 17.824 1.00 0.00 H ATOM 704 HH22 ARG A 171 25.729 20.463 16.084 1.00 0.00 H ATOM 705 HH21 ARG A 171 26.159 18.733 15.825 1.00 0.00 H ATOM 706 H ARG A 171 22.310 15.317 20.711 1.00 0.00 H ATOM 707 N VAL A 172 18.712 15.222 18.136 1.00 13.52 N ATOM 708 CA VAL A 172 17.556 14.380 17.835 1.00 13.42 C ATOM 709 C VAL A 172 18.024 13.294 16.869 1.00 15.22 C ATOM 710 O VAL A 172 18.620 13.590 15.824 1.00 15.14 O ATOM 711 CB VAL A 172 16.419 15.208 17.208 1.00 15.93 C ATOM 712 CG1 VAL A 172 15.211 14.301 16.895 1.00 17.70 C ATOM 713 CG2 VAL A 172 16.017 16.373 18.108 1.00 23.52 C ATOM 714 H VAL A 172 18.892 16.063 17.552 1.00 0.00 H ATOM 715 N LEU A 173 17.721 12.038 17.205 1.00 15.31 N ATOM 716 CA LEU A 173 18.127 10.862 16.447 1.00 13.23 C ATOM 717 C LEU A 173 16.882 10.195 15.882 1.00 12.53 C ATOM 718 O LEU A 173 15.923 9.920 16.614 1.00 14.94 O ATOM 719 CB LEU A 173 18.840 9.885 17.384 1.00 18.33 C ATOM 720 CG LEU A 173 19.817 8.867 16.837 1.00 29.29 C ATOM 721 CD1 LEU A 173 20.740 9.513 15.821 1.00 36.53 C ATOM 722 CD2 LEU A 173 20.616 8.336 18.016 1.00 36.51 C ATOM 723 H LEU A 173 17.157 11.889 18.066 1.00 0.00 H ATOM 724 N ILE A 174 16.900 9.932 14.576 1.00 12.60 N ATOM 725 CA ILE A 174 15.798 9.282 13.869 1.00 14.84 C ATOM 726 C ILE A 174 16.346 8.060 13.147 1.00 14.43 C ATOM 727 O ILE A 174 17.346 8.158 12.420 1.00 17.63 O ATOM 728 CB ILE A 174 15.134 10.252 12.867 1.00 12.69 C ATOM 729 CG1 ILE A 174 14.540 11.450 13.617 1.00 15.85 C ATOM 730 CG2 ILE A 174 14.088 9.525 12.002 1.00 14.01 C ATOM 731 CD1 ILE A 174 14.187 12.655 12.698 1.00 18.97 C ATOM 732 H ILE A 174 17.743 10.204 14.031 1.00 0.00 H ATOM 733 N CYS A 175 15.699 6.912 13.339 1.00 12.53 N ATOM 734 CA CYS A 175 16.055 5.682 12.648 1.00 15.84 C ATOM 735 C CYS A 175 14.839 5.085 11.954 1.00 14.83 C ATOM 736 O CYS A 175 13.721 5.120 12.480 1.00 15.04 O ATOM 737 CB CYS A 175 16.625 4.624 13.578 1.00 14.11 C ATOM 738 SG CYS A 175 18.089 5.106 14.549 1.00 17.47 S ATOM 739 H CYS A 175 14.906 6.894 14.011 1.00 0.00 H ATOM 740 N THR A 176 15.057 4.524 10.772 1.00 13.55 N ATOM 741 CA THR A 176 13.988 3.833 10.069 1.00 12.42 C ATOM 742 C THR A 176 14.570 2.730 9.190 1.00 12.11 C ATOM 743 O THR A 176 15.618 2.908 8.568 1.00 15.67 O ATOM 744 CB THR A 176 13.095 4.814 9.298 1.00 13.83 C ATOM 745 OG1 THR A 176 12.008 4.078 8.760 1.00 15.76 O ATOM 746 CG2 THR A 176 13.845 5.545 8.214 1.00 16.97 C ATOM 747 HG1 THR A 176 11.414 4.689 8.256 1.00 0.00 H ATOM 748 H THR A 176 16.003 4.579 10.343 1.00 0.00 H ATOM 749 N VAL A 177 13.907 1.574 9.164 1.00 11.77 N ATOM 750 CA VAL A 177 14.401 0.397 8.444 1.00 13.26 C ATOM 751 C VAL A 177 13.740 0.276 7.074 1.00 15.45 C ATOM 752 O VAL A 177 12.520 0.428 6.934 1.00 15.86 O ATOM 753 CB VAL A 177 14.153 -0.873 9.277 1.00 14.27 C ATOM 754 CG1 VAL A 177 14.441 -2.132 8.470 1.00 16.08 C ATOM 755 CG2 VAL A 177 15.031 -0.835 10.528 1.00 16.74 C ATOM 756 H VAL A 177 13.004 1.505 9.675 1.00 0.00 H ATOM 757 N LYS A 178 14.546 -0.043 6.068 1.00 14.78 N ATOM 758 CA LYS A 178 14.054 -0.418 4.742 1.00 13.23 C ATOM 759 C LYS A 178 14.444 -1.862 4.471 1.00 15.27 C ATOM 760 O LYS A 178 15.631 -2.195 4.494 1.00 15.13 O ATOM 761 CB LYS A 178 14.641 0.491 3.662 1.00 17.85 C ATOM 762 CG LYS A 178 13.962 0.300 2.282 1.00 17.82 C ATOM 763 CD LYS A 178 14.550 1.200 1.240 1.00 19.81 C ATOM 764 CE LYS A 178 13.869 0.949 -0.111 1.00 26.12 C ATOM 765 NZ LYS A 178 14.525 1.691 -1.220 1.00 24.45 N ATOM 766 HZ1 LYS A 178 14.486 2.712 -1.024 1.00 0.00 H ATOM 767 HZ2 LYS A 178 15.517 1.390 -1.298 1.00 0.00 H ATOM 768 HZ3 LYS A 178 14.029 1.489 -2.112 1.00 0.00 H ATOM 769 H LYS A 178 15.573 -0.026 6.230 1.00 0.00 H ATOM 770 N ASP A 179 13.447 -2.710 4.195 1.00 17.17 N ATOM 771 CA ASP A 179 13.640 -4.106 3.783 1.00 18.75 C ATOM 772 C ASP A 179 14.091 -4.999 4.937 1.00 20.51 C ATOM 773 O ASP A 179 13.285 -5.778 5.459 1.00 18.89 O ATOM 774 CB ASP A 179 14.555 -4.226 2.541 1.00 18.35 C ATOM 775 CG ASP A 179 14.892 -5.675 2.172 1.00 18.76 C ATOM 776 OD1 ASP A 179 14.162 -6.629 2.546 1.00 20.14 O ATOM 777 OD2 ASP A 179 15.919 -5.867 1.497 1.00 20.08 O ATOM 778 H ASP A 179 12.472 -2.358 4.278 1.00 0.00 H ATOM 779 N GLU A 180 15.367 -4.931 5.316 1.00 15.86 N ATOM 780 CA GLU A 180 15.893 -5.823 6.348 1.00 14.82 C ATOM 781 C GLU A 180 17.036 -5.119 7.059 1.00 15.87 C ATOM 782 O GLU A 180 17.984 -4.675 6.405 1.00 16.65 O ATOM 783 CB GLU A 180 16.422 -7.125 5.714 1.00 14.34 C ATOM 784 CG GLU A 180 16.200 -8.375 6.554 1.00 15.10 C ATOM 785 CD GLU A 180 16.912 -8.328 7.901 1.00 14.79 C ATOM 786 OE1 GLU A 180 18.160 -8.336 7.920 1.00 15.69 O ATOM 787 OE2 GLU A 180 16.214 -8.271 8.935 1.00 16.94 O ATOM 788 H GLU A 180 15.997 -4.234 4.871 1.00 0.00 H ATOM 789 N GLY A 181 16.959 -5.039 8.388 1.00 13.03 N ATOM 790 CA GLY A 181 17.997 -4.357 9.149 1.00 13.91 C ATOM 791 C GLY A 181 18.597 -5.158 10.302 1.00 14.65 C ATOM 792 O GLY A 181 19.354 -4.604 11.121 1.00 15.27 O ATOM 793 H GLY A 181 16.152 -5.467 8.885 1.00 0.00 H ATOM 794 N SER A 182 18.277 -6.457 10.381 1.00 14.59 N ATOM 795 CA SER A 182 18.591 -7.243 11.573 1.00 11.94 C ATOM 796 C SER A 182 19.653 -8.323 11.400 1.00 12.57 C ATOM 797 O SER A 182 20.281 -8.694 12.385 1.00 13.44 O ATOM 798 CB SER A 182 17.323 -7.908 12.125 1.00 13.64 C ATOM 799 OG SER A 182 16.968 -9.005 11.317 1.00 16.17 O ATOM 800 HG SER A 182 16.798 -8.692 10.393 1.00 0.00 H ATOM 801 H SER A 182 17.797 -6.914 9.580 1.00 0.00 H ATOM 802 N PHE A 183 19.867 -8.867 10.190 1.00 11.71 N ATOM 803 CA PHE A 183 20.674 -10.087 10.082 1.00 12.77 C ATOM 804 C PHE A 183 22.048 -9.921 10.715 1.00 14.01 C ATOM 805 O PHE A 183 22.504 -10.801 11.456 1.00 14.64 O ATOM 806 CB PHE A 183 20.760 -10.511 8.601 1.00 12.54 C ATOM 807 CG PHE A 183 21.527 -11.795 8.334 1.00 12.80 C ATOM 808 CD1 PHE A 183 21.683 -12.788 9.296 1.00 15.18 C ATOM 809 CD2 PHE A 183 22.071 -12.020 7.086 1.00 13.35 C ATOM 810 CE1 PHE A 183 22.390 -13.946 9.018 1.00 14.00 C ATOM 811 CE2 PHE A 183 22.784 -13.182 6.807 1.00 14.17 C ATOM 812 CZ PHE A 183 22.934 -14.138 7.773 1.00 16.98 C ATOM 813 H PHE A 183 19.464 -8.427 9.338 1.00 0.00 H ATOM 814 N HIS A 184 22.685 -8.779 10.493 1.00 13.14 N ATOM 815 CA HIS A 184 23.987 -8.462 11.068 1.00 14.81 C ATOM 816 C HIS A 184 23.942 -7.254 11.996 1.00 13.76 C ATOM 817 O HIS A 184 24.907 -6.490 12.082 1.00 13.42 O ATOM 818 CB HIS A 184 25.063 -8.324 9.989 1.00 14.54 C ATOM 819 CG HIS A 184 25.420 -9.632 9.379 1.00 12.96 C ATOM 820 ND1 HIS A 184 26.409 -10.444 9.890 1.00 15.67 N ATOM 821 CD2 HIS A 184 24.855 -10.318 8.359 1.00 14.42 C ATOM 822 CE1 HIS A 184 26.471 -11.555 9.175 1.00 17.44 C ATOM 823 NE2 HIS A 184 25.522 -11.513 8.256 1.00 16.50 N ATOM 824 H HIS A 184 22.233 -8.073 9.877 1.00 0.00 H ATOM 825 N LEU A 185 22.829 -7.083 12.713 1.00 14.82 N ATOM 826 CA LEU A 185 22.756 -6.121 13.822 1.00 11.38 C ATOM 827 C LEU A 185 23.166 -6.876 15.075 1.00 16.14 C ATOM 828 O LEU A 185 22.374 -7.590 15.676 1.00 15.15 O ATOM 829 CB LEU A 185 21.335 -5.581 13.953 1.00 15.70 C ATOM 830 CG LEU A 185 21.135 -4.406 14.903 1.00 15.46 C ATOM 831 CD1 LEU A 185 21.785 -3.164 14.359 1.00 16.91 C ATOM 832 CD2 LEU A 185 19.654 -4.142 15.160 1.00 17.44 C ATOM 833 H LEU A 185 21.988 -7.648 12.480 1.00 0.00 H ATOM 834 N LYS A 186 24.426 -6.769 15.430 1.00 13.88 N ATOM 835 CA LYS A 186 24.971 -7.661 16.441 1.00 12.90 C ATOM 836 C LYS A 186 24.895 -7.016 17.825 1.00 14.60 C ATOM 837 O LYS A 186 24.316 -5.944 18.005 1.00 15.68 O ATOM 838 CB LYS A 186 26.341 -8.184 16.022 1.00 13.57 C ATOM 839 CG LYS A 186 26.290 -9.021 14.725 1.00 14.62 C ATOM 840 CD LYS A 186 25.115 -10.007 14.665 1.00 14.55 C ATOM 841 CE LYS A 186 25.366 -11.073 13.587 1.00 14.17 C ATOM 842 NZ LYS A 186 24.207 -12.033 13.446 1.00 16.97 N ATOM 843 HZ1 LYS A 186 24.050 -12.521 14.351 1.00 0.00 H ATOM 844 HZ2 LYS A 186 23.351 -11.505 13.183 1.00 0.00 H ATOM 845 HZ3 LYS A 186 24.425 -12.732 12.707 1.00 0.00 H ATOM 846 H LYS A 186 25.032 -6.048 14.989 1.00 0.00 H ATOM 847 N ASP A 187 25.515 -7.656 18.811 1.00 16.19 N ATOM 848 CA ASP A 187 25.196 -7.334 20.200 1.00 15.21 C ATOM 849 C ASP A 187 25.646 -5.936 20.597 1.00 18.31 C ATOM 850 O ASP A 187 24.964 -5.268 21.385 1.00 18.69 O ATOM 851 CB ASP A 187 25.720 -8.430 21.121 1.00 22.26 C ATOM 852 CG ASP A 187 24.838 -9.687 21.074 1.00 21.62 C ATOM 853 OD1 ASP A 187 23.793 -9.648 20.399 1.00 28.27 O ATOM 854 OD2 ASP A 187 25.172 -10.684 21.749 1.00 32.88 O ATOM 855 H ASP A 187 26.225 -8.384 18.594 1.00 0.00 H ATOM 856 N THR A 188 26.787 -5.466 20.094 1.00 17.61 N ATOM 857 CA THR A 188 27.245 -4.148 20.527 1.00 16.92 C ATOM 858 C THR A 188 26.330 -3.052 19.996 1.00 16.79 C ATOM 859 O THR A 188 26.026 -2.079 20.703 1.00 16.82 O ATOM 860 CB THR A 188 28.708 -3.915 20.130 1.00 22.29 C ATOM 861 OG1 THR A 188 29.558 -4.868 20.795 1.00 27.26 O ATOM 862 CG2 THR A 188 29.157 -2.530 20.543 1.00 24.15 C ATOM 863 HG1 THR A 188 29.292 -5.785 20.534 1.00 0.00 H ATOM 864 H THR A 188 27.338 -6.024 19.410 1.00 0.00 H ATOM 865 N ALA A 189 25.880 -3.185 18.744 1.00 14.78 N ATOM 866 CA ALA A 189 24.936 -2.221 18.205 1.00 14.80 C ATOM 867 C ALA A 189 23.598 -2.286 18.933 1.00 16.92 C ATOM 868 O ALA A 189 23.013 -1.243 19.245 1.00 17.89 O ATOM 869 CB ALA A 189 24.764 -2.441 16.689 1.00 13.78 C ATOM 870 H ALA A 189 26.206 -3.979 18.156 1.00 0.00 H ATOM 871 N LYS A 190 23.102 -3.497 19.217 1.00 14.63 N ATOM 872 CA LYS A 190 21.857 -3.630 19.972 1.00 13.97 C ATOM 873 C LYS A 190 21.962 -2.988 21.347 1.00 16.37 C ATOM 874 O LYS A 190 21.024 -2.320 21.793 1.00 17.87 O ATOM 875 CB LYS A 190 21.447 -5.097 20.069 1.00 16.16 C ATOM 876 CG LYS A 190 20.879 -5.649 18.746 1.00 15.83 C ATOM 877 CD LYS A 190 20.551 -7.130 18.909 1.00 20.48 C ATOM 878 CE LYS A 190 19.904 -7.706 17.653 1.00 37.10 C ATOM 879 NZ LYS A 190 19.856 -9.198 17.720 1.00 33.64 N ATOM 880 HZ1 LYS A 190 20.823 -9.571 17.802 1.00 0.00 H ATOM 881 HZ2 LYS A 190 19.299 -9.489 18.549 1.00 0.00 H ATOM 882 HZ3 LYS A 190 19.412 -9.569 16.856 1.00 0.00 H ATOM 883 H LYS A 190 23.606 -4.349 18.898 1.00 0.00 H ATOM 884 N ALA A 191 23.097 -3.170 22.020 1.00 16.72 N ATOM 885 CA ALA A 191 23.292 -2.544 23.328 1.00 16.06 C ATOM 886 C ALA A 191 23.319 -1.028 23.218 1.00 17.91 C ATOM 887 O ALA A 191 22.825 -0.327 24.112 1.00 21.45 O ATOM 888 CB ALA A 191 24.590 -3.049 23.966 1.00 20.52 C ATOM 889 H ALA A 191 23.850 -3.761 21.613 1.00 0.00 H ATOM 890 N LEU A 192 23.850 -0.498 22.116 1.00 17.97 N ATOM 891 CA LEU A 192 23.862 0.950 21.944 1.00 18.16 C ATOM 892 C LEU A 192 22.449 1.472 21.741 1.00 15.58 C ATOM 893 O LEU A 192 22.040 2.448 22.387 1.00 19.61 O ATOM 894 CB LEU A 192 24.802 1.336 20.796 1.00 18.45 C ATOM 895 CG LEU A 192 25.027 2.823 20.579 1.00 19.04 C ATOM 896 CD1 LEU A 192 25.366 3.490 21.918 1.00 31.31 C ATOM 897 CD2 LEU A 192 26.155 3.002 19.579 1.00 21.14 C ATOM 898 H LEU A 192 24.254 -1.115 21.382 1.00 0.00 H ATOM 899 N LEU A 193 21.657 0.776 20.924 1.00 15.44 N ATOM 900 CA LEU A 193 20.253 1.153 20.768 1.00 15.63 C ATOM 901 C LEU A 193 19.499 1.059 22.086 1.00 16.89 C ATOM 902 O LEU A 193 18.666 1.919 22.382 1.00 20.79 O ATOM 903 CB LEU A 193 19.578 0.315 19.679 1.00 17.60 C ATOM 904 CG LEU A 193 20.144 0.457 18.261 1.00 19.16 C ATOM 905 CD1 LEU A 193 19.453 -0.516 17.327 1.00 16.93 C ATOM 906 CD2 LEU A 193 20.010 1.881 17.743 1.00 21.56 C ATOM 907 H LEU A 193 22.039 -0.036 20.397 1.00 0.00 H ATOM 908 N ARG A 194 19.794 0.037 22.903 1.00 19.08 N ATOM 909 CA ARG A 194 19.160 -0.069 24.214 1.00 16.49 C ATOM 910 C ARG A 194 19.531 1.113 25.102 1.00 21.06 C ATOM 911 O ARG A 194 18.690 1.619 25.859 1.00 20.73 O ATOM 912 CB ARG A 194 19.567 -1.385 24.884 1.00 18.64 C ATOM 913 CG ARG A 194 18.913 -1.640 26.236 1.00 24.16 C ATOM 914 CD ARG A 194 19.343 -2.993 26.820 1.00 26.98 C ATOM 915 NE ARG A 194 18.864 -4.120 26.014 1.00 36.40 N ATOM 916 CZ ARG A 194 19.610 -4.825 25.162 1.00 35.77 C ATOM 917 NH1 ARG A 194 20.902 -4.542 24.978 1.00 37.18 N ATOM 918 NH2 ARG A 194 19.061 -5.832 24.489 1.00 44.09 N ATOM 919 HE ARG A 194 17.865 -4.391 26.114 1.00 0.00 H ATOM 920 HH12 ARG A 194 21.467 -5.103 24.309 1.00 0.00 H ATOM 921 HH11 ARG A 194 21.343 -3.760 25.503 1.00 0.00 H ATOM 922 HH22 ARG A 194 19.636 -6.387 23.823 1.00 0.00 H ATOM 923 HH21 ARG A 194 18.057 -6.065 24.629 1.00 0.00 H ATOM 924 H ARG A 194 20.479 -0.685 22.601 1.00 0.00 H ATOM 925 N SER A 195 20.784 1.580 25.014 1.00 21.12 N ATOM 926 CA SER A 195 21.208 2.718 25.828 1.00 21.89 C ATOM 927 C SER A 195 20.510 4.010 25.430 1.00 23.10 C ATOM 928 O SER A 195 20.427 4.927 26.253 1.00 27.23 O ATOM 929 CB SER A 195 22.727 2.916 25.750 1.00 24.51 C ATOM 930 OG SER A 195 23.096 3.625 24.574 1.00 27.24 O ATOM 931 HG SER A 195 22.803 3.116 23.777 1.00 0.00 H ATOM 932 H SER A 195 21.459 1.130 24.363 1.00 0.00 H ATOM 933 N LEU A 196 20.031 4.117 24.190 1.00 22.01 N ATOM 934 CA LEU A 196 19.220 5.265 23.801 1.00 22.81 C ATOM 935 C LEU A 196 17.804 5.195 24.350 1.00 36.51 C ATOM 936 O LEU A 196 17.061 6.176 24.237 1.00 38.07 O ATOM 937 CB LEU A 196 19.112 5.339 22.281 1.00 29.35 C ATOM 938 CG LEU A 196 20.400 5.375 21.474 1.00 30.47 C ATOM 939 CD1 LEU A 196 20.024 5.461 20.008 1.00 28.96 C ATOM 940 CD2 LEU A 196 21.294 6.529 21.862 1.00 28.40 C ATOM 941 H LEU A 196 20.238 3.374 23.493 1.00 0.00 H ATOM 942 N GLY A 197 17.410 4.066 24.926 1.00 21.24 N ATOM 943 CA GLY A 197 16.048 3.870 25.353 1.00 24.89 C ATOM 944 C GLY A 197 15.170 3.120 24.375 1.00 22.65 C ATOM 945 O GLY A 197 13.995 2.898 24.685 1.00 23.01 O ATOM 946 H GLY A 197 18.102 3.304 25.073 1.00 0.00 H ATOM 947 N SER A 198 15.691 2.734 23.207 1.00 20.98 N ATOM 948 CA SER A 198 14.867 2.032 22.231 1.00 18.86 C ATOM 949 C SER A 198 14.418 0.687 22.773 1.00 20.05 C ATOM 950 O SER A 198 15.219 -0.088 23.298 1.00 23.58 O ATOM 951 CB SER A 198 15.646 1.808 20.938 1.00 18.59 C ATOM 952 OG SER A 198 14.881 1.026 20.030 1.00 18.21 O ATOM 953 HG SER A 198 14.036 1.497 19.821 1.00 0.00 H ATOM 954 H SER A 198 16.689 2.935 22.993 1.00 0.00 H ATOM 955 N GLN A 199 13.129 0.411 22.624 1.00 22.80 N ATOM 956 CA GLN A 199 12.550 -0.853 23.041 1.00 30.39 C ATOM 957 C GLN A 199 12.600 -1.883 21.927 1.00 28.20 C ATOM 958 O GLN A 199 12.851 -3.064 22.189 1.00 27.70 O ATOM 959 CB GLN A 199 11.101 -0.639 23.483 1.00 26.78 C ATOM 960 CG GLN A 199 10.975 0.393 24.583 1.00 28.50 C ATOM 961 CD GLN A 199 11.683 -0.038 25.845 1.00 34.30 C ATOM 962 OE1 GLN A 199 11.376 -1.086 26.415 1.00 40.92 O ATOM 963 NE2 GLN A 199 12.648 0.759 26.284 1.00 37.92 N ATOM 964 HE22 GLN A 199 12.873 1.635 25.770 1.00 0.00 H ATOM 965 HE21 GLN A 199 13.180 0.508 27.142 1.00 0.00 H ATOM 966 H GLN A 199 12.510 1.127 22.192 1.00 0.00 H ATOM 967 N ALA A 200 12.386 -1.448 20.685 1.00 19.01 N ATOM 968 CA ALA A 200 12.297 -2.362 19.558 1.00 22.26 C ATOM 969 C ALA A 200 13.638 -2.588 18.890 1.00 28.98 C ATOM 970 O ALA A 200 13.879 -3.671 18.340 1.00 24.10 O ATOM 971 CB ALA A 200 11.335 -1.806 18.507 1.00 23.88 C ATOM 972 H ALA A 200 12.280 -0.427 20.518 1.00 0.00 H ATOM 973 N GLY A 201 14.505 -1.585 18.896 1.00 20.22 N ATOM 974 CA GLY A 201 15.796 -1.709 18.254 1.00 22.00 C ATOM 975 C GLY A 201 16.610 -2.895 18.748 1.00 18.92 C ATOM 976 O GLY A 201 17.134 -3.686 17.957 1.00 19.66 O ATOM 977 H GLY A 201 14.253 -0.694 19.370 1.00 0.00 H ATOM 978 N PRO A 202 16.742 -3.058 20.064 1.00 19.12 N ATOM 979 CA PRO A 202 17.567 -4.169 20.556 1.00 18.86 C ATOM 980 C PRO A 202 16.982 -5.530 20.251 1.00 18.71 C ATOM 981 O PRO A 202 17.701 -6.531 20.368 1.00 23.45 O ATOM 982 CB PRO A 202 17.654 -3.911 22.066 1.00 20.01 C ATOM 983 CG PRO A 202 17.345 -2.471 22.214 1.00 19.38 C ATOM 984 CD PRO A 202 16.349 -2.152 21.157 1.00 19.09 C ATOM 985 N ALA A 203 15.716 -5.598 19.845 1.00 17.69 N ATOM 986 CA ALA A 203 15.037 -6.853 19.561 1.00 22.63 C ATOM 987 C ALA A 203 14.701 -6.999 18.085 1.00 19.29 C ATOM 988 O ALA A 203 13.939 -7.900 17.710 1.00 20.27 O ATOM 989 CB ALA A 203 13.766 -6.961 20.408 1.00 26.64 C ATOM 990 H ALA A 203 15.187 -4.711 19.725 1.00 0.00 H ATOM 991 N LEU A 204 15.242 -6.127 17.246 1.00 15.86 N ATOM 992 CA LEU A 204 14.882 -6.145 15.836 1.00 15.11 C ATOM 993 C LEU A 204 15.174 -7.513 15.233 1.00 15.52 C ATOM 994 O LEU A 204 16.253 -8.084 15.436 1.00 17.67 O ATOM 995 CB LEU A 204 15.661 -5.058 15.112 1.00 13.61 C ATOM 996 CG LEU A 204 15.173 -4.757 13.699 1.00 12.83 C ATOM 997 CD1 LEU A 204 13.825 -3.998 13.686 1.00 14.85 C ATOM 998 CD2 LEU A 204 16.272 -3.960 12.971 1.00 16.59 C ATOM 999 H LEU A 204 15.927 -5.427 17.597 1.00 0.00 H ATOM 1000 N GLY A 205 14.204 -8.023 14.474 1.00 16.28 N ATOM 1001 CA GLY A 205 14.274 -9.326 13.856 1.00 15.83 C ATOM 1002 C GLY A 205 14.101 -9.268 12.348 1.00 16.69 C ATOM 1003 O GLY A 205 13.954 -8.198 11.749 1.00 15.97 O ATOM 1004 H GLY A 205 13.350 -7.451 14.318 1.00 0.00 H ATOM 1005 N TRP A 206 14.125 -10.463 11.747 1.00 16.55 N ATOM 1006 CA TRP A 206 14.188 -10.643 10.303 1.00 14.02 C ATOM 1007 C TRP A 206 13.022 -9.966 9.598 1.00 15.72 C ATOM 1008 O TRP A 206 11.858 -10.346 9.792 1.00 17.69 O ATOM 1009 CB TRP A 206 14.187 -12.139 9.988 1.00 17.98 C ATOM 1010 CG TRP A 206 14.177 -12.480 8.519 1.00 18.67 C ATOM 1011 CD1 TRP A 206 13.111 -12.899 7.789 1.00 17.40 C ATOM 1012 CD2 TRP A 206 15.294 -12.446 7.614 1.00 17.17 C ATOM 1013 NE1 TRP A 206 13.483 -13.115 6.463 1.00 18.82 N ATOM 1014 CE2 TRP A 206 14.826 -12.862 6.343 1.00 18.18 C ATOM 1015 CE3 TRP A 206 16.643 -12.105 7.760 1.00 16.82 C ATOM 1016 CZ2 TRP A 206 15.666 -12.932 5.234 1.00 18.26 C ATOM 1017 CZ3 TRP A 206 17.483 -12.209 6.684 1.00 18.11 C ATOM 1018 CH2 TRP A 206 16.989 -12.609 5.420 1.00 19.56 C ATOM 1019 HE1 TRP A 206 12.850 -13.417 5.695 1.00 0.00 H ATOM 1020 H TRP A 206 14.097 -11.313 12.346 1.00 0.00 H ATOM 1021 N ARG A 207 13.324 -8.934 8.816 1.00 15.44 N ATOM 1022 CA ARG A 207 12.342 -8.215 8.001 1.00 15.37 C ATOM 1023 C ARG A 207 11.322 -7.448 8.820 1.00 17.86 C ATOM 1024 O ARG A 207 10.272 -7.084 8.296 1.00 17.74 O ATOM 1025 CB ARG A 207 11.626 -9.116 6.986 1.00 15.91 C ATOM 1026 CG ARG A 207 12.581 -9.643 5.933 1.00 17.01 C ATOM 1027 CD ARG A 207 11.887 -10.610 5.007 1.00 20.21 C ATOM 1028 NE ARG A 207 12.713 -10.857 3.828 1.00 18.60 N ATOM 1029 CZ ARG A 207 12.347 -11.662 2.838 1.00 20.61 C ATOM 1030 NH1 ARG A 207 13.145 -11.835 1.792 1.00 23.81 N ATOM 1031 NH2 ARG A 207 11.175 -12.285 2.910 1.00 21.83 N ATOM 1032 HE ARG A 207 13.634 -10.378 3.761 1.00 0.00 H ATOM 1033 HH12 ARG A 207 12.857 -12.466 1.017 1.00 0.00 H ATOM 1034 HH11 ARG A 207 14.058 -11.340 1.747 1.00 0.00 H ATOM 1035 HH22 ARG A 207 10.875 -12.919 2.142 1.00 0.00 H ATOM 1036 HH21 ARG A 207 10.558 -12.139 3.734 1.00 0.00 H ATOM 1037 H ARG A 207 14.315 -8.619 8.781 1.00 0.00 H ATOM 1038 N ASP A 208 11.589 -7.213 10.105 1.00 16.15 N ATOM 1039 CA ASP A 208 10.741 -6.343 10.906 1.00 16.94 C ATOM 1040 C ASP A 208 10.861 -4.906 10.410 1.00 14.94 C ATOM 1041 O ASP A 208 11.920 -4.471 9.946 1.00 17.02 O ATOM 1042 CB ASP A 208 11.247 -6.305 12.356 1.00 16.27 C ATOM 1043 CG ASP A 208 11.003 -7.589 13.130 1.00 17.77 C ATOM 1044 OD1 ASP A 208 10.497 -8.578 12.560 1.00 21.35 O ATOM 1045 OD2 ASP A 208 11.333 -7.575 14.347 1.00 21.42 O ATOM 1046 H ASP A 208 12.419 -7.660 10.543 1.00 0.00 H ATOM 1047 N THR A 209 9.791 -4.146 10.587 1.00 15.86 N ATOM 1048 CA THR A 209 9.819 -2.708 10.343 1.00 14.87 C ATOM 1049 C THR A 209 9.956 -1.960 11.658 1.00 15.93 C ATOM 1050 O THR A 209 9.561 -2.455 12.716 1.00 16.35 O ATOM 1051 CB THR A 209 8.565 -2.247 9.602 1.00 16.28 C ATOM 1052 OG1 THR A 209 7.403 -2.706 10.309 1.00 20.01 O ATOM 1053 CG2 THR A 209 8.563 -2.814 8.197 1.00 19.32 C ATOM 1054 HG1 THR A 209 6.589 -2.409 9.831 1.00 0.00 H ATOM 1055 H THR A 209 8.906 -4.587 10.909 1.00 0.00 H ATOM 1056 N TRP A 210 10.576 -0.779 11.593 1.00 15.94 N ATOM 1057 CA TRP A 210 10.943 -0.067 12.814 1.00 13.76 C ATOM 1058 C TRP A 210 11.158 1.409 12.495 1.00 18.38 C ATOM 1059 O TRP A 210 11.902 1.748 11.568 1.00 15.24 O ATOM 1060 CB TRP A 210 12.223 -0.684 13.420 1.00 13.92 C ATOM 1061 CG TRP A 210 12.759 0.036 14.639 1.00 16.50 C ATOM 1062 CD1 TRP A 210 12.049 0.437 15.751 1.00 17.73 C ATOM 1063 CD2 TRP A 210 14.109 0.470 14.853 1.00 13.86 C ATOM 1064 NE1 TRP A 210 12.882 1.078 16.635 1.00 16.95 N ATOM 1065 CE2 TRP A 210 14.151 1.100 16.124 1.00 16.60 C ATOM 1066 CE3 TRP A 210 15.294 0.347 14.122 1.00 13.78 C ATOM 1067 CZ2 TRP A 210 15.320 1.648 16.647 1.00 16.38 C ATOM 1068 CZ3 TRP A 210 16.458 0.909 14.641 1.00 16.02 C ATOM 1069 CH2 TRP A 210 16.460 1.533 15.904 1.00 15.61 C ATOM 1070 HE1 TRP A 210 12.594 1.483 17.549 1.00 0.00 H ATOM 1071 H TRP A 210 10.799 -0.363 10.666 1.00 0.00 H ATOM 1072 N ALA A 211 10.496 2.283 13.263 1.00 17.09 N ATOM 1073 CA ALA A 211 10.687 3.727 13.191 1.00 15.66 C ATOM 1074 C ALA A 211 10.937 4.255 14.595 1.00 15.79 C ATOM 1075 O ALA A 211 10.252 3.854 15.538 1.00 18.35 O ATOM 1076 CB ALA A 211 9.434 4.409 12.645 1.00 19.47 C ATOM 1077 H ALA A 211 9.808 1.912 13.949 1.00 0.00 H ATOM 1078 N PHE A 212 11.878 5.186 14.723 1.00 15.58 N ATOM 1079 CA PHE A 212 12.329 5.616 16.039 1.00 15.83 C ATOM 1080 C PHE A 212 12.682 7.093 16.010 1.00 16.65 C ATOM 1081 O PHE A 212 13.347 7.550 15.077 1.00 17.12 O ATOM 1082 CB PHE A 212 13.575 4.833 16.401 1.00 14.38 C ATOM 1083 CG PHE A 212 14.261 5.322 17.638 1.00 14.40 C ATOM 1084 CD1 PHE A 212 13.877 4.849 18.891 1.00 18.69 C ATOM 1085 CD2 PHE A 212 15.291 6.255 17.564 1.00 17.64 C ATOM 1086 CE1 PHE A 212 14.502 5.290 20.038 1.00 21.17 C ATOM 1087 CE2 PHE A 212 15.917 6.710 18.720 1.00 19.75 C ATOM 1088 CZ PHE A 212 15.525 6.215 19.951 1.00 17.94 C ATOM 1089 H PHE A 212 12.297 5.612 13.872 1.00 0.00 H ATOM 1090 N VAL A 213 12.249 7.839 17.035 1.00 15.12 N ATOM 1091 CA VAL A 213 12.655 9.234 17.203 1.00 15.52 C ATOM 1092 C VAL A 213 13.000 9.455 18.670 1.00 15.28 C ATOM 1093 O VAL A 213 12.163 9.222 19.547 1.00 16.18 O ATOM 1094 CB VAL A 213 11.555 10.227 16.776 1.00 20.39 C ATOM 1095 CG1 VAL A 213 12.090 11.649 16.836 1.00 19.59 C ATOM 1096 CG2 VAL A 213 11.011 9.915 15.354 1.00 19.97 C ATOM 1097 H VAL A 213 11.605 7.414 17.732 1.00 0.00 H ATOM 1098 N GLY A 214 14.200 9.951 18.942 1.00 14.90 N ATOM 1099 CA GLY A 214 14.525 10.230 20.331 1.00 16.13 C ATOM 1100 C GLY A 214 15.733 11.130 20.480 1.00 21.04 C ATOM 1101 O GLY A 214 16.497 11.344 19.545 1.00 21.12 O ATOM 1102 H GLY A 214 14.888 10.135 18.184 1.00 0.00 H ATOM 1103 N ARG A 215 15.914 11.656 21.695 1.00 20.82 N ATOM 1104 CA ARG A 215 17.114 12.428 21.998 1.00 20.57 C ATOM 1105 C ARG A 215 18.276 11.472 22.256 1.00 25.73 C ATOM 1106 O ARG A 215 18.105 10.440 22.909 1.00 27.61 O ATOM 1107 CB ARG A 215 16.859 13.297 23.232 1.00 19.84 C ATOM 1108 CG ARG A 215 18.034 14.193 23.644 1.00 20.90 C ATOM 1109 CD ARG A 215 17.671 15.113 24.825 1.00 20.61 C ATOM 1110 NE ARG A 215 18.826 15.871 25.310 1.00 25.82 N ATOM 1111 CZ ARG A 215 19.751 15.382 26.131 1.00 30.05 C ATOM 1112 NH1 ARG A 215 19.645 14.136 26.582 1.00 29.86 N ATOM 1113 NH2 ARG A 215 20.787 16.131 26.503 1.00 25.90 N ATOM 1114 HE ARG A 215 18.930 16.856 24.992 1.00 0.00 H ATOM 1115 HH12 ARG A 215 20.368 13.752 27.224 1.00 0.00 H ATOM 1116 HH11 ARG A 215 18.840 13.545 26.293 1.00 0.00 H ATOM 1117 HH22 ARG A 215 21.506 15.741 27.145 1.00 0.00 H ATOM 1118 HH21 ARG A 215 20.877 17.106 26.151 1.00 0.00 H ATOM 1119 H ARG A 215 15.193 11.514 22.431 1.00 0.00 H ATOM 1120 N LYS A 216 19.457 11.808 21.716 1.00 20.96 N ATOM 1121 CA LYS A 216 20.624 10.932 21.839 1.00 27.79 C ATOM 1122 C LYS A 216 20.864 10.531 23.284 1.00 32.59 C ATOM 1123 O LYS A 216 21.025 9.343 23.590 1.00 37.96 O ATOM 1124 CB LYS A 216 21.877 11.592 21.247 1.00 28.51 C ATOM 1125 CG LYS A 216 23.226 10.918 21.639 1.00 29.31 C ATOM 1126 CD LYS A 216 23.522 9.646 20.834 1.00 28.96 C ATOM 1127 CE LYS A 216 24.674 8.828 21.456 1.00 31.47 C ATOM 1128 NZ LYS A 216 26.022 9.469 21.336 1.00 25.05 N ATOM 1129 HZ1 LYS A 216 26.252 9.603 20.331 1.00 0.00 H ATOM 1130 HZ2 LYS A 216 26.010 10.391 21.816 1.00 0.00 H ATOM 1131 HZ3 LYS A 216 26.737 8.856 21.778 1.00 0.00 H ATOM 1132 H LYS A 216 19.545 12.707 21.201 1.00 0.00 H ATOM 1133 N GLY A 217 20.873 11.505 24.192 1.00 19.84 N ATOM 1134 CA GLY A 217 21.038 11.190 25.602 1.00 26.66 C ATOM 1135 C GLY A 217 19.771 10.892 26.391 1.00 33.93 C ATOM 1136 O GLY A 217 19.790 10.920 27.628 1.00 38.33 O ATOM 1137 H GLY A 217 20.762 12.494 23.892 1.00 0.00 H ATOM 1138 N GLY A 218 18.676 10.584 25.699 1.00 30.32 N ATOM 1139 CA GLY A 218 17.400 10.264 26.336 1.00 28.77 C ATOM 1140 C GLY A 218 16.565 11.506 26.536 1.00 21.35 C ATOM 1141 O GLY A 218 17.121 12.598 26.696 1.00 25.88 O ATOM 1142 H GLY A 218 18.731 10.571 24.661 1.00 0.00 H ATOM 1143 N PRO A 219 15.222 11.371 26.538 1.00 21.27 N ATOM 1144 CA PRO A 219 14.449 10.137 26.353 1.00 23.96 C ATOM 1145 C PRO A 219 14.001 9.866 24.922 1.00 18.89 C ATOM 1146 O PRO A 219 14.214 10.689 24.022 1.00 20.05 O ATOM 1147 CB PRO A 219 13.195 10.419 27.171 1.00 21.90 C ATOM 1148 CG PRO A 219 12.967 11.892 26.972 1.00 22.19 C ATOM 1149 CD PRO A 219 14.354 12.510 26.900 1.00 24.07 C ATOM 1150 N VAL A 220 13.369 8.705 24.727 1.00 20.14 N ATOM 1151 CA VAL A 220 12.716 8.396 23.459 1.00 18.03 C ATOM 1152 C VAL A 220 11.441 9.213 23.347 1.00 16.32 C ATOM 1153 O VAL A 220 10.681 9.347 24.314 1.00 20.89 O ATOM 1154 CB VAL A 220 12.396 6.893 23.370 1.00 20.84 C ATOM 1155 CG1 VAL A 220 11.662 6.572 22.075 1.00 20.87 C ATOM 1156 CG2 VAL A 220 13.664 6.061 23.490 1.00 27.00 C ATOM 1157 H VAL A 220 13.342 8.006 25.496 1.00 0.00 H ATOM 1158 N PHE A 221 11.181 9.741 22.153 1.00 15.88 N ATOM 1159 CA PHE A 221 9.969 10.520 21.904 1.00 16.50 C ATOM 1160 C PHE A 221 8.872 9.720 21.216 1.00 16.51 C ATOM 1161 O PHE A 221 7.690 9.912 21.519 1.00 20.28 O ATOM 1162 CB PHE A 221 10.291 11.775 21.095 1.00 18.04 C ATOM 1163 CG PHE A 221 11.300 12.684 21.751 1.00 18.99 C ATOM 1164 CD1 PHE A 221 11.111 13.135 23.042 1.00 18.62 C ATOM 1165 CD2 PHE A 221 12.447 13.083 21.063 1.00 17.22 C ATOM 1166 CE1 PHE A 221 12.024 13.968 23.631 1.00 18.12 C ATOM 1167 CE2 PHE A 221 13.365 13.928 21.656 1.00 16.70 C ATOM 1168 CZ PHE A 221 13.161 14.353 22.953 1.00 17.67 C ATOM 1169 H PHE A 221 11.858 9.596 21.377 1.00 0.00 H ATOM 1170 N GLY A 222 9.233 8.842 20.277 1.00 15.70 N ATOM 1171 CA GLY A 222 8.254 7.992 19.625 1.00 16.73 C ATOM 1172 C GLY A 222 8.940 6.775 19.056 1.00 17.79 C ATOM 1173 O GLY A 222 10.125 6.820 18.723 1.00 17.41 O ATOM 1174 H GLY A 222 10.235 8.766 20.008 1.00 0.00 H ATOM 1175 N GLU A 223 8.194 5.676 18.941 1.00 16.65 N ATOM 1176 CA GLU A 223 8.759 4.437 18.420 1.00 15.50 C ATOM 1177 C GLU A 223 7.618 3.532 17.985 1.00 17.03 C ATOM 1178 O GLU A 223 6.599 3.433 18.674 1.00 20.39 O ATOM 1179 CB GLU A 223 9.611 3.728 19.482 1.00 16.88 C ATOM 1180 CG GLU A 223 10.309 2.469 19.005 1.00 18.29 C ATOM 1181 CD GLU A 223 11.424 2.011 19.935 1.00 23.83 C ATOM 1182 OE1 GLU A 223 11.336 2.217 21.176 1.00 21.58 O ATOM 1183 OE2 GLU A 223 12.408 1.458 19.416 1.00 22.12 O ATOM 1184 H GLU A 223 7.194 5.703 19.227 1.00 0.00 H ATOM 1185 N LYS A 224 7.787 2.887 16.825 1.00 18.04 N ATOM 1186 CA LYS A 224 6.839 1.897 16.336 1.00 16.82 C ATOM 1187 C LYS A 224 7.621 0.722 15.766 1.00 18.64 C ATOM 1188 O LYS A 224 8.735 0.887 15.261 1.00 18.69 O ATOM 1189 CB LYS A 224 5.919 2.481 15.257 1.00 19.72 C ATOM 1190 CG LYS A 224 4.819 3.369 15.758 1.00 30.34 C ATOM 1191 CD LYS A 224 3.815 3.644 14.655 1.00 28.67 C ATOM 1192 CE LYS A 224 2.672 4.477 15.200 1.00 27.40 C ATOM 1193 NZ LYS A 224 1.621 4.713 14.172 1.00 30.85 N ATOM 1194 HZ1 LYS A 224 2.036 5.217 13.363 1.00 0.00 H ATOM 1195 HZ2 LYS A 224 1.238 3.800 13.854 1.00 0.00 H ATOM 1196 HZ3 LYS A 224 0.857 5.286 14.584 1.00 0.00 H ATOM 1197 H LYS A 224 8.627 3.101 16.251 1.00 0.00 H ATOM 1198 N HIS A 225 7.045 -0.472 15.878 1.00 16.86 N ATOM 1199 CA HIS A 225 7.716 -1.684 15.431 1.00 20.67 C ATOM 1200 C HIS A 225 6.643 -2.660 14.966 1.00 18.54 C ATOM 1201 O HIS A 225 5.591 -2.771 15.598 1.00 23.14 O ATOM 1202 CB HIS A 225 8.517 -2.274 16.606 1.00 20.01 C ATOM 1203 CG HIS A 225 9.142 -3.616 16.332 1.00 24.04 C ATOM 1204 ND1 HIS A 225 8.907 -4.717 17.133 1.00 35.03 N ATOM 1205 CD2 HIS A 225 10.010 -4.027 15.374 1.00 18.32 C ATOM 1206 CE1 HIS A 225 9.590 -5.746 16.674 1.00 35.47 C ATOM 1207 NE2 HIS A 225 10.269 -5.353 15.609 1.00 23.97 N ATOM 1208 H HIS A 225 6.094 -0.541 16.294 1.00 0.00 H ATOM 1209 N SER A 226 6.900 -3.372 13.871 1.00 18.05 N ATOM 1210 CA SER A 226 6.023 -4.459 13.447 1.00 18.77 C ATOM 1211 C SER A 226 6.881 -5.682 13.170 1.00 20.33 C ATOM 1212 O SER A 226 7.769 -5.645 12.305 1.00 20.09 O ATOM 1213 CB SER A 226 5.193 -4.094 12.208 1.00 23.59 C ATOM 1214 OG SER A 226 4.358 -5.188 11.829 1.00 24.68 O ATOM 1215 HG SER A 226 3.745 -5.408 12.575 1.00 0.00 H ATOM 1216 H SER A 226 7.744 -3.149 13.305 1.00 0.00 H ATOM 1217 N LYS A 227 6.606 -6.764 13.897 1.00 21.85 N ATOM 1218 CA LYS A 227 7.326 -8.014 13.706 1.00 24.94 C ATOM 1219 C LYS A 227 6.844 -8.702 12.431 1.00 24.79 C ATOM 1220 O LYS A 227 5.635 -8.816 12.192 1.00 24.80 O ATOM 1221 CB LYS A 227 7.064 -8.912 14.917 1.00 24.99 C ATOM 1222 CG LYS A 227 7.990 -10.106 15.069 1.00 37.51 C ATOM 1223 CD LYS A 227 7.866 -10.719 16.473 1.00 37.31 C ATOM 1224 CE LYS A 227 8.770 -11.938 16.651 1.00 44.50 C ATOM 1225 NZ LYS A 227 8.289 -13.112 15.862 1.00 47.68 N ATOM 1226 HZ1 LYS A 227 7.331 -13.369 16.175 1.00 0.00 H ATOM 1227 HZ2 LYS A 227 8.271 -12.865 14.852 1.00 0.00 H ATOM 1228 HZ3 LYS A 227 8.931 -13.916 16.012 1.00 0.00 H ATOM 1229 H LYS A 227 5.859 -6.714 14.618 1.00 0.00 H ATOM 1230 N SER A 228 7.789 -9.143 11.603 1.00 20.34 N ATOM 1231 CA SER A 228 7.443 -9.925 10.429 1.00 23.93 C ATOM 1232 C SER A 228 6.769 -11.218 10.866 1.00 22.72 C ATOM 1233 O SER A 228 7.264 -11.880 11.788 1.00 26.52 O ATOM 1234 CB SER A 228 8.709 -10.256 9.634 1.00 20.31 C ATOM 1235 OG SER A 228 8.421 -11.299 8.709 1.00 26.34 O ATOM 1236 HG SER A 228 9.238 -11.516 8.193 1.00 0.00 H ATOM 1237 H SER A 228 8.787 -8.925 11.799 1.00 0.00 H ATOM 1238 N PRO A 229 5.656 -11.623 10.240 1.00 25.44 N ATOM 1239 CA PRO A 229 4.922 -12.793 10.741 1.00 31.78 C ATOM 1240 C PRO A 229 5.463 -14.121 10.246 1.00 30.13 C ATOM 1241 O PRO A 229 5.007 -15.166 10.727 1.00 33.90 O ATOM 1242 CB PRO A 229 3.502 -12.563 10.205 1.00 34.59 C ATOM 1243 CG PRO A 229 3.719 -11.860 8.918 1.00 28.18 C ATOM 1244 CD PRO A 229 4.930 -10.947 9.149 1.00 30.02 C ATOM 1245 N ALA A 230 6.397 -14.113 9.298 1.00 28.63 N ATOM 1246 CA ALA A 230 6.914 -15.327 8.686 1.00 30.05 C ATOM 1247 C ALA A 230 8.176 -14.938 7.942 1.00 27.52 C ATOM 1248 O ALA A 230 8.342 -13.782 7.542 1.00 26.49 O ATOM 1249 CB ALA A 230 5.902 -15.930 7.704 1.00 29.97 C ATOM 1250 H ALA A 230 6.774 -13.197 8.980 1.00 0.00 H ATOM 1251 N LEU A 231 9.061 -15.921 7.747 1.00 28.53 N ATOM 1252 CA LEU A 231 10.334 -15.629 7.096 1.00 24.06 C ATOM 1253 C LEU A 231 10.139 -15.089 5.680 1.00 27.22 C ATOM 1254 O LEU A 231 10.952 -14.289 5.201 1.00 24.52 O ATOM 1255 CB LEU A 231 11.237 -16.860 7.103 1.00 24.81 C ATOM 1256 CG LEU A 231 11.728 -17.297 8.484 1.00 27.31 C ATOM 1257 CD1 LEU A 231 12.625 -18.529 8.363 1.00 33.55 C ATOM 1258 CD2 LEU A 231 12.463 -16.168 9.191 1.00 25.22 C ATOM 1259 H LEU A 231 8.843 -16.889 8.058 1.00 0.00 H ATOM 1260 N SER A 232 9.068 -15.501 4.999 1.00 31.46 N ATOM 1261 CA SER A 232 8.790 -15.024 3.649 1.00 30.84 C ATOM 1262 C SER A 232 8.038 -13.697 3.623 1.00 32.17 C ATOM 1263 O SER A 232 7.715 -13.214 2.531 1.00 33.84 O ATOM 1264 CB SER A 232 7.997 -16.084 2.875 1.00 31.25 C ATOM 1265 OG SER A 232 6.844 -16.464 3.606 1.00 38.21 O ATOM 1266 HG SER A 232 6.270 -15.671 3.750 1.00 0.00 H ATOM 1267 H SER A 232 8.415 -16.179 5.442 1.00 0.00 H ATOM 1268 N SER A 233 7.737 -13.111 4.781 1.00 25.74 N ATOM 1269 CA SER A 233 6.947 -11.890 4.876 1.00 30.75 C ATOM 1270 C SER A 233 7.757 -10.787 5.547 1.00 25.44 C ATOM 1271 O SER A 233 8.824 -11.020 6.122 1.00 23.84 O ATOM 1272 CB SER A 233 5.667 -12.123 5.693 1.00 29.50 C ATOM 1273 OG SER A 233 4.781 -13.005 5.030 1.00 36.53 O ATOM 1274 HG SER A 233 5.228 -13.877 4.892 1.00 0.00 H ATOM 1275 H SER A 233 8.083 -13.546 5.660 1.00 0.00 H ATOM 1276 N TRP A 234 7.228 -9.576 5.476 1.00 22.40 N ATOM 1277 CA TRP A 234 7.797 -8.418 6.148 1.00 26.60 C ATOM 1278 C TRP A 234 6.838 -7.933 7.227 1.00 24.15 C ATOM 1279 O TRP A 234 5.643 -8.238 7.208 1.00 29.18 O ATOM 1280 CB TRP A 234 8.035 -7.275 5.152 1.00 21.62 C ATOM 1281 CG TRP A 234 9.249 -7.459 4.290 1.00 21.35 C ATOM 1282 CD1 TRP A 234 10.468 -6.874 4.471 1.00 20.81 C ATOM 1283 CD2 TRP A 234 9.359 -8.264 3.107 1.00 22.44 C ATOM 1284 NE1 TRP A 234 11.338 -7.284 3.497 1.00 19.08 N ATOM 1285 CE2 TRP A 234 10.682 -8.126 2.635 1.00 22.23 C ATOM 1286 CE3 TRP A 234 8.474 -9.093 2.406 1.00 25.80 C ATOM 1287 CZ2 TRP A 234 11.140 -8.783 1.497 1.00 28.69 C ATOM 1288 CZ3 TRP A 234 8.936 -9.744 1.269 1.00 30.06 C ATOM 1289 CH2 TRP A 234 10.255 -9.587 0.830 1.00 27.81 C ATOM 1290 HE1 TRP A 234 12.336 -7.002 3.422 1.00 0.00 H ATOM 1291 H TRP A 234 6.364 -9.446 4.912 1.00 0.00 H ATOM 1292 N GLY A 235 7.360 -7.146 8.165 1.00 20.84 N ATOM 1293 CA GLY A 235 6.483 -6.437 9.074 1.00 22.91 C ATOM 1294 C GLY A 235 5.560 -5.490 8.331 1.00 23.84 C ATOM 1295 O GLY A 235 5.819 -5.109 7.181 1.00 23.53 O ATOM 1296 H GLY A 235 8.392 -7.041 8.245 1.00 0.00 H ATOM 1297 N ASP A 236 4.457 -5.122 8.996 1.00 21.36 N ATOM 1298 CA ASP A 236 3.518 -4.163 8.419 1.00 27.88 C ATOM 1299 C ASP A 236 4.222 -2.818 8.275 1.00 23.55 C ATOM 1300 O ASP A 236 5.024 -2.457 9.138 1.00 21.24 O ATOM 1301 CB ASP A 236 2.323 -3.955 9.364 1.00 23.74 C ATOM 1302 CG ASP A 236 1.466 -5.195 9.534 1.00 33.40 C ATOM 1303 OD1 ASP A 236 1.512 -6.104 8.672 1.00 32.50 O ATOM 1304 OD2 ASP A 236 0.712 -5.241 10.533 1.00 43.37 O ATOM 1305 H ASP A 236 4.266 -5.524 9.936 1.00 0.00 H ATOM 1306 N PRO A 237 3.949 -2.046 7.222 1.00 21.15 N ATOM 1307 CA PRO A 237 4.513 -0.686 7.173 1.00 25.57 C ATOM 1308 C PRO A 237 4.087 0.097 8.409 1.00 20.16 C ATOM 1309 O PRO A 237 2.929 0.038 8.822 1.00 25.03 O ATOM 1310 CB PRO A 237 3.888 -0.086 5.904 1.00 24.78 C ATOM 1311 CG PRO A 237 3.423 -1.263 5.097 1.00 30.93 C ATOM 1312 CD PRO A 237 3.035 -2.313 6.096 1.00 24.39 C ATOM 1313 N VAL A 238 5.021 0.835 9.008 1.00 18.49 N ATOM 1314 CA VAL A 238 4.706 1.670 10.170 1.00 20.48 C ATOM 1315 C VAL A 238 4.951 3.134 9.834 1.00 20.24 C ATOM 1316 O VAL A 238 5.970 3.483 9.220 1.00 18.90 O ATOM 1317 CB VAL A 238 5.421 1.246 11.474 1.00 20.63 C ATOM 1318 CG1 VAL A 238 5.033 -0.167 11.856 1.00 29.56 C ATOM 1319 CG2 VAL A 238 6.922 1.379 11.354 1.00 20.63 C ATOM 1320 H VAL A 238 5.995 0.818 8.643 1.00 0.00 H ATOM 1321 N LEU A 239 4.003 3.976 10.222 1.00 18.67 N ATOM 1322 CA LEU A 239 4.058 5.424 10.052 1.00 19.37 C ATOM 1323 C LEU A 239 3.980 6.017 11.451 1.00 18.75 C ATOM 1324 O LEU A 239 2.918 5.983 12.083 1.00 21.11 O ATOM 1325 CB LEU A 239 2.894 5.919 9.182 1.00 19.69 C ATOM 1326 CG LEU A 239 2.878 7.413 8.847 1.00 25.00 C ATOM 1327 CD1 LEU A 239 4.276 7.862 8.421 1.00 31.69 C ATOM 1328 CD2 LEU A 239 1.855 7.693 7.742 1.00 27.80 C ATOM 1329 H LEU A 239 3.160 3.575 10.680 1.00 0.00 H ATOM 1330 N LEU A 240 5.102 6.556 11.922 1.00 16.25 N ATOM 1331 CA LEU A 240 5.214 7.165 13.240 1.00 17.98 C ATOM 1332 C LEU A 240 5.166 8.681 13.090 1.00 20.39 C ATOM 1333 O LEU A 240 5.911 9.251 12.289 1.00 19.90 O ATOM 1334 CB LEU A 240 6.541 6.742 13.877 1.00 17.79 C ATOM 1335 CG LEU A 240 6.927 7.417 15.193 1.00 16.74 C ATOM 1336 CD1 LEU A 240 5.948 7.038 16.293 1.00 20.53 C ATOM 1337 CD2 LEU A 240 8.335 7.021 15.582 1.00 17.84 C ATOM 1338 H LEU A 240 5.946 6.541 11.315 1.00 0.00 H ATOM 1339 N LYS A 241 4.274 9.328 13.839 1.00 20.76 N ATOM 1340 CA LYS A 241 4.148 10.782 13.852 1.00 18.13 C ATOM 1341 C LYS A 241 4.368 11.262 15.279 1.00 18.83 C ATOM 1342 O LYS A 241 3.596 10.916 16.185 1.00 30.22 O ATOM 1343 CB LYS A 241 2.771 11.204 13.344 1.00 27.72 C ATOM 1344 CG LYS A 241 2.504 10.749 11.921 1.00 30.98 C ATOM 1345 CD LYS A 241 1.068 11.012 11.492 1.00 38.81 C ATOM 1346 CE LYS A 241 0.787 12.505 11.380 1.00 46.40 C ATOM 1347 NZ LYS A 241 2.003 13.275 10.956 1.00 42.19 N ATOM 1348 HZ1 LYS A 241 2.760 13.138 11.656 1.00 0.00 H ATOM 1349 HZ2 LYS A 241 2.322 12.933 10.027 1.00 0.00 H ATOM 1350 HZ3 LYS A 241 1.767 14.286 10.892 1.00 0.00 H ATOM 1351 H LYS A 241 3.637 8.770 14.443 1.00 0.00 H ATOM 1352 N THR A 242 5.410 12.062 15.483 1.00 19.10 N ATOM 1353 CA THR A 242 5.878 12.405 16.822 1.00 18.55 C ATOM 1354 C THR A 242 6.135 13.899 16.914 1.00 21.83 C ATOM 1355 O THR A 242 6.784 14.472 16.037 1.00 19.67 O ATOM 1356 CB THR A 242 7.182 11.659 17.113 1.00 20.85 C ATOM 1357 OG1 THR A 242 6.931 10.247 17.116 1.00 26.43 O ATOM 1358 CG2 THR A 242 7.761 12.083 18.466 1.00 27.01 C ATOM 1359 HG1 THR A 242 6.263 10.033 17.815 1.00 0.00 H ATOM 1360 H THR A 242 5.909 12.457 14.660 1.00 0.00 H ATOM 1361 N ASP A 243 5.639 14.531 17.983 1.00 19.54 N ATOM 1362 CA ASP A 243 5.957 15.927 18.257 1.00 18.64 C ATOM 1363 C ASP A 243 7.197 15.940 19.143 1.00 21.66 C ATOM 1364 O ASP A 243 7.157 15.481 20.283 1.00 25.54 O ATOM 1365 CB ASP A 243 4.784 16.629 18.940 1.00 20.69 C ATOM 1366 CG ASP A 243 3.644 16.922 17.977 1.00 33.35 C ATOM 1367 OD1 ASP A 243 3.915 17.107 16.771 1.00 30.32 O ATOM 1368 OD2 ASP A 243 2.476 16.980 18.424 1.00 43.57 O ATOM 1369 H ASP A 243 5.012 14.015 18.633 1.00 0.00 H ATOM 1370 N VAL A 244 8.291 16.472 18.626 1.00 17.76 N ATOM 1371 CA VAL A 244 9.591 16.457 19.294 1.00 16.15 C ATOM 1372 C VAL A 244 9.811 17.826 19.936 1.00 16.92 C ATOM 1373 O VAL A 244 9.701 18.836 19.237 1.00 17.52 O ATOM 1374 CB VAL A 244 10.695 16.185 18.252 1.00 16.74 C ATOM 1375 CG1 VAL A 244 12.073 16.330 18.873 1.00 20.49 C ATOM 1376 CG2 VAL A 244 10.523 14.792 17.655 1.00 19.46 C ATOM 1377 H VAL A 244 8.223 16.926 17.693 1.00 0.00 H ATOM 1378 N PRO A 245 10.127 17.905 21.227 1.00 17.24 N ATOM 1379 CA PRO A 245 10.403 19.217 21.822 1.00 18.06 C ATOM 1380 C PRO A 245 11.706 19.818 21.327 1.00 19.62 C ATOM 1381 O PRO A 245 12.681 19.109 21.052 1.00 24.20 O ATOM 1382 CB PRO A 245 10.505 18.901 23.320 1.00 18.71 C ATOM 1383 CG PRO A 245 11.012 17.501 23.351 1.00 20.34 C ATOM 1384 CD PRO A 245 10.340 16.801 22.184 1.00 17.48 C ATOM 1385 N LEU A 246 11.710 21.143 21.191 1.00 19.72 N ATOM 1386 CA LEU A 246 12.901 21.874 20.781 1.00 19.64 C ATOM 1387 C LEU A 246 13.527 22.568 21.980 1.00 25.63 C ATOM 1388 O LEU A 246 12.834 22.988 22.912 1.00 25.79 O ATOM 1389 CB LEU A 246 12.583 22.909 19.696 1.00 28.55 C ATOM 1390 CG LEU A 246 12.335 22.353 18.283 1.00 27.26 C ATOM 1391 CD1 LEU A 246 11.925 23.443 17.284 1.00 28.44 C ATOM 1392 CD2 LEU A 246 13.553 21.590 17.768 1.00 23.62 C ATOM 1393 H LEU A 246 10.836 21.672 21.384 1.00 0.00 H ATOM 1394 N SER A 247 14.851 22.665 21.960 1.00 19.93 N ATOM 1395 CA SER A 247 15.544 23.395 23.014 1.00 20.92 C ATOM 1396 C SER A 247 15.600 24.878 22.668 1.00 26.06 C ATOM 1397 O SER A 247 15.416 25.280 21.513 1.00 30.03 O ATOM 1398 CB SER A 247 16.962 22.857 23.195 1.00 30.73 C ATOM 1399 OG SER A 247 17.777 23.185 22.089 1.00 34.58 O ATOM 1400 HG SER A 247 18.688 22.825 22.233 1.00 0.00 H ATOM 1401 H SER A 247 15.394 22.220 21.192 1.00 0.00 H ATOM 1402 N SER A 248 15.872 25.696 23.678 1.00 27.46 N ATOM 1403 CA SER A 248 15.787 27.139 23.486 1.00 35.21 C ATOM 1404 C SER A 248 16.687 27.833 24.503 1.00 43.18 C ATOM 1405 O SER A 248 17.644 27.241 25.011 1.00 39.89 O ATOM 1406 CB SER A 248 14.320 27.590 23.572 1.00 45.86 C ATOM 1407 OG SER A 248 13.835 27.442 24.894 1.00 38.71 O ATOM 1408 HG SER A 248 13.897 26.491 25.162 1.00 0.00 H ATOM 1409 H SER A 248 16.145 25.308 24.604 1.00 0.00 H ATOM 1410 N ALA A 249 16.370 29.095 24.791 1.00 57.65 N ATOM 1411 CA ALA A 249 17.106 29.943 25.734 1.00 59.99 C ATOM 1412 C ALA A 249 18.561 30.133 25.317 1.00 58.52 C ATOM 1413 O ALA A 249 18.935 31.202 24.831 1.00 62.42 O ATOM 1414 CB ALA A 249 17.002 29.403 27.162 1.00 48.00 C ATOM 1415 H ALA A 249 15.543 29.507 24.314 1.00 0.00 H TER 1416 ALA A 249 HETATM 1417 O HOH 1 7.381 13.947 21.844 1.00 40.90 O HETATM 1418 O HOH 2 29.551 6.162 8.700 1.00 46.17 O HETATM 1419 O HOH 3 20.509 32.555 25.721 1.00 44.82 O HETATM 1420 O HOH 4 11.195 13.096 -2.094 1.00 39.28 O HETATM 1421 O HOH 5 2.809 -8.091 8.576 1.00 37.32 O HETATM 1422 O HOH 6 35.033 -6.859 12.996 1.00 27.36 O HETATM 1423 O HOH 7 15.048 18.959 20.836 1.00 31.57 O HETATM 1424 O HOH 8 19.389 -17.601 -3.540 1.00 48.29 O HETATM 1425 O HOH 9 19.103 -7.323 22.625 1.00 37.76 O HETATM 1426 O HOH 10 32.089 -5.902 15.776 1.00 38.77 O HETATM 1427 O HOH 11 4.509 -14.863 3.445 1.00 44.39 O HETATM 1428 O HOH 12 18.946 5.807 0.559 1.00 35.67 O HETATM 1429 O HOH 13 9.542 23.724 14.278 1.00 30.00 O HETATM 1430 O HOH 14 4.908 5.628 -2.415 1.00 57.74 O HETATM 1431 O HOH 15 12.472 24.746 24.708 1.00 37.02 O HETATM 1432 O HOH 16 11.527 -9.218 16.282 1.00 38.61 O HETATM 1433 O HOH 17 14.542 26.616 19.521 1.00 37.93 O HETATM 1434 O HOH 18 8.911 22.805 6.731 1.00 34.81 O HETATM 1435 O HOH 19 26.085 -3.689 1.854 1.00 30.66 O HETATM 1436 O HOH 20 16.461 8.539 -2.454 1.00 45.58 O HETATM 1437 O HOH 21 26.019 -5.071 9.962 1.00 17.47 O HETATM 1438 O HOH 22 16.895 0.715 -8.235 1.00 40.98 O HETATM 1439 O HOH 23 0.095 16.379 17.567 1.00 46.31 O HETATM 1440 O HOH 24 28.068 19.148 15.758 1.00 38.26 O HETATM 1441 O HOH 25 27.970 6.319 6.867 1.00 45.41 O HETATM 1442 O HOH 26 29.499 11.664 21.341 1.00 38.54 O HETATM 1443 O HOH 27 29.391 -5.941 4.222 1.00 33.64 O HETATM 1444 O HOH 28 17.727 16.098 3.670 1.00 49.47 O HETATM 1445 O HOH 29 0.625 2.266 14.042 1.00 44.98 O HETATM 1446 O HOH 30 27.042 2.880 5.502 1.00 35.12 O HETATM 1447 O HOH 31 8.852 21.666 2.153 1.00 25.74 O HETATM 1448 O HOH 32 18.384 4.640 -2.957 1.00 33.00 O HETATM 1449 O HOH 33 18.176 7.591 2.907 1.00 42.63 O HETATM 1450 O HOH 34 3.159 -8.494 6.271 1.00 46.64 O HETATM 1451 O HOH 35 32.770 -1.649 9.690 1.00 30.51 O HETATM 1452 O HOH 36 16.834 -4.474 -0.603 1.00 25.82 O HETATM 1453 O HOH 37 22.128 0.313 2.011 1.00 21.77 O HETATM 1454 O HOH 38 1.472 2.486 4.301 1.00 46.82 O HETATM 1455 O HOH 39 27.383 -4.827 16.972 1.00 19.64 O HETATM 1456 O HOH 40 13.363 -2.754 -0.583 1.00 44.03 O HETATM 1457 O HOH 41 -0.533 -7.329 11.755 1.00 32.85 O HETATM 1458 O HOH 42 21.511 1.627 -2.118 1.00 45.95 O HETATM 1459 O HOH 43 2.647 7.830 3.587 1.00 56.40 O HETATM 1460 O HOH 44 31.175 4.872 10.872 1.00 25.19 O HETATM 1461 O HOH 45 33.999 -7.292 15.598 1.00 42.12 O HETATM 1462 O HOH 46 16.289 8.330 22.723 1.00 24.02 O HETATM 1463 O HOH 47 19.501 -9.348 14.941 1.00 41.42 O HETATM 1464 O HOH 48 17.506 -11.464 12.430 1.00 29.65 O HETATM 1465 O HOH 49 11.163 -12.046 11.851 1.00 38.73 O HETATM 1466 O HOH 50 29.080 -7.263 11.503 1.00 20.52 O HETATM 1467 O HOH 51 28.531 -9.812 11.543 1.00 15.94 O HETATM 1468 O HOH 52 33.146 6.514 17.631 1.00 27.55 O HETATM 1469 O HOH 53 4.043 -10.731 13.414 1.00 39.85 O HETATM 1470 O HOH 54 4.036 20.246 3.752 1.00 30.12 O HETATM 1471 O HOH 55 12.327 16.979 -0.224 1.00 20.12 O HETATM 1472 O HOH 56 22.978 -12.529 15.912 1.00 21.43 O HETATM 1473 O HOH 57 9.263 3.067 22.859 1.00 36.02 O HETATM 1474 O HOH 58 13.689 6.894 -4.115 1.00 28.25 O HETATM 1475 O HOH 59 17.853 20.589 7.331 1.00 34.00 O HETATM 1476 O HOH 60 21.357 -10.198 14.498 1.00 45.21 O HETATM 1477 O HOH 61 12.572 4.173 26.743 1.00 35.12 O HETATM 1478 O HOH 62 21.161 20.400 6.490 1.00 31.72 O HETATM 1479 O HOH 63 22.913 -1.176 26.790 1.00 32.65 O HETATM 1480 O HOH 64 4.642 9.479 18.562 1.00 42.27 O HETATM 1481 O HOH 65 6.572 -1.386 1.236 1.00 31.91 O HETATM 1482 O HOH 66 4.370 -6.715 15.609 1.00 35.21 O HETATM 1483 O HOH 67 1.944 -4.547 13.132 1.00 43.03 O HETATM 1484 O HOH 68 11.613 -6.256 -1.821 1.00 45.22 O HETATM 1485 O HOH 69 6.474 -3.447 5.001 1.00 22.73 O HETATM 1486 O HOH 70 4.382 -17.917 10.621 1.00 50.11 O HETATM 1487 O HOH 71 29.039 -7.111 22.431 1.00 56.78 O HETATM 1488 O HOH 72 17.694 -10.506 15.645 1.00 46.50 O HETATM 1489 O HOH 73 27.496 -0.745 22.716 1.00 22.56 O HETATM 1490 O HOH 74 7.655 13.544 -0.192 1.00 27.27 O HETATM 1491 O HOH 75 1.561 2.892 11.159 1.00 42.11 O HETATM 1492 O HOH 76 12.467 -12.720 -0.812 1.00 45.24 O HETATM 1493 O HOH 77 1.296 -0.424 11.098 1.00 48.70 O HETATM 1494 O HOH 78 18.479 18.316 23.528 1.00 28.24 O HETATM 1495 O HOH 79 14.813 19.632 8.766 1.00 26.80 O HETATM 1496 O HOH 80 25.155 -9.224 2.340 1.00 22.39 O HETATM 1497 O HOH 81 24.542 19.502 21.146 1.00 28.23 O HETATM 1498 O HOH 82 32.346 -0.508 15.970 1.00 22.31 O HETATM 1499 O HOH 83 5.623 -11.727 1.287 1.00 43.01 O HETATM 1500 O HOH 84 6.630 16.549 9.055 1.00 21.59 O HETATM 1501 O HOH 85 3.971 -6.343 5.390 1.00 44.38 O HETATM 1502 O HOH 86 22.593 -9.988 17.520 1.00 24.75 O HETATM 1503 O HOH 87 22.742 -3.831 27.052 1.00 38.37 O HETATM 1504 O HOH 88 12.517 20.430 7.772 1.00 31.69 O HETATM 1505 O HOH 89 20.554 -8.131 -2.152 1.00 46.88 O HETATM 1506 O HOH 90 24.186 -10.753 4.439 1.00 19.16 O HETATM 1507 O HOH 91 16.529 10.829 0.424 1.00 31.65 O HETATM 1508 O HOH 92 3.256 14.954 14.992 1.00 39.12 O HETATM 1509 O HOH 93 1.426 11.437 17.989 1.00 52.21 O HETATM 1510 O HOH 94 10.197 -13.271 9.801 1.00 32.75 O HETATM 1511 O HOH 95 21.819 -10.915 -0.564 1.00 39.81 O HETATM 1512 O HOH 96 5.046 0.738 1.481 1.00 41.71 O HETATM 1513 O HOH 97 4.801 -0.471 17.678 1.00 36.49 O HETATM 1514 O HOH 98 27.028 7.007 22.527 1.00 44.12 O HETATM 1515 O HOH 99 32.961 4.345 19.303 1.00 29.59 O HETATM 1516 O HOH 100 13.366 22.443 10.894 1.00 41.53 O HETATM 1517 O HOH 101 28.448 11.340 14.455 1.00 28.66 O HETATM 1518 O HOH 102 13.273 -14.800 3.540 1.00 26.84 O HETATM 1519 O HOH 103 14.571 -5.729 9.892 1.00 16.95 O HETATM 1520 O HOH 104 15.750 -2.003 -0.366 1.00 41.78 O HETATM 1521 O HOH 105 28.196 3.820 23.707 1.00 49.55 O HETATM 1522 O HOH 106 4.779 -8.942 4.013 1.00 33.09 O HETATM 1523 O HOH 107 25.539 6.445 4.588 1.00 23.98 O HETATM 1524 O HOH 108 23.162 -6.567 23.287 1.00 28.76 O HETATM 1525 O HOH 109 4.950 23.105 6.822 1.00 44.72 O HETATM 1526 O HOH 110 29.392 -7.052 14.856 1.00 22.28 O HETATM 1527 O HOH 111 16.748 -9.419 -4.725 1.00 43.02 O HETATM 1528 O HOH 112 25.573 10.147 24.164 1.00 39.65 O HETATM 1529 O HOH 113 8.225 -18.571 8.722 1.00 34.76 O HETATM 1530 O HOH 114 10.618 -13.971 0.555 1.00 35.54 O HETATM 1531 O HOH 115 24.528 1.384 3.221 1.00 28.78 O HETATM 1532 O HOH 116 31.733 9.045 10.034 1.00 30.92 O HETATM 1533 O HOH 117 19.471 7.868 5.017 1.00 29.24 O HETATM 1534 O HOH 118 2.363 7.788 15.501 1.00 30.90 O HETATM 1535 O HOH 119 -0.817 5.721 15.525 1.00 35.75 O HETATM 1536 O HOH 120 14.142 26.297 12.411 1.00 59.58 O HETATM 1537 O HOH 121 5.827 5.942 20.741 1.00 34.94 O HETATM 1538 O HOH 122 17.488 2.193 28.539 1.00 46.69 O HETATM 1539 O HOH 123 13.232 6.852 27.081 1.00 27.23 O HETATM 1540 O HOH 124 16.675 16.486 21.340 1.00 40.32 O HETATM 1541 O HOH 125 15.354 -12.562 13.509 1.00 24.43 O HETATM 1542 O HOH 126 3.176 8.283 -1.051 1.00 47.05 O HETATM 1543 O HOH 127 22.267 23.747 9.430 1.00 23.14 O HETATM 1544 O HOH 128 28.931 -6.833 18.455 1.00 22.27 O HETATM 1545 O HOH 129 0.600 1.845 8.107 1.00 45.69 O HETATM 1546 O HOH 130 4.271 12.656 19.955 1.00 39.56 O HETATM 1547 O HOH 131 21.849 5.095 28.948 1.00 51.25 O HETATM 1548 O HOH 132 23.695 12.023 3.281 1.00 49.61 O HETATM 1549 O HOH 133 20.528 22.471 23.258 1.00 39.66 O HETATM 1550 O HOH 134 25.134 17.931 23.446 1.00 25.70 O HETATM 1551 O HOH 135 25.092 5.986 24.233 1.00 47.63 O HETATM 1552 O HOH 136 26.602 15.680 16.767 1.00 15.24 O HETATM 1553 O HOH 137 13.357 -6.720 -0.472 1.00 32.97 O HETATM 1554 O HOH 138 23.019 -13.019 3.158 1.00 27.73 O HETATM 1555 O HOH 139 24.956 8.701 3.466 1.00 36.10 O HETATM 1556 O HOH 140 20.733 -1.814 -0.888 1.00 28.77 O HETATM 1557 O HOH 141 20.049 -12.094 -2.400 1.00 40.52 O HETATM 1558 O HOH 142 22.756 -2.108 0.331 1.00 47.99 O HETATM 1559 O HOH 143 29.562 1.140 21.897 1.00 26.19 O HETATM 1560 O HOH 144 5.592 10.385 0.244 1.00 59.74 O HETATM 1561 O HOH 145 9.427 -4.236 20.363 1.00 43.99 O HETATM 1562 O HOH 146 19.033 9.884 1.031 1.00 46.42 O HETATM 1563 O HOH 147 21.588 -8.235 22.455 1.00 49.41 O HETATM 1564 O HOH 148 13.025 26.779 15.858 1.00 42.39 O HETATM 1565 O HOH 149 25.692 15.708 14.896 1.00 37.67 O HETATM 1566 O HOH 150 34.383 -10.628 7.613 1.00 28.27 O HETATM 1567 O HOH 151 31.009 7.769 23.219 1.00 52.79 O HETATM 1568 O HOH 152 16.331 6.598 -3.827 1.00 38.67 O HETATM 1569 O HOH 153 0.456 10.531 6.245 1.00 48.07 O HETATM 1570 O HOH 154 15.947 -10.646 18.191 1.00 55.03 O HETATM 1571 O HOH 155 26.069 0.828 24.474 1.00 36.50 O HETATM 1572 O HOH 156 4.752 -3.277 18.932 1.00 57.33 O HETATM 1573 O HOH 157 26.841 0.083 2.223 1.00 38.71 O HETATM 1574 O HOH 158 22.261 2.238 0.314 1.00 39.00 O HETATM 1575 O HOH 159 33.226 8.169 19.773 1.00 37.43 O HETATM 1576 O HOH 160 34.145 -6.839 4.272 1.00 43.12 O HETATM 1577 O HOH 161 33.679 0.239 11.316 1.00 34.99 O HETATM 1578 O HOH 162 32.043 7.247 12.068 1.00 27.31 O HETATM 1579 O HOH 163 27.553 -5.637 23.900 1.00 54.98 O HETATM 1580 O HOH 164 30.216 7.970 5.280 1.00 52.39 O HETATM 1581 O HOH 165 31.731 12.386 21.081 1.00 39.61 O HETATM 1582 O HOH 166 1.509 15.677 21.764 1.00 44.84 O HETATM 1583 O HOH 167 36.327 -6.214 6.315 1.00 45.51 O HETATM 1584 O HOH 168 7.835 5.255 22.617 1.00 44.75 O HETATM 1585 O HOH 169 9.764 24.525 2.755 1.00 49.42 O HETATM 1586 O HOH 170 21.142 0.178 28.457 1.00 41.52 O HETATM 1587 O HOH 171 33.592 4.411 22.220 1.00 45.46 O HETATM 1588 O HOH 172 -0.061 8.065 14.438 1.00 39.69 O HETATM 1589 O HOH 173 9.068 -2.819 22.068 1.00 48.87 O HETATM 1590 O HOH 174 1.772 -2.148 12.467 1.00 53.05 O HETATM 1591 O HOH 175 32.869 -0.808 7.630 1.00 44.87 O HETATM 1592 O HOH 176 11.605 25.775 11.634 1.00 55.29 O HETATM 1593 O HOH 177 22.741 8.748 2.659 1.00 54.49 O HETATM 1594 O HOH 178 24.189 10.380 25.915 1.00 41.92 O HETATM 1595 O HOH 179 4.244 11.059 2.020 1.00 56.36 O HETATM 1596 O HOH 180 28.265 -3.641 2.837 1.00 40.45 O HETATM 1597 O HOH 181 4.825 -11.258 15.520 1.00 60.87 O HETATM 1598 O HOH 182 26.174 4.689 2.254 1.00 54.99 O HETATM 1599 O HOH 183 11.339 -14.150 18.173 1.00 47.69 O HETATM 1600 O HOH 184 33.029 7.385 22.012 1.00 40.62 O HETATM 1601 O HOH 185 24.273 -9.451 0.088 1.00 44.26 O HETATM 1602 O HOH 186 21.267 22.727 7.090 1.00 36.28 O HETATM 1603 O HOH 187 19.734 20.520 24.819 1.00 38.87 O HETATM 1604 O HOH 188 12.013 -11.584 16.699 1.00 42.71 O HETATM 1605 O HOH 189 27.030 2.717 25.407 1.00 48.59 O HETATM 1606 O HOH 190 5.085 -3.689 2.901 1.00 45.30 O HETATM 1607 O HOH 191 27.762 -9.462 2.215 1.00 34.12 O HETATM 1608 O HOH 192 31.264 -3.269 24.219 1.00 56.31 O HETATM 1609 O HOH 193 21.397 4.614 -0.488 1.00 39.64 O HETATM 1610 O HOH 194 10.777 25.823 14.549 1.00 42.61 O HETATM 1611 O HOH 195 24.055 -2.967 -1.475 1.00 50.37 O HETATM 1612 O HOH 196 5.385 8.508 24.934 1.00 41.28 O HETATM 1613 O HOH 197 20.299 8.612 2.760 1.00 61.06 O HETATM 1614 O HOH 198 22.271 19.859 4.501 1.00 51.57 O HETATM 1615 O HOH 199 31.370 -2.464 17.603 1.00 28.18 O HETATM 1616 O HOH 200 33.841 1.650 19.048 1.00 32.38 O HETATM 1617 O HOH 201 0.179 8.170 4.625 1.00 55.56 O HETATM 1618 O HOH 202 28.403 -2.410 24.411 1.00 35.60 O HETATM 1619 O HOH 203 33.258 3.172 10.352 1.00 35.97 O HETATM 1620 O HOH 204 33.023 -9.565 15.850 1.00 35.70 O HETATM 1621 O HOH 205 2.880 21.586 5.803 1.00 53.46 O HETATM 1622 O HOH 206 5.174 12.774 -0.107 1.00 39.72 O HETATM 1623 O HOH 207 21.466 -9.830 24.576 1.00 62.90 O HETATM 1624 O HOH 208 29.688 -7.570 2.518 1.00 33.61 O HETATM 1625 O HOH 209 29.253 3.884 6.721 1.00 40.56 O HETATM 1626 O HOH 210 17.917 18.486 5.008 1.00 41.95 O HETATM 1627 O HOH 211 23.092 14.583 3.196 1.00 42.43 O HETATM 1628 O HOH 212 0.000 0.000 4.963 1.00 47.40 O HETATM 1629 O HOH 213 26.054 -0.496 0.243 1.00 52.16 O HETATM 1630 O HOH 214 35.301 -10.173 4.592 1.00 48.04 O HETATM 1631 O HOH 215 -1.236 8.144 16.647 1.00 47.31 O HETATM 1632 O HOH 216 29.970 -9.552 15.268 1.00 24.56 O HETATM 1633 O HOH 217 34.893 -2.575 5.969 1.00 46.81 O HETATM 1634 O HOH 218 34.745 0.000 17.214 1.00 29.20 O HETATM 1635 O HOH 219 19.591 19.554 4.016 1.00 59.07 O HETATM 1636 O HOH 220 29.844 -3.522 0.749 1.00 42.29 O HETATM 1637 O HOH 221 27.110 -2.739 26.945 1.00 36.87 O HETATM 1638 O HOH 222 28.871 -6.455 -0.965 1.00 60.59 O HETATM 1639 O HOH 223 32.210 -9.450 0.816 1.00 53.60 O HETATM 1640 O HOH 224 33.840 -8.566 -0.768 1.00 51.69 O HETATM 1641 C1 PNA A 225 16.294 -11.736 0.104 1.00 0.21 C HETATM 1642 C2 PNA A 225 17.302 -11.047 -0.847 1.00 0.14 C HETATM 1643 C3 PNA A 225 17.544 -9.538 -0.671 1.00 0.11 C HETATM 1644 C4 PNA A 225 16.808 -8.924 0.513 1.00 0.11 C HETATM 1645 C5 PNA A 225 16.733 -9.966 1.610 1.00 0.11 C HETATM 1646 C6 PNA A 225 16.219 -9.414 2.928 1.00 0.07 C HETATM 1647 O6 PNA A 225 14.829 -9.090 2.812 1.00 -0.39 O HETATM 1648 H15 PNA A 225 14.713 -8.437 2.132 1.00 0.21 H HETATM 1649 H6 PNA A 225 16.784 -8.507 3.189 1.00 0.06 H HETATM 1650 H7 PNA A 225 16.353 -10.169 3.717 1.00 0.06 H HETATM 1651 O5 PNA A 225 15.782 -10.897 1.126 1.00 -0.34 O HETATM 1652 H5 PNA A 225 17.716 -10.435 1.763 1.00 0.06 H HETATM 1653 O4 PNA A 225 17.512 -7.763 0.950 1.00 -0.39 O HETATM 1654 H14 PNA A 225 17.064 -7.385 1.697 1.00 0.21 H HETATM 1655 H4 PNA A 225 15.790 -8.637 0.211 1.00 0.06 H HETATM 1656 O3 PNA A 225 17.202 -8.828 -1.871 1.00 -0.39 O HETATM 1657 H13 PNA A 225 17.662 -9.213 -2.607 1.00 0.21 H HETATM 1658 H3 PNA A 225 18.621 -9.402 -0.492 1.00 0.06 H HETATM 1659 O2 PNA A 225 16.953 -11.301 -2.223 1.00 -0.38 O HETATM 1660 H12 PNA A 225 16.164 -10.819 -2.443 1.00 0.21 H HETATM 1661 H2 PNA A 225 18.270 -11.534 -0.656 1.00 0.07 H HETATM 1662 O1 PNA A 225 16.835 -12.766 0.927 1.00 -0.28 O HETATM 1663 C7 PNA A 225 17.766 -13.643 0.525 1.00 0.10 C HETATM 1664 C8 PNA A 225 18.933 -13.705 1.267 1.00 -0.02 C HETATM 1665 C9 PNA A 225 19.908 -14.582 0.878 1.00 -0.03 C HETATM 1666 C10 PNA A 225 19.673 -15.377 -0.222 1.00 0.19 C HETATM 1667 C11 PNA A 225 18.502 -15.334 -0.967 1.00 -0.03 C HETATM 1668 C12 PNA A 225 17.520 -14.453 -0.573 1.00 -0.02 C HETATM 1669 H11 PNA A 225 16.579 -14.394 -1.107 1.00 0.06 H HETATM 1670 H10 PNA A 225 18.365 -15.974 -1.831 1.00 0.07 H HETATM 1671 N1 PNA A 225 20.702 -16.225 -0.571 1.00 0.31 N HETATM 1672 O7 PNA A 225 20.818 -16.623 -1.901 1.00 0.17 O HETATM 1673 O8 PNA A 225 21.617 -16.600 0.413 1.00 0.17 O HETATM 1674 H9 PNA A 225 20.843 -14.650 1.422 1.00 0.07 H HETATM 1675 H8 PNA A 225 19.071 -13.073 2.137 1.00 0.06 H HETATM 1676 H1 PNA A 225 15.476 -12.132 -0.517 1.00 0.10 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 1641 1642 1651 1662 1676 CONECT 1642 1641 1643 1659 1661 CONECT 1643 1642 1644 1656 1658 CONECT 1644 1643 1645 1653 1655 CONECT 1645 1644 1646 1651 1652 CONECT 1646 1645 1647 1649 1650 CONECT 1647 1646 1648 CONECT 1648 1647 CONECT 1649 1646 CONECT 1650 1646 CONECT 1651 1641 1645 CONECT 1652 1645 CONECT 1653 1644 1654 CONECT 1654 1653 CONECT 1655 1644 CONECT 1656 1643 1657 CONECT 1657 1656 CONECT 1658 1643 CONECT 1659 1642 1660 CONECT 1660 1659 CONECT 1661 1642 CONECT 1662 1641 1663 CONECT 1663 1662 1664 1668 CONECT 1664 1663 1665 1675 CONECT 1665 1664 1666 1674 CONECT 1666 1665 1667 1671 CONECT 1667 1666 1668 1670 CONECT 1668 1663 1667 1669 CONECT 1669 1668 CONECT 1670 1667 CONECT 1671 1666 1672 1673 CONECT 1672 1671 CONECT 1673 1671 CONECT 1674 1665 CONECT 1675 1664 CONECT 1676 1641 MASTER 0 0 0 0 0 0 0 0 1675 1 40 12 END
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Related entries of code: 5ggj
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
5ggk
RCSB PDB
PDBbind
164aa, >5GGK_1|Chains... at 100%
5ggl
RCSB PDB
PDBbind
164aa, >5GGL_1|Chains... at 100%
5ggn
RCSB PDB
PDBbind
164aa, >5GGN_1|Chains... at 100%
5ggo
RCSB PDB
PDBbind
164aa, >5GGO_1|Chains... at 100%
5ggp
RCSB PDB
PDBbind
164aa, >5GGP_1|Chains... 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
5ggj
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
N-terminal domain of human protein O-mannose beta-1,2-N-acetylglucosaminyltransferase
Ligand Name
PNA
EC.Number
E.C.2.4.1
Resolution
1.42(Å)
Affinity (Kd/Ki/IC50)
Kd=17.78mM
Release Year
2016
Protein/NA Sequence
Check fasta file
Primary Reference
(2016) Proc.Natl.Acad.Sci.USA Vol.113 : pp. 9280-9285
Ligand Properties
Formula
C
1
2
H
1
5
NO
8
Molecular Weight
301.249
Exact Mass
301.080
No. of atoms
36
No. of bonds
37
Polar Surface Area
145.2
LOGP Value
-0.41 (
Computed with XLOGP3
)
-0.70 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 4
No. of Hydrogen Bond Acceptors: 6
No. of Rotatable Bonds: 7
No. of Nitrogen and Oxygen Atoms: 9
No. of Rings: 2
Canonical SMILES
OC[C@H]1O[C@H](Oc2ccc(cc2)N(=O)=O)[C@H]([C@H]([C@@H]1O)O)O
InChI String
InChI=1S/C12H15NO8/c14-5-8-9(15)10(16)11(17)12(21-8)20-7-3-1-6(2-4-7)13(18)19/h1-4,8-12,14-17H,5H2/t8-,9-,10+,11+,12+/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):
Q8WZA1
Entrez Gene ID
NCBI Entrez Gene ID:
55624
ASD
Information of known allosteric effects of PDB entries
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