Browse entries in the PDBbind-CN Database
HEADER 5Z9E_COMPLEX COMPND 5Z9E_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 83 LEU ASP ALA VAL ARG LYS ARG PRO GLY MET TYR ILE GLY SEQRES 2 A 83 ASP THR ASP ASP GLY THR GLY LEU HIS HIS MET VAL PHE SEQRES 3 A 83 GLU VAL VAL ASP ASN ALA ILE ASP GLU ALA LEU ALA GLY SEQRES 4 A 83 HIS CYS LYS GLU ILE ILE VAL THR ILE HIS ALA ASP ASN SEQRES 5 A 83 SER VAL SER VAL GLN ASP ASP GLY ARG GLY ILE PRO THR SEQRES 6 A 83 GLY ILE HIS PRO GLU GLU GLY VAL SER ALA ALA GLU VAL SEQRES 7 A 83 ILE MET THR VAL LEU SEQRES 1 A 102 GLY VAL GLY VAL SER VAL VAL ASN ALA LEU SER GLN LYS SEQRES 2 A 102 LEU GLU LEU VAL ILE GLN ARG GLU GLY LYS ILE HIS ARG SEQRES 3 A 102 GLN ILE TYR GLU HIS GLY VAL PRO GLN ALA PRO LEU ALA SEQRES 4 A 102 VAL THR GLY GLU THR GLU LYS THR GLY THR MET VAL ARG SEQRES 5 A 102 PHE TRP PRO SER LEU GLU THR PHE THR ASN VAL THR GLU SEQRES 6 A 102 PHE GLU TYR GLU ILE LEU ALA LYS ARG LEU ARG GLU LEU SEQRES 7 A 102 SER PHE LEU ASN SER GLY VAL SER ILE ARG LEU ARG ASP SEQRES 8 A 102 LYS ARG ASP GLY LYS GLU ASP HIS PHE HIS TYR HET UNN A 248 28 ATOM 1 N LEU A 16 11.102 11.512 12.694 1.00 26.79 N ATOM 2 CA LEU A 16 12.314 11.208 11.868 1.00 25.85 C ATOM 3 C LEU A 16 12.165 10.167 10.729 1.00 25.77 C ATOM 4 O LEU A 16 13.126 9.961 9.963 1.00 23.97 O ATOM 5 CB LEU A 16 13.459 10.781 12.784 1.00 26.00 C ATOM 6 CG LEU A 16 13.866 11.781 13.878 1.00 25.81 C ATOM 7 CD1 LEU A 16 14.874 11.136 14.819 1.00 26.46 C ATOM 8 CD2 LEU A 16 14.430 13.031 13.242 1.00 26.41 C ATOM 9 HN3 LEU A 16 10.774 10.642 13.159 1.00 0.00 H ATOM 10 HN2 LEU A 16 10.349 11.883 12.080 1.00 0.00 H ATOM 11 HN1 LEU A 16 11.344 12.221 13.415 1.00 0.00 H ATOM 12 N ASP A 17 10.990 9.542 10.587 1.00 25.79 N ATOM 13 CA ASP A 17 10.786 8.526 9.539 1.00 26.39 C ATOM 14 C ASP A 17 10.996 9.056 8.109 1.00 25.55 C ATOM 15 O ASP A 17 11.513 8.328 7.267 1.00 24.86 O ATOM 16 CB ASP A 17 9.418 7.815 9.680 1.00 28.29 C ATOM 17 CG ASP A 17 9.477 6.560 10.583 1.00 30.10 C ATOM 18 OD1 ASP A 17 10.579 6.042 10.897 1.00 30.58 O ATOM 19 OD2 ASP A 17 8.384 6.063 10.965 1.00 33.16 O ATOM 20 H ASP A 17 10.206 9.778 11.228 1.00 0.00 H ATOM 21 N ALA A 18 10.674 10.326 7.832 1.00 24.93 N ATOM 22 CA ALA A 18 10.945 10.880 6.491 1.00 24.96 C ATOM 23 C ALA A 18 12.450 10.891 6.157 1.00 23.33 C ATOM 24 O ALA A 18 12.830 10.672 5.010 1.00 23.11 O ATOM 25 CB ALA A 18 10.367 12.279 6.350 1.00 25.64 C ATOM 26 H ALA A 18 10.233 10.922 8.562 1.00 0.00 H ATOM 27 N VAL A 19 13.290 11.130 7.168 1.00 22.68 N ATOM 28 CA VAL A 19 14.749 11.111 7.002 1.00 22.30 C ATOM 29 C VAL A 19 15.244 9.687 6.779 1.00 21.88 C ATOM 30 O VAL A 19 16.066 9.440 5.897 1.00 21.97 O ATOM 31 CB VAL A 19 15.485 11.702 8.227 1.00 21.90 C ATOM 32 CG1 VAL A 19 16.995 11.591 8.071 1.00 21.76 C ATOM 33 CG2 VAL A 19 15.080 13.164 8.430 1.00 22.57 C ATOM 34 H VAL A 19 12.896 11.337 8.108 1.00 0.00 H ATOM 35 N ARG A 20 14.742 8.757 7.581 1.00 22.01 N ATOM 36 CA ARG A 20 15.174 7.371 7.469 1.00 22.39 C ATOM 37 C ARG A 20 14.813 6.798 6.101 1.00 23.24 C ATOM 38 O ARG A 20 15.553 6.009 5.545 1.00 22.68 O ATOM 39 CB ARG A 20 14.556 6.508 8.572 1.00 23.13 C ATOM 40 CG ARG A 20 14.875 6.979 9.997 1.00 22.95 C ATOM 41 CD ARG A 20 14.560 5.895 11.016 1.00 24.14 C ATOM 42 NE ARG A 20 14.751 6.338 12.417 1.00 24.40 N ATOM 43 CZ ARG A 20 13.805 6.889 13.177 1.00 24.98 C ATOM 44 NH1 ARG A 20 12.584 7.122 12.694 1.00 25.48 N ATOM 45 NH2 ARG A 20 14.081 7.224 14.441 1.00 24.85 N ATOM 46 HE ARG A 20 15.693 6.209 12.838 1.00 0.00 H ATOM 47 HH12 ARG A 20 11.858 7.553 13.301 1.00 0.00 H ATOM 48 HH11 ARG A 20 12.358 6.873 11.710 1.00 0.00 H ATOM 49 HH22 ARG A 20 13.346 7.654 15.037 1.00 0.00 H ATOM 50 HH21 ARG A 20 15.031 7.054 14.828 1.00 0.00 H ATOM 51 H ARG A 20 14.034 9.020 8.296 1.00 0.00 H ATOM 52 N LYS A 21 13.665 7.202 5.572 1.00 23.79 N ATOM 53 CA LYS A 21 13.197 6.721 4.279 1.00 25.95 C ATOM 54 C LYS A 21 14.066 7.179 3.090 1.00 26.21 C ATOM 55 O LYS A 21 14.266 6.422 2.143 1.00 25.97 O ATOM 56 CB LYS A 21 11.740 7.158 4.109 1.00 27.42 C ATOM 57 CG LYS A 21 11.059 6.602 2.880 1.00 30.28 C ATOM 58 CD LYS A 21 9.595 6.984 2.860 1.00 31.28 C ATOM 59 CE LYS A 21 9.117 7.056 1.440 1.00 33.03 C ATOM 60 NZ LYS A 21 7.654 6.956 1.357 1.00 33.87 N ATOM 61 HZ1 LYS A 21 7.346 6.049 1.762 1.00 0.00 H ATOM 62 HZ2 LYS A 21 7.223 7.739 1.889 1.00 0.00 H ATOM 63 HZ3 LYS A 21 7.360 7.010 0.361 1.00 0.00 H ATOM 64 H LYS A 21 13.081 7.884 6.097 1.00 0.00 H ATOM 65 N ARG A 22 14.581 8.412 3.138 1.00 26.05 N ATOM 66 CA ARG A 22 15.383 8.973 2.047 1.00 27.70 C ATOM 67 C ARG A 22 16.613 9.702 2.577 1.00 25.97 C ATOM 68 O ARG A 22 16.720 10.926 2.432 1.00 26.33 O ATOM 69 CB ARG A 22 14.511 9.923 1.215 1.00 30.15 C ATOM 70 CG ARG A 22 13.351 9.244 0.520 1.00 33.08 C ATOM 71 CD ARG A 22 13.822 8.496 -0.717 1.00 36.20 C ATOM 72 NE ARG A 22 13.911 9.408 -1.853 1.00 38.61 N ATOM 73 CZ ARG A 22 14.764 9.317 -2.879 1.00 40.97 C ATOM 74 NH1 ARG A 22 15.680 8.347 -2.960 1.00 41.96 N ATOM 75 NH2 ARG A 22 14.697 10.229 -3.837 1.00 41.96 N ATOM 76 HE ARG A 22 13.246 10.207 -1.866 1.00 0.00 H ATOM 77 HH12 ARG A 22 16.326 8.309 -3.774 1.00 0.00 H ATOM 78 HH11 ARG A 22 15.746 7.630 -2.209 1.00 0.00 H ATOM 79 HH22 ARG A 22 15.348 10.182 -4.646 1.00 0.00 H ATOM 80 HH21 ARG A 22 13.993 10.992 -3.780 1.00 0.00 H ATOM 81 H ARG A 22 14.406 8.995 3.981 1.00 0.00 H ATOM 82 N PRO A 23 17.550 8.965 3.204 1.00 24.38 N ATOM 83 CA PRO A 23 18.652 9.656 3.913 1.00 23.51 C ATOM 84 C PRO A 23 19.489 10.590 3.003 1.00 24.04 C ATOM 85 O PRO A 23 19.860 11.691 3.415 1.00 22.95 O ATOM 86 CB PRO A 23 19.506 8.507 4.480 1.00 23.41 C ATOM 87 CG PRO A 23 18.691 7.261 4.334 1.00 24.18 C ATOM 88 CD PRO A 23 17.676 7.494 3.258 1.00 24.66 C ATOM 89 N GLY A 24 19.752 10.148 1.777 1.00 25.62 N ATOM 90 CA GLY A 24 20.515 10.943 0.804 1.00 27.56 C ATOM 91 C GLY A 24 19.950 12.318 0.488 1.00 28.52 C ATOM 92 O GLY A 24 20.703 13.259 0.217 1.00 28.90 O ATOM 93 H GLY A 24 19.406 9.208 1.497 1.00 0.00 H ATOM 94 N MET A 25 18.625 12.437 0.537 1.00 30.33 N ATOM 95 CA MET A 25 17.939 13.709 0.293 1.00 32.08 C ATOM 96 C MET A 25 18.129 14.723 1.405 1.00 30.43 C ATOM 97 O MET A 25 17.968 15.923 1.171 1.00 30.89 O ATOM 98 CB MET A 25 16.440 13.477 0.068 1.00 35.03 C ATOM 99 CG MET A 25 16.115 12.661 -1.181 1.00 38.09 C ATOM 100 SD MET A 25 16.724 13.365 -2.737 1.00 42.56 S ATOM 101 CE MET A 25 16.012 15.010 -2.696 1.00 42.33 C ATOM 102 H MET A 25 18.055 11.595 0.757 1.00 0.00 H ATOM 103 N TYR A 26 18.470 14.259 2.607 1.00 28.73 N ATOM 104 CA TYR A 26 18.704 15.148 3.743 1.00 27.18 C ATOM 105 C TYR A 26 20.181 15.404 3.997 1.00 26.92 C ATOM 106 O TYR A 26 20.572 16.537 4.261 1.00 27.78 O ATOM 107 CB TYR A 26 18.045 14.582 5.001 1.00 27.13 C ATOM 108 CG TYR A 26 16.545 14.638 4.936 1.00 28.26 C ATOM 109 CD1 TYR A 26 15.818 13.641 4.298 1.00 28.73 C ATOM 110 CD2 TYR A 26 15.845 15.712 5.492 1.00 28.83 C ATOM 111 CE1 TYR A 26 14.425 13.700 4.221 1.00 30.24 C ATOM 112 CE2 TYR A 26 14.462 15.783 5.422 1.00 29.48 C ATOM 113 CZ TYR A 26 13.758 14.782 4.789 1.00 30.45 C ATOM 114 OH TYR A 26 12.394 14.865 4.730 1.00 32.03 O ATOM 115 HH TYR A 26 12.037 14.078 4.248 1.00 0.00 H ATOM 116 H TYR A 26 18.573 13.233 2.741 1.00 0.00 H ATOM 117 N ILE A 27 21.002 14.364 3.921 1.00 25.92 N ATOM 118 CA ILE A 27 22.404 14.460 4.343 1.00 25.37 C ATOM 119 C ILE A 27 23.411 14.478 3.184 1.00 25.64 C ATOM 120 O ILE A 27 24.557 14.867 3.378 1.00 25.89 O ATOM 121 CB ILE A 27 22.734 13.345 5.376 1.00 24.38 C ATOM 122 CG1 ILE A 27 23.914 13.720 6.292 1.00 23.85 C ATOM 123 CG2 ILE A 27 22.988 12.007 4.696 1.00 24.55 C ATOM 124 CD1 ILE A 27 23.652 14.851 7.257 1.00 23.65 C ATOM 125 H ILE A 27 20.643 13.460 3.554 1.00 0.00 H ATOM 126 N GLY A 28 23.005 14.060 1.992 1.00 26.57 N ATOM 127 CA GLY A 28 23.933 13.920 0.876 1.00 27.87 C ATOM 128 C GLY A 28 24.252 12.465 0.611 1.00 28.96 C ATOM 129 O GLY A 28 23.801 11.578 1.346 1.00 28.12 O ATOM 130 H GLY A 28 22.001 13.827 1.850 1.00 0.00 H ATOM 131 N ASP A 29 25.055 12.232 -0.421 1.00 29.72 N ATOM 132 CA ASP A 29 25.288 10.886 -0.950 1.00 31.68 C ATOM 133 C ASP A 29 25.820 9.952 0.131 1.00 30.52 C ATOM 134 O ASP A 29 26.844 10.224 0.742 1.00 29.65 O ATOM 135 CB ASP A 29 26.259 10.934 -2.134 1.00 33.39 C ATOM 136 CG ASP A 29 26.321 9.617 -2.901 1.00 35.63 C ATOM 137 OD1 ASP A 29 26.840 8.600 -2.381 1.00 35.00 O ATOM 138 OD2 ASP A 29 25.860 9.610 -4.057 1.00 39.03 O ATOM 139 H ASP A 29 25.537 13.036 -0.871 1.00 0.00 H ATOM 140 N THR A 30 25.108 8.857 0.373 1.00 30.37 N ATOM 141 CA THR A 30 25.444 7.946 1.466 1.00 29.91 C ATOM 142 C THR A 30 26.452 6.867 1.069 1.00 31.39 C ATOM 143 O THR A 30 26.788 6.024 1.897 1.00 30.51 O ATOM 144 CB THR A 30 24.164 7.273 2.019 1.00 29.77 C ATOM 145 OG1 THR A 30 23.537 6.525 0.980 1.00 30.51 O ATOM 146 CG2 THR A 30 23.184 8.322 2.530 1.00 29.20 C ATOM 147 HG1 THR A 30 23.297 7.133 0.236 1.00 0.00 H ATOM 148 H THR A 30 24.289 8.642 -0.231 1.00 0.00 H ATOM 149 N ASP A 31 26.925 6.882 -0.191 1.00 33.27 N ATOM 150 CA ASP A 31 27.886 5.888 -0.689 1.00 35.39 C ATOM 151 C ASP A 31 29.304 6.415 -0.960 1.00 36.06 C ATOM 152 O ASP A 31 30.245 5.640 -0.898 1.00 38.17 O ATOM 153 CB ASP A 31 27.329 5.196 -1.961 1.00 36.86 C ATOM 154 CG ASP A 31 28.043 3.885 -2.281 1.00 39.15 C ATOM 155 OD1 ASP A 31 27.967 2.920 -1.483 1.00 38.55 O ATOM 156 OD2 ASP A 31 28.693 3.811 -3.345 1.00 41.33 O ATOM 157 H ASP A 31 26.597 7.627 -0.838 1.00 0.00 H ATOM 158 N ASP A 32 29.472 7.705 -1.248 1.00 35.27 N ATOM 159 CA ASP A 32 30.792 8.232 -1.661 1.00 35.95 C ATOM 160 C ASP A 32 31.536 9.041 -0.582 1.00 34.52 C ATOM 161 O ASP A 32 32.587 9.638 -0.862 1.00 33.98 O ATOM 162 CB ASP A 32 30.664 9.046 -2.964 1.00 36.48 C ATOM 163 CG ASP A 32 29.908 10.358 -2.791 1.00 36.33 C ATOM 164 OD1 ASP A 32 29.579 10.734 -1.644 1.00 34.66 O ATOM 165 OD2 ASP A 32 29.644 11.022 -3.822 1.00 37.16 O ATOM 166 H ASP A 32 28.661 8.353 -1.181 1.00 0.00 H ATOM 167 N GLY A 33 31.008 9.041 0.640 1.00 32.60 N ATOM 168 CA GLY A 33 31.594 9.806 1.728 1.00 31.95 C ATOM 169 C GLY A 33 31.040 11.206 1.942 1.00 30.77 C ATOM 170 O GLY A 33 31.250 11.774 3.012 1.00 30.75 O ATOM 171 H GLY A 33 30.153 8.478 0.821 1.00 0.00 H ATOM 172 N THR A 34 30.284 11.745 0.980 1.00 30.15 N ATOM 173 CA THR A 34 29.690 13.083 1.103 1.00 29.53 C ATOM 174 C THR A 34 28.815 13.214 2.357 1.00 26.80 C ATOM 175 O THR A 34 29.060 14.065 3.248 1.00 24.53 O ATOM 176 CB THR A 34 28.859 13.415 -0.164 1.00 31.44 C ATOM 177 OG1 THR A 34 29.709 13.305 -1.301 1.00 34.03 O ATOM 178 CG2 THR A 34 28.281 14.827 -0.127 1.00 31.63 C ATOM 179 HG1 THR A 34 30.062 12.382 -1.359 1.00 0.00 H ATOM 180 H THR A 34 30.110 11.197 0.113 1.00 0.00 H ATOM 181 N GLY A 35 27.805 12.355 2.414 1.00 25.46 N ATOM 182 CA GLY A 35 26.850 12.346 3.523 1.00 24.35 C ATOM 183 C GLY A 35 27.526 12.092 4.848 1.00 23.47 C ATOM 184 O GLY A 35 27.235 12.777 5.832 1.00 22.03 O ATOM 185 H GLY A 35 27.688 11.665 1.645 1.00 0.00 H ATOM 186 N LEU A 36 28.453 11.130 4.864 1.00 23.67 N ATOM 187 CA LEU A 36 29.164 10.751 6.090 1.00 23.43 C ATOM 188 C LEU A 36 29.846 11.944 6.746 1.00 22.92 C ATOM 189 O LEU A 36 29.733 12.141 7.950 1.00 21.72 O ATOM 190 CB LEU A 36 30.215 9.678 5.804 1.00 24.51 C ATOM 191 CG LEU A 36 30.981 9.149 7.021 1.00 24.98 C ATOM 192 CD1 LEU A 36 30.054 8.369 7.942 1.00 25.74 C ATOM 193 CD2 LEU A 36 32.155 8.286 6.589 1.00 26.06 C ATOM 194 H LEU A 36 28.678 10.634 3.978 1.00 0.00 H ATOM 195 N HIS A 37 30.542 12.738 5.937 1.00 22.83 N ATOM 196 CA HIS A 37 31.239 13.914 6.447 1.00 23.46 C ATOM 197 C HIS A 37 30.312 15.085 6.771 1.00 22.44 C ATOM 198 O HIS A 37 30.554 15.823 7.732 1.00 20.88 O ATOM 199 CB HIS A 37 32.359 14.295 5.470 1.00 24.62 C ATOM 200 CG HIS A 37 33.438 13.260 5.420 1.00 25.88 C ATOM 201 ND1 HIS A 37 34.502 13.279 6.288 1.00 26.69 N ATOM 202 CD2 HIS A 37 33.577 12.135 4.681 1.00 26.38 C ATOM 203 CE1 HIS A 37 35.277 12.244 6.054 1.00 26.81 C ATOM 204 NE2 HIS A 37 34.740 11.531 5.083 1.00 27.85 N ATOM 205 H HIS A 37 30.590 12.516 4.922 1.00 0.00 H ATOM 206 N HIS A 38 29.251 15.235 5.983 1.00 22.87 N ATOM 207 CA HIS A 38 28.213 16.222 6.256 1.00 23.91 C ATOM 208 C HIS A 38 27.600 16.031 7.650 1.00 21.52 C ATOM 209 O HIS A 38 27.183 17.005 8.268 1.00 19.61 O ATOM 210 CB HIS A 38 27.124 16.204 5.179 1.00 27.06 C ATOM 211 CG HIS A 38 26.147 17.340 5.286 1.00 31.95 C ATOM 212 ND1 HIS A 38 26.542 18.648 5.486 1.00 35.28 N ATOM 213 CD2 HIS A 38 24.794 17.374 5.200 1.00 34.69 C ATOM 214 CE1 HIS A 38 25.479 19.430 5.541 1.00 35.96 C ATOM 215 NE2 HIS A 38 24.405 18.684 5.365 1.00 35.94 N ATOM 216 H HIS A 38 29.159 14.628 5.144 1.00 0.00 H ATOM 217 N MET A 39 27.557 14.788 8.130 1.00 20.24 N ATOM 218 CA MET A 39 27.063 14.503 9.508 1.00 19.55 C ATOM 219 C MET A 39 27.866 15.284 10.541 1.00 18.66 C ATOM 220 O MET A 39 27.298 15.920 11.454 1.00 18.54 O ATOM 221 CB MET A 39 27.157 13.014 9.851 1.00 19.76 C ATOM 222 CG MET A 39 26.322 12.105 8.974 1.00 19.64 C ATOM 223 SD MET A 39 24.657 11.868 9.595 1.00 19.01 S ATOM 224 CE MET A 39 24.970 10.673 10.906 1.00 18.77 C ATOM 225 H MET A 39 27.875 14.000 7.530 1.00 0.00 H ATOM 226 N VAL A 40 29.190 15.266 10.382 1.00 18.79 N ATOM 227 CA VAL A 40 30.045 16.064 11.273 1.00 18.45 C ATOM 228 C VAL A 40 29.757 17.553 11.118 1.00 18.39 C ATOM 229 O VAL A 40 29.643 18.272 12.113 1.00 17.25 O ATOM 230 CB VAL A 40 31.534 15.810 11.036 1.00 18.93 C ATOM 231 CG1 VAL A 40 32.376 16.640 12.003 1.00 19.28 C ATOM 232 CG2 VAL A 40 31.846 14.323 11.217 1.00 19.31 C ATOM 233 H VAL A 40 29.617 14.689 9.629 1.00 0.00 H ATOM 234 N PHE A 41 29.653 18.022 9.873 1.00 18.54 N ATOM 235 CA PHE A 41 29.506 19.467 9.640 1.00 18.67 C ATOM 236 C PHE A 41 28.217 20.018 10.229 1.00 18.85 C ATOM 237 O PHE A 41 28.199 21.128 10.742 1.00 18.23 O ATOM 238 CB PHE A 41 29.659 19.806 8.158 1.00 19.12 C ATOM 239 CG PHE A 41 30.964 19.311 7.547 1.00 19.53 C ATOM 240 CD1 PHE A 41 32.142 19.304 8.279 1.00 19.97 C ATOM 241 CD2 PHE A 41 31.001 18.875 6.232 1.00 20.09 C ATOM 242 CE1 PHE A 41 33.328 18.847 7.723 1.00 20.89 C ATOM 243 CE2 PHE A 41 32.184 18.441 5.653 1.00 20.86 C ATOM 244 CZ PHE A 41 33.348 18.409 6.408 1.00 20.98 C ATOM 245 H PHE A 41 29.676 17.365 9.067 1.00 0.00 H ATOM 246 N GLU A 42 27.146 19.230 10.219 1.00 19.44 N ATOM 247 CA GLU A 42 25.887 19.672 10.838 1.00 20.61 C ATOM 248 C GLU A 42 26.027 19.859 12.338 1.00 18.89 C ATOM 249 O GLU A 42 25.517 20.840 12.890 1.00 19.20 O ATOM 250 CB GLU A 42 24.759 18.662 10.594 1.00 22.41 C ATOM 251 CG GLU A 42 24.212 18.714 9.190 1.00 26.40 C ATOM 252 CD GLU A 42 23.687 20.110 8.836 1.00 29.18 C ATOM 253 OE1 GLU A 42 22.858 20.674 9.594 1.00 30.58 O ATOM 254 OE2 GLU A 42 24.162 20.671 7.822 1.00 33.39 O ATOM 255 H GLU A 42 27.199 18.293 9.770 1.00 0.00 H ATOM 256 N VAL A 43 26.709 18.929 12.985 1.00 17.79 N ATOM 257 CA VAL A 43 26.908 19.015 14.442 1.00 17.77 C ATOM 258 C VAL A 43 27.806 20.233 14.727 1.00 17.66 C ATOM 259 O VAL A 43 27.539 21.021 15.633 1.00 17.64 O ATOM 260 CB VAL A 43 27.528 17.740 15.038 1.00 17.60 C ATOM 261 CG1 VAL A 43 27.728 17.869 16.551 1.00 17.79 C ATOM 262 CG2 VAL A 43 26.630 16.519 14.782 1.00 17.71 C ATOM 263 H VAL A 43 27.110 18.127 12.459 1.00 0.00 H ATOM 264 N VAL A 44 28.868 20.374 13.946 1.00 17.67 N ATOM 265 CA VAL A 44 29.795 21.501 14.116 1.00 18.18 C ATOM 266 C VAL A 44 29.103 22.859 13.983 1.00 19.53 C ATOM 267 O VAL A 44 29.402 23.777 14.746 1.00 19.24 O ATOM 268 CB VAL A 44 30.980 21.363 13.156 1.00 18.03 C ATOM 269 CG1 VAL A 44 31.796 22.633 13.052 1.00 18.64 C ATOM 270 CG2 VAL A 44 31.874 20.222 13.632 1.00 17.89 C ATOM 271 H VAL A 44 29.048 19.673 13.199 1.00 0.00 H ATOM 272 N ASP A 45 28.178 22.997 13.036 1.00 20.78 N ATOM 273 CA ASP A 45 27.435 24.260 12.902 1.00 23.74 C ATOM 274 C ASP A 45 26.754 24.652 14.215 1.00 23.54 C ATOM 275 O ASP A 45 26.794 25.810 14.637 1.00 23.98 O ATOM 276 CB ASP A 45 26.390 24.173 11.771 1.00 25.94 C ATOM 277 CG ASP A 45 26.964 24.488 10.405 1.00 28.89 C ATOM 278 OD1 ASP A 45 28.030 25.139 10.318 1.00 31.40 O ATOM 279 OD2 ASP A 45 26.326 24.104 9.385 1.00 31.11 O ATOM 280 H ASP A 45 27.979 22.208 12.388 1.00 0.00 H ATOM 281 N ASN A 46 26.145 23.672 14.867 1.00 23.10 N ATOM 282 CA ASN A 46 25.442 23.926 16.106 1.00 23.83 C ATOM 283 C ASN A 46 26.423 24.237 17.226 1.00 21.95 C ATOM 284 O ASN A 46 26.185 25.147 18.017 1.00 22.41 O ATOM 285 CB ASN A 46 24.541 22.751 16.438 1.00 25.10 C ATOM 286 CG ASN A 46 23.394 22.634 15.461 1.00 27.78 C ATOM 287 OD1 ASN A 46 23.407 21.803 14.554 1.00 31.82 O ATOM 288 ND2 ASN A 46 22.425 23.505 15.608 1.00 29.62 N ATOM 289 HD22 ASN A 46 22.456 24.190 16.390 1.00 0.00 H ATOM 290 HD21 ASN A 46 21.626 23.511 14.942 1.00 0.00 H ATOM 291 H ASN A 46 26.173 22.706 14.482 1.00 0.00 H ATOM 292 N ALA A 47 27.539 23.515 17.255 1.00 20.27 N ATOM 293 CA ALA A 47 28.583 23.741 18.251 1.00 20.54 C ATOM 294 C ALA A 47 29.191 25.135 18.138 1.00 20.89 C ATOM 295 O ALA A 47 29.469 25.754 19.147 1.00 20.89 O ATOM 296 CB ALA A 47 29.675 22.707 18.137 1.00 20.27 C ATOM 297 H ALA A 47 27.673 22.766 16.546 1.00 0.00 H ATOM 298 N ILE A 48 29.401 25.608 16.915 1.00 21.59 N ATOM 299 CA ILE A 48 29.960 26.951 16.712 1.00 22.87 C ATOM 300 C ILE A 48 28.977 28.022 17.202 1.00 23.91 C ATOM 301 O ILE A 48 29.409 28.943 17.896 1.00 25.48 O ATOM 302 CB ILE A 48 30.419 27.186 15.253 1.00 23.39 C ATOM 303 CG1 ILE A 48 31.680 26.355 14.969 1.00 23.37 C ATOM 304 CG2 ILE A 48 30.687 28.681 15.005 1.00 24.12 C ATOM 305 CD1 ILE A 48 32.087 26.269 13.513 1.00 23.92 C ATOM 306 H ILE A 48 29.167 25.020 16.090 1.00 0.00 H ATOM 307 N ASP A 49 27.680 27.888 16.883 1.00 25.67 N ATOM 308 CA ASP A 49 26.628 28.784 17.415 1.00 28.39 C ATOM 309 C ASP A 49 26.683 28.853 18.939 1.00 28.04 C ATOM 310 O ASP A 49 26.574 29.931 19.522 1.00 27.06 O ATOM 311 CB ASP A 49 25.205 28.323 17.032 1.00 31.00 C ATOM 312 CG ASP A 49 24.878 28.517 15.553 1.00 34.30 C ATOM 313 OD1 ASP A 49 25.580 29.290 14.862 1.00 38.01 O ATOM 314 OD2 ASP A 49 23.898 27.885 15.078 1.00 35.71 O ATOM 315 H ASP A 49 27.402 27.123 16.235 1.00 0.00 H ATOM 316 N GLU A 50 26.828 27.687 19.569 1.00 26.70 N ATOM 317 CA GLU A 50 26.903 27.597 21.027 1.00 26.93 C ATOM 318 C GLU A 50 28.155 28.251 21.587 1.00 26.99 C ATOM 319 O GLU A 50 28.078 29.008 22.557 1.00 27.67 O ATOM 320 CB GLU A 50 26.823 26.135 21.481 1.00 27.05 C ATOM 321 CG GLU A 50 25.435 25.522 21.322 1.00 27.55 C ATOM 322 CD GLU A 50 24.397 26.209 22.183 1.00 28.79 C ATOM 323 OE1 GLU A 50 23.383 26.704 21.631 1.00 30.00 O ATOM 324 OE2 GLU A 50 24.612 26.279 23.409 1.00 28.63 O ATOM 325 H GLU A 50 26.890 26.814 19.006 1.00 0.00 H ATOM 326 N ALA A 51 29.298 27.975 20.974 1.00 26.22 N ATOM 327 CA ALA A 51 30.561 28.541 21.433 1.00 27.43 C ATOM 328 C ALA A 51 30.583 30.061 21.336 1.00 29.08 C ATOM 329 O ALA A 51 31.158 30.703 22.208 1.00 29.87 O ATOM 330 CB ALA A 51 31.732 27.945 20.668 1.00 26.74 C ATOM 331 H ALA A 51 29.294 27.342 20.149 1.00 0.00 H ATOM 332 N LEU A 52 29.956 30.615 20.292 1.00 30.97 N ATOM 333 CA LEU A 52 29.866 32.076 20.071 1.00 33.38 C ATOM 334 C LEU A 52 29.151 32.827 21.191 1.00 34.97 C ATOM 335 O LEU A 52 29.478 33.986 21.454 1.00 34.45 O ATOM 336 CB LEU A 52 29.152 32.402 18.745 1.00 34.60 C ATOM 337 CG LEU A 52 29.924 32.219 17.432 1.00 35.30 C ATOM 338 CD1 LEU A 52 28.973 32.209 16.239 1.00 35.24 C ATOM 339 CD2 LEU A 52 30.992 33.293 17.254 1.00 35.85 C ATOM 340 H LEU A 52 29.507 29.984 19.597 1.00 0.00 H ATOM 341 N ALA A 53 28.172 32.183 21.832 1.00 36.02 N ATOM 342 CA ALA A 53 27.413 32.804 22.937 1.00 37.26 C ATOM 343 C ALA A 53 28.046 32.610 24.328 1.00 38.70 C ATOM 344 O ALA A 53 27.446 33.006 25.345 1.00 40.09 O ATOM 345 CB ALA A 53 25.975 32.302 22.925 1.00 37.47 C ATOM 346 H ALA A 53 27.936 31.212 21.544 1.00 0.00 H ATOM 347 N GLY A 54 29.240 32.005 24.385 1.00 38.07 N ATOM 348 CA GLY A 54 30.004 31.849 25.633 1.00 38.39 C ATOM 349 C GLY A 54 31.247 32.729 25.626 1.00 39.18 C ATOM 350 O GLY A 54 31.519 33.419 24.639 1.00 39.06 O ATOM 351 H GLY A 54 29.646 31.628 23.505 1.00 0.00 H ATOM 352 N HIS A 55 32.010 32.687 26.718 1.00 39.69 N ATOM 353 CA HIS A 55 33.186 33.559 26.903 1.00 40.38 C ATOM 354 C HIS A 55 34.452 33.016 26.226 1.00 39.97 C ATOM 355 O HIS A 55 35.137 33.763 25.526 1.00 39.90 O ATOM 356 CB HIS A 55 33.466 33.803 28.398 1.00 41.82 C ATOM 357 H HIS A 55 31.767 32.012 27.471 1.00 0.00 H ATOM 358 N CYS A 56 34.747 31.726 26.426 1.00 39.07 N ATOM 359 CA CYS A 56 36.018 31.119 25.961 1.00 38.75 C ATOM 360 C CYS A 56 36.065 30.762 24.460 1.00 35.81 C ATOM 361 O CYS A 56 37.142 30.814 23.846 1.00 35.25 O ATOM 362 CB CYS A 56 36.342 29.898 26.801 1.00 40.12 C ATOM 363 SG CYS A 56 36.689 30.348 28.505 1.00 46.45 S ATOM 364 H CYS A 56 34.060 31.127 26.926 1.00 0.00 H ATOM 365 N LYS A 57 34.910 30.375 23.909 1.00 32.15 N ATOM 366 CA LYS A 57 34.689 30.237 22.466 1.00 29.93 C ATOM 367 C LYS A 57 35.606 29.201 21.815 1.00 28.10 C ATOM 368 O LYS A 57 36.383 29.525 20.922 1.00 27.16 O ATOM 369 CB LYS A 57 34.831 31.598 21.757 1.00 31.59 C ATOM 370 CG LYS A 57 33.907 32.683 22.287 1.00 32.78 C ATOM 371 CD LYS A 57 34.206 34.021 21.632 1.00 35.12 C ATOM 372 CE LYS A 57 32.966 34.891 21.521 1.00 36.81 C ATOM 373 NZ LYS A 57 32.411 35.271 22.846 1.00 37.68 N ATOM 374 HZ1 LYS A 57 32.152 34.412 23.371 1.00 0.00 H ATOM 375 HZ2 LYS A 57 33.127 35.803 23.381 1.00 0.00 H ATOM 376 HZ3 LYS A 57 31.567 35.863 22.710 1.00 0.00 H ATOM 377 H LYS A 57 34.117 30.158 24.545 1.00 0.00 H ATOM 378 N GLU A 58 35.504 27.961 22.271 1.00 26.12 N ATOM 379 CA GLU A 58 36.270 26.868 21.707 1.00 25.23 C ATOM 380 C GLU A 58 35.371 25.666 21.467 1.00 23.65 C ATOM 381 O GLU A 58 34.519 25.337 22.297 1.00 22.18 O ATOM 382 CB GLU A 58 37.444 26.449 22.604 1.00 26.65 C ATOM 383 CG GLU A 58 38.333 25.383 21.941 1.00 27.37 C ATOM 384 CD GLU A 58 39.712 25.205 22.581 1.00 29.23 C ATOM 385 OE1 GLU A 58 39.814 24.440 23.564 1.00 30.18 O ATOM 386 OE2 GLU A 58 40.701 25.788 22.064 1.00 29.33 O ATOM 387 H GLU A 58 34.854 27.766 23.059 1.00 0.00 H ATOM 388 N ILE A 59 35.591 25.021 20.330 1.00 22.45 N ATOM 389 CA ILE A 59 35.017 23.714 20.042 1.00 21.51 C ATOM 390 C ILE A 59 36.138 22.701 19.806 1.00 21.29 C ATOM 391 O ILE A 59 37.214 23.059 19.306 1.00 21.04 O ATOM 392 CB ILE A 59 34.033 23.747 18.851 1.00 22.26 C ATOM 393 CG1 ILE A 59 34.737 24.013 17.517 1.00 23.77 C ATOM 394 CG2 ILE A 59 32.935 24.780 19.095 1.00 21.81 C ATOM 395 CD1 ILE A 59 33.944 23.528 16.305 1.00 24.53 C ATOM 396 H ILE A 59 36.199 25.467 19.614 1.00 0.00 H ATOM 397 N ILE A 60 35.868 21.442 20.152 1.00 20.49 N ATOM 398 CA ILE A 60 36.811 20.358 19.956 1.00 20.71 C ATOM 399 C ILE A 60 36.092 19.251 19.171 1.00 20.02 C ATOM 400 O ILE A 60 35.021 18.782 19.594 1.00 18.97 O ATOM 401 CB ILE A 60 37.358 19.810 21.296 1.00 21.80 C ATOM 402 CG1 ILE A 60 37.977 20.935 22.132 1.00 22.89 C ATOM 403 CG2 ILE A 60 38.409 18.734 21.018 1.00 22.60 C ATOM 404 CD1 ILE A 60 38.320 20.534 23.549 1.00 23.86 C ATOM 405 H ILE A 60 34.944 21.229 20.580 1.00 0.00 H ATOM 406 N VAL A 61 36.685 18.861 18.040 1.00 19.18 N ATOM 407 CA VAL A 61 36.159 17.800 17.178 1.00 19.46 C ATOM 408 C VAL A 61 37.157 16.661 17.241 1.00 20.49 C ATOM 409 O VAL A 61 38.334 16.831 16.876 1.00 21.47 O ATOM 410 CB VAL A 61 36.011 18.266 15.717 1.00 19.01 C ATOM 411 CG1 VAL A 61 35.430 17.143 14.829 1.00 18.98 C ATOM 412 CG2 VAL A 61 35.141 19.505 15.650 1.00 19.04 C ATOM 413 H VAL A 61 37.566 19.335 17.756 1.00 0.00 H ATOM 414 N THR A 62 36.677 15.498 17.665 1.00 20.86 N ATOM 415 CA THR A 62 37.522 14.329 17.871 1.00 22.02 C ATOM 416 C THR A 62 37.016 13.159 17.050 1.00 22.75 C ATOM 417 O THR A 62 35.831 12.820 17.123 1.00 22.20 O ATOM 418 CB THR A 62 37.534 13.902 19.339 1.00 22.04 C ATOM 419 OG1 THR A 62 37.907 15.019 20.149 1.00 22.11 O ATOM 420 CG2 THR A 62 38.507 12.739 19.560 1.00 22.91 C ATOM 421 HG1 THR A 62 37.253 15.751 20.020 1.00 0.00 H ATOM 422 H THR A 62 35.658 15.418 17.858 1.00 0.00 H ATOM 423 N ILE A 63 37.929 12.565 16.286 1.00 23.43 N ATOM 424 CA ILE A 63 37.696 11.298 15.600 1.00 24.65 C ATOM 425 C ILE A 63 38.209 10.213 16.529 1.00 25.44 C ATOM 426 O ILE A 63 39.404 10.191 16.862 1.00 26.17 O ATOM 427 CB ILE A 63 38.445 11.192 14.259 1.00 26.04 C ATOM 428 CG1 ILE A 63 38.140 12.399 13.359 1.00 25.86 C ATOM 429 CG2 ILE A 63 38.081 9.874 13.571 1.00 27.04 C ATOM 430 CD1 ILE A 63 39.069 12.517 12.167 1.00 26.73 C ATOM 431 H ILE A 63 38.854 13.026 16.172 1.00 0.00 H ATOM 432 N HIS A 64 37.304 9.330 16.940 1.00 24.67 N ATOM 433 CA HIS A 64 37.614 8.254 17.873 1.00 25.92 C ATOM 434 C HIS A 64 38.030 7.004 17.090 1.00 27.58 C ATOM 435 O HIS A 64 37.733 6.867 15.904 1.00 27.51 O ATOM 436 CB HIS A 64 36.420 8.007 18.809 1.00 25.04 C ATOM 437 CG HIS A 64 36.072 9.195 19.659 1.00 24.19 C ATOM 438 ND1 HIS A 64 36.523 9.348 20.956 1.00 24.26 N ATOM 439 CD2 HIS A 64 35.323 10.296 19.390 1.00 23.30 C ATOM 440 CE1 HIS A 64 36.069 10.489 21.445 1.00 24.09 C ATOM 441 NE2 HIS A 64 35.339 11.081 20.513 1.00 22.82 N ATOM 442 H HIS A 64 36.332 9.411 16.580 1.00 0.00 H ATOM 443 N ALA A 65 38.741 6.107 17.770 1.00 29.97 N ATOM 444 CA ALA A 65 39.289 4.905 17.144 1.00 32.25 C ATOM 445 C ALA A 65 38.198 3.963 16.646 1.00 33.18 C ATOM 446 O ALA A 65 38.425 3.216 15.690 1.00 33.90 O ATOM 447 CB ALA A 65 40.217 4.182 18.110 1.00 33.50 C ATOM 448 H ALA A 65 38.913 6.267 18.783 1.00 0.00 H ATOM 449 N ASP A 66 37.011 4.042 17.258 1.00 33.07 N ATOM 450 CA ASP A 66 35.858 3.211 16.872 1.00 33.81 C ATOM 451 C ASP A 66 34.976 3.828 15.783 1.00 34.14 C ATOM 452 O ASP A 66 33.826 3.432 15.632 1.00 34.46 O ATOM 453 CB ASP A 66 35.017 2.866 18.115 1.00 33.57 C ATOM 454 CG ASP A 66 34.282 4.068 18.704 1.00 32.38 C ATOM 455 OD1 ASP A 66 34.520 5.223 18.294 1.00 31.84 O ATOM 456 OD2 ASP A 66 33.443 3.855 19.590 1.00 32.33 O ATOM 457 H ASP A 66 36.898 4.719 18.039 1.00 0.00 H ATOM 458 N ASN A 67 35.508 4.812 15.055 1.00 34.84 N ATOM 459 CA ASN A 67 34.816 5.440 13.935 1.00 35.57 C ATOM 460 C ASN A 67 33.628 6.326 14.335 1.00 32.29 C ATOM 461 O ASN A 67 32.722 6.544 13.531 1.00 34.38 O ATOM 462 CB ASN A 67 34.342 4.376 12.928 1.00 38.75 C ATOM 463 CG ASN A 67 33.980 4.982 11.593 1.00 41.50 C ATOM 464 OD1 ASN A 67 34.746 5.788 11.049 1.00 44.21 O ATOM 465 ND2 ASN A 67 32.786 4.662 11.087 1.00 42.72 N ATOM 466 HD22 ASN A 67 32.178 3.979 11.582 1.00 0.00 H ATOM 467 HD21 ASN A 67 32.465 5.096 10.198 1.00 0.00 H ATOM 468 H ASN A 67 36.462 5.147 15.298 1.00 0.00 H ATOM 469 N SER A 68 33.612 6.819 15.566 1.00 27.74 N ATOM 470 CA SER A 68 32.610 7.811 15.975 1.00 24.37 C ATOM 471 C SER A 68 33.303 9.150 15.975 1.00 22.56 C ATOM 472 O SER A 68 34.544 9.209 15.953 1.00 21.67 O ATOM 473 CB SER A 68 32.050 7.490 17.360 1.00 24.23 C ATOM 474 OG SER A 68 33.063 7.466 18.344 1.00 24.04 O ATOM 475 HG SER A 68 33.732 6.774 18.111 1.00 0.00 H ATOM 476 H SER A 68 34.322 6.497 16.254 1.00 0.00 H ATOM 477 N VAL A 69 32.510 10.217 15.975 1.00 20.81 N ATOM 478 CA VAL A 69 33.026 11.571 16.112 1.00 20.26 C ATOM 479 C VAL A 69 32.314 12.258 17.267 1.00 19.22 C ATOM 480 O VAL A 69 31.105 12.091 17.456 1.00 18.67 O ATOM 481 CB VAL A 69 32.843 12.398 14.818 1.00 20.36 C ATOM 482 CG1 VAL A 69 33.141 13.873 15.038 1.00 20.34 C ATOM 483 CG2 VAL A 69 33.746 11.856 13.733 1.00 21.58 C ATOM 484 H VAL A 69 31.484 10.079 15.873 1.00 0.00 H ATOM 485 N SER A 70 33.071 13.009 18.056 1.00 18.58 N ATOM 486 CA SER A 70 32.471 13.874 19.064 1.00 18.39 C ATOM 487 C SER A 70 32.788 15.327 18.798 1.00 18.02 C ATOM 488 O SER A 70 33.854 15.656 18.264 1.00 18.84 O ATOM 489 CB SER A 70 32.906 13.477 20.466 1.00 18.82 C ATOM 490 OG SER A 70 34.286 13.696 20.665 1.00 20.19 O ATOM 491 HG SER A 70 34.489 14.656 20.535 1.00 0.00 H ATOM 492 H SER A 70 34.106 12.980 17.954 1.00 0.00 H ATOM 493 N VAL A 71 31.853 16.189 19.159 1.00 17.91 N ATOM 494 CA VAL A 71 31.992 17.633 19.013 1.00 18.22 C ATOM 495 C VAL A 71 31.574 18.220 20.349 1.00 19.35 C ATOM 496 O VAL A 71 30.464 17.957 20.822 1.00 18.67 O ATOM 497 CB VAL A 71 31.093 18.202 17.900 1.00 18.14 C ATOM 498 CG1 VAL A 71 31.317 19.691 17.732 1.00 18.15 C ATOM 499 CG2 VAL A 71 31.356 17.512 16.570 1.00 18.05 C ATOM 500 H VAL A 71 30.972 15.818 19.569 1.00 0.00 H ATOM 501 N GLN A 72 32.475 18.982 20.962 1.00 20.94 N ATOM 502 CA GLN A 72 32.243 19.608 22.260 1.00 22.48 C ATOM 503 C GLN A 72 32.342 21.097 22.076 1.00 22.28 C ATOM 504 O GLN A 72 33.215 21.549 21.327 1.00 21.17 O ATOM 505 CB GLN A 72 33.368 19.297 23.248 1.00 25.28 C ATOM 506 CG GLN A 72 33.813 17.863 23.357 1.00 28.36 C ATOM 507 CD GLN A 72 35.153 17.740 24.067 1.00 29.60 C ATOM 508 OE1 GLN A 72 36.028 17.008 23.618 1.00 30.42 O ATOM 509 NE2 GLN A 72 35.304 18.438 25.193 1.00 29.98 N ATOM 510 HE22 GLN A 72 34.533 19.046 25.535 1.00 0.00 H ATOM 511 HE21 GLN A 72 36.193 18.374 25.729 1.00 0.00 H ATOM 512 H GLN A 72 33.390 19.140 20.494 1.00 0.00 H ATOM 513 N ASP A 73 31.503 21.837 22.794 1.00 21.88 N ATOM 514 CA ASP A 73 31.682 23.285 22.957 1.00 22.77 C ATOM 515 C ASP A 73 31.701 23.663 24.431 1.00 23.64 C ATOM 516 O ASP A 73 31.320 22.876 25.301 1.00 22.13 O ATOM 517 CB ASP A 73 30.605 24.058 22.216 1.00 23.19 C ATOM 518 CG ASP A 73 29.244 23.940 22.880 1.00 24.57 C ATOM 519 OD1 ASP A 73 28.995 24.694 23.839 1.00 25.74 O ATOM 520 OD2 ASP A 73 28.440 23.110 22.433 1.00 25.16 O ATOM 521 H ASP A 73 30.693 21.375 23.255 1.00 0.00 H ATOM 522 N ASP A 74 32.151 24.880 24.686 1.00 25.06 N ATOM 523 CA ASP A 74 32.201 25.426 26.041 1.00 27.75 C ATOM 524 C ASP A 74 31.209 26.575 26.197 1.00 28.50 C ATOM 525 O ASP A 74 31.471 27.531 26.945 1.00 29.70 O ATOM 526 CB ASP A 74 33.626 25.883 26.380 1.00 29.48 C ATOM 527 CG ASP A 74 34.183 26.913 25.369 1.00 30.58 C ATOM 528 OD1 ASP A 74 33.441 27.378 24.468 1.00 30.99 O ATOM 529 OD2 ASP A 74 35.384 27.228 25.460 1.00 33.34 O ATOM 530 H ASP A 74 32.481 25.469 23.895 1.00 0.00 H ATOM 531 N GLY A 75 30.079 26.489 25.506 1.00 28.22 N ATOM 532 CA GLY A 75 29.044 27.513 25.581 1.00 29.52 C ATOM 533 C GLY A 75 28.192 27.345 26.828 1.00 30.57 C ATOM 534 O GLY A 75 28.662 26.819 27.830 1.00 31.63 O ATOM 535 H GLY A 75 29.927 25.664 24.891 1.00 0.00 H ATOM 536 N ARG A 76 26.935 27.767 26.748 1.00 32.68 N ATOM 537 CA ARG A 76 26.039 27.819 27.924 1.00 34.63 C ATOM 538 C ARG A 76 25.401 26.472 28.268 1.00 33.39 C ATOM 539 O ARG A 76 24.870 26.319 29.372 1.00 33.07 O ATOM 540 CB ARG A 76 24.890 28.820 27.701 1.00 38.26 C ATOM 541 CG ARG A 76 25.296 30.266 27.370 1.00 42.20 C ATOM 542 CD ARG A 76 24.229 30.969 26.526 1.00 45.62 C ATOM 543 NE ARG A 76 24.049 30.292 25.231 1.00 48.21 N ATOM 544 CZ ARG A 76 23.142 30.604 24.301 1.00 51.54 C ATOM 545 NH1 ARG A 76 22.292 31.616 24.482 1.00 53.97 N ATOM 546 NH2 ARG A 76 23.087 29.895 23.172 1.00 51.38 N ATOM 547 HE ARG A 76 24.687 29.498 25.021 1.00 0.00 H ATOM 548 HH12 ARG A 76 21.592 31.845 23.748 1.00 0.00 H ATOM 549 HH11 ARG A 76 22.329 32.176 25.358 1.00 0.00 H ATOM 550 HH22 ARG A 76 22.384 30.132 22.443 1.00 0.00 H ATOM 551 HH21 ARG A 76 23.747 29.106 23.021 1.00 0.00 H ATOM 552 H ARG A 76 26.567 28.072 25.824 1.00 0.00 H ATOM 553 N GLY A 77 25.420 25.528 27.323 1.00 31.23 N ATOM 554 CA GLY A 77 24.649 24.297 27.423 1.00 31.16 C ATOM 555 C GLY A 77 23.311 24.512 26.748 1.00 31.21 C ATOM 556 O GLY A 77 22.651 25.540 26.982 1.00 31.81 O ATOM 557 H GLY A 77 26.010 25.679 26.480 1.00 0.00 H ATOM 558 N ILE A 78 22.897 23.568 25.909 1.00 30.77 N ATOM 559 CA ILE A 78 21.587 23.685 25.268 1.00 31.42 C ATOM 560 C ILE A 78 20.477 23.488 26.311 1.00 31.38 C ATOM 561 O ILE A 78 20.689 22.805 27.326 1.00 29.93 O ATOM 562 CB ILE A 78 21.422 22.787 24.032 1.00 32.68 C ATOM 563 CG1 ILE A 78 21.454 21.305 24.375 1.00 33.05 C ATOM 564 CG2 ILE A 78 22.493 23.134 22.997 1.00 32.34 C ATOM 565 CD1 ILE A 78 21.047 20.432 23.205 1.00 34.23 C ATOM 566 H ILE A 78 23.503 22.747 25.708 1.00 0.00 H ATOM 567 N PRO A 79 19.305 24.107 26.078 1.00 30.50 N ATOM 568 CA PRO A 79 18.285 24.104 27.139 1.00 30.72 C ATOM 569 C PRO A 79 17.784 22.703 27.465 1.00 28.80 C ATOM 570 O PRO A 79 17.641 21.867 26.569 1.00 28.54 O ATOM 571 CB PRO A 79 17.157 24.989 26.575 1.00 31.48 C ATOM 572 CG PRO A 79 17.388 25.059 25.107 1.00 31.99 C ATOM 573 CD PRO A 79 18.870 24.860 24.883 1.00 31.21 C ATOM 574 N THR A 80 17.545 22.466 28.748 1.00 28.66 N ATOM 575 CA THR A 80 17.172 21.134 29.251 1.00 28.46 C ATOM 576 C THR A 80 15.709 21.035 29.712 1.00 28.41 C ATOM 577 O THR A 80 15.161 19.923 29.822 1.00 28.57 O ATOM 578 CB THR A 80 18.090 20.735 30.414 1.00 29.10 C ATOM 579 OG1 THR A 80 17.941 21.671 31.492 1.00 30.28 O ATOM 580 CG2 THR A 80 19.562 20.697 29.952 1.00 29.16 C ATOM 581 HG1 THR A 80 17.000 21.670 31.801 1.00 0.00 H ATOM 582 H THR A 80 17.624 23.252 29.425 1.00 0.00 H ATOM 583 N GLY A 81 15.086 22.181 29.999 1.00 27.36 N ATOM 584 CA GLY A 81 13.716 22.222 30.489 1.00 27.27 C ATOM 585 C GLY A 81 12.688 21.583 29.570 1.00 26.98 C ATOM 586 O GLY A 81 12.878 21.493 28.357 1.00 25.93 O ATOM 587 H GLY A 81 15.598 23.076 29.868 1.00 0.00 H ATOM 588 N ILE A 82 11.580 21.151 30.159 1.00 26.86 N ATOM 589 CA ILE A 82 10.528 20.484 29.411 1.00 26.76 C ATOM 590 C ILE A 82 9.915 21.475 28.420 1.00 27.91 C ATOM 591 O ILE A 82 9.541 22.592 28.797 1.00 27.77 O ATOM 592 CB ILE A 82 9.442 19.904 30.348 1.00 27.20 C ATOM 593 CG1 ILE A 82 10.025 18.843 31.310 1.00 26.99 C ATOM 594 CG2 ILE A 82 8.271 19.349 29.548 1.00 27.35 C ATOM 595 CD1 ILE A 82 10.693 17.647 30.661 1.00 26.17 C ATOM 596 H ILE A 82 11.462 21.294 31.182 1.00 0.00 H ATOM 597 N HIS A 83 9.848 21.072 27.154 1.00 27.97 N ATOM 598 CA HIS A 83 9.131 21.835 26.129 1.00 29.78 C ATOM 599 C HIS A 83 7.616 21.793 26.430 1.00 31.27 C ATOM 600 O HIS A 83 7.027 20.715 26.476 1.00 30.26 O ATOM 601 CB HIS A 83 9.441 21.251 24.747 1.00 29.68 C ATOM 602 CG HIS A 83 9.078 22.152 23.612 1.00 31.38 C ATOM 603 ND1 HIS A 83 7.773 22.419 23.261 1.00 33.07 N ATOM 604 CD2 HIS A 83 9.850 22.839 22.737 1.00 31.58 C ATOM 605 CE1 HIS A 83 7.752 23.238 22.225 1.00 33.09 C ATOM 606 NE2 HIS A 83 8.999 23.515 21.891 1.00 32.44 N ATOM 607 H HIS A 83 10.320 20.186 26.883 1.00 0.00 H ATOM 608 N PRO A 84 6.981 22.965 26.659 1.00 33.57 N ATOM 609 CA PRO A 84 5.583 22.955 27.120 1.00 35.25 C ATOM 610 C PRO A 84 4.572 22.327 26.161 1.00 36.02 C ATOM 611 O PRO A 84 3.595 21.736 26.620 1.00 38.22 O ATOM 612 CB PRO A 84 5.267 24.442 27.352 1.00 36.74 C ATOM 613 CG PRO A 84 6.278 25.193 26.576 1.00 36.14 C ATOM 614 CD PRO A 84 7.512 24.336 26.529 1.00 34.75 C ATOM 615 N GLU A 85 4.779 22.474 24.858 1.00 35.71 N ATOM 616 CA GLU A 85 3.974 21.776 23.845 1.00 36.50 C ATOM 617 C GLU A 85 4.294 20.270 23.644 1.00 36.16 C ATOM 618 O GLU A 85 3.374 19.462 23.572 1.00 35.28 O ATOM 619 CB GLU A 85 4.077 22.508 22.500 1.00 37.54 C ATOM 620 H GLU A 85 5.540 23.108 24.541 1.00 0.00 H ATOM 621 N GLU A 86 5.577 19.892 23.551 1.00 35.48 N ATOM 622 CA GLU A 86 5.968 18.515 23.224 1.00 34.61 C ATOM 623 C GLU A 86 6.000 17.617 24.448 1.00 32.06 C ATOM 624 O GLU A 86 5.880 16.410 24.322 1.00 31.97 O ATOM 625 CB GLU A 86 7.339 18.473 22.542 1.00 35.98 C ATOM 626 CG GLU A 86 7.388 19.152 21.184 1.00 38.26 C ATOM 627 CD GLU A 86 6.702 18.361 20.081 1.00 40.75 C ATOM 628 OE1 GLU A 86 6.085 17.305 20.350 1.00 42.91 O ATOM 629 OE2 GLU A 86 6.778 18.813 18.919 1.00 44.88 O ATOM 630 H GLU A 86 6.322 20.599 23.716 1.00 0.00 H ATOM 631 N GLY A 87 6.161 18.197 25.633 1.00 29.94 N ATOM 632 CA GLY A 87 6.105 17.421 26.879 1.00 28.19 C ATOM 633 C GLY A 87 7.333 16.564 27.146 1.00 26.04 C ATOM 634 O GLY A 87 7.271 15.632 27.940 1.00 25.56 O ATOM 635 H GLY A 87 6.330 19.222 25.679 1.00 0.00 H ATOM 636 N VAL A 88 8.431 16.873 26.466 1.00 23.90 N ATOM 637 CA VAL A 88 9.723 16.226 26.720 1.00 22.37 C ATOM 638 C VAL A 88 10.752 17.334 26.767 1.00 21.39 C ATOM 639 O VAL A 88 10.486 18.459 26.336 1.00 21.26 O ATOM 640 CB VAL A 88 10.099 15.188 25.631 1.00 21.61 C ATOM 641 CG1 VAL A 88 9.099 14.045 25.625 1.00 22.14 C ATOM 642 CG2 VAL A 88 10.218 15.815 24.257 1.00 21.66 C ATOM 643 H VAL A 88 8.373 17.601 25.726 1.00 0.00 H ATOM 644 N SER A 89 11.954 17.018 27.239 1.00 20.65 N ATOM 645 CA SER A 89 13.022 18.017 27.284 1.00 20.52 C ATOM 646 C SER A 89 13.199 18.738 25.935 1.00 20.17 C ATOM 647 O SER A 89 13.111 18.121 24.861 1.00 19.71 O ATOM 648 CB SER A 89 14.356 17.392 27.685 1.00 20.80 C ATOM 649 OG SER A 89 14.952 16.699 26.594 1.00 22.15 O ATOM 650 HG SER A 89 14.345 15.978 26.291 1.00 0.00 H ATOM 651 H SER A 89 12.137 16.052 27.579 1.00 0.00 H ATOM 652 N ALA A 90 13.518 20.022 26.000 1.00 20.20 N ATOM 653 CA ALA A 90 13.812 20.819 24.801 1.00 20.56 C ATOM 654 C ALA A 90 14.917 20.194 23.961 1.00 19.80 C ATOM 655 O ALA A 90 14.851 20.213 22.725 1.00 18.85 O ATOM 656 CB ALA A 90 14.195 22.245 25.180 1.00 21.08 C ATOM 657 H ALA A 90 13.562 20.482 26.932 1.00 0.00 H ATOM 658 N ALA A 91 15.922 19.645 24.648 1.00 19.25 N ATOM 659 CA ALA A 91 17.021 18.910 24.019 1.00 19.05 C ATOM 660 C ALA A 91 16.499 17.739 23.211 1.00 18.71 C ATOM 661 O ALA A 91 16.902 17.551 22.059 1.00 19.80 O ATOM 662 CB ALA A 91 17.988 18.408 25.081 1.00 19.27 C ATOM 663 H ALA A 91 15.924 19.745 25.683 1.00 0.00 H ATOM 664 N GLU A 92 15.588 16.961 23.780 1.00 18.80 N ATOM 665 CA GLU A 92 14.996 15.836 23.027 1.00 18.83 C ATOM 666 C GLU A 92 14.168 16.309 21.806 1.00 19.30 C ATOM 667 O GLU A 92 14.169 15.659 20.750 1.00 19.32 O ATOM 668 CB GLU A 92 14.166 14.937 23.925 1.00 19.13 C ATOM 669 CG GLU A 92 13.578 13.742 23.182 1.00 19.17 C ATOM 670 CD GLU A 92 12.898 12.736 24.063 1.00 19.69 C ATOM 671 OE1 GLU A 92 13.390 12.450 25.166 1.00 20.45 O ATOM 672 OE2 GLU A 92 11.856 12.189 23.658 1.00 19.91 O ATOM 673 H GLU A 92 15.289 17.143 24.759 1.00 0.00 H ATOM 674 N VAL A 93 13.465 17.426 21.950 1.00 19.73 N ATOM 675 CA VAL A 93 12.717 17.996 20.816 1.00 20.79 C ATOM 676 C VAL A 93 13.683 18.325 19.681 1.00 20.41 C ATOM 677 O VAL A 93 13.467 17.934 18.530 1.00 20.54 O ATOM 678 CB VAL A 93 11.883 19.234 21.221 1.00 21.57 C ATOM 679 CG1 VAL A 93 11.233 19.867 20.000 1.00 22.62 C ATOM 680 CG2 VAL A 93 10.806 18.864 22.226 1.00 22.19 C ATOM 681 H VAL A 93 13.442 17.904 22.873 1.00 0.00 H ATOM 682 N ILE A 94 14.771 19.005 20.006 1.00 20.29 N ATOM 683 CA ILE A 94 15.787 19.315 19.010 1.00 21.47 C ATOM 684 C ILE A 94 16.348 18.048 18.326 1.00 20.75 C ATOM 685 O ILE A 94 16.593 18.042 17.112 1.00 20.24 O ATOM 686 CB ILE A 94 16.906 20.142 19.649 1.00 23.01 C ATOM 687 CG1 ILE A 94 16.379 21.560 19.965 1.00 25.10 C ATOM 688 CG2 ILE A 94 18.128 20.234 18.754 1.00 24.53 C ATOM 689 CD1 ILE A 94 17.102 22.226 21.106 1.00 25.91 C ATOM 690 H ILE A 94 14.902 19.323 20.988 1.00 0.00 H ATOM 691 N MET A 95 16.543 16.988 19.100 1.00 20.40 N ATOM 692 CA MET A 95 17.078 15.733 18.559 1.00 20.87 C ATOM 693 C MET A 95 16.113 14.891 17.750 1.00 20.50 C ATOM 694 O MET A 95 16.559 14.032 16.980 1.00 19.85 O ATOM 695 CB MET A 95 17.640 14.858 19.690 1.00 21.88 C ATOM 696 CG MET A 95 18.938 15.387 20.244 1.00 23.50 C ATOM 697 SD MET A 95 20.244 15.174 19.021 1.00 25.88 S ATOM 698 CE MET A 95 21.483 16.201 19.771 1.00 26.06 C ATOM 699 H MET A 95 16.312 17.048 20.112 1.00 0.00 H ATOM 700 N THR A 96 14.814 15.104 17.904 1.00 20.96 N ATOM 701 CA THR A 96 13.822 14.160 17.372 1.00 21.97 C ATOM 702 C THR A 96 12.746 14.771 16.466 1.00 23.79 C ATOM 703 O THR A 96 11.920 14.031 15.940 1.00 23.86 O ATOM 704 CB THR A 96 13.124 13.381 18.502 1.00 22.02 C ATOM 705 OG1 THR A 96 12.362 14.285 19.321 1.00 21.83 O ATOM 706 CG2 THR A 96 14.129 12.612 19.351 1.00 21.54 C ATOM 707 HG1 THR A 96 12.968 14.961 19.716 1.00 0.00 H ATOM 708 H THR A 96 14.492 15.954 18.410 1.00 0.00 H ATOM 709 N VAL A 97 12.773 16.086 16.271 1.00 25.86 N ATOM 710 CA VAL A 97 11.784 16.778 15.430 1.00 28.95 C ATOM 711 C VAL A 97 12.534 17.449 14.287 1.00 31.27 C ATOM 712 O VAL A 97 13.563 18.105 14.506 1.00 32.68 O ATOM 713 CB VAL A 97 10.990 17.835 16.222 1.00 29.58 C ATOM 714 CG1 VAL A 97 9.989 18.565 15.325 1.00 30.92 C ATOM 715 CG2 VAL A 97 10.252 17.190 17.390 1.00 29.41 C ATOM 716 H VAL A 97 13.520 16.646 16.730 1.00 0.00 H ATOM 717 N LEU A 98 12.031 17.277 13.065 1.00 34.37 N ATOM 718 CA LEU A 98 12.545 18.036 11.918 1.00 36.61 C ATOM 719 C LEU A 98 12.165 19.506 12.025 1.00 38.03 C ATOM 720 O LEU A 98 10.996 19.808 12.270 1.00 38.21 O ATOM 721 CB LEU A 98 11.987 17.471 10.614 1.00 39.10 C ATOM 722 CG LEU A 98 12.798 16.329 10.025 1.00 40.31 C ATOM 723 CD1 LEU A 98 11.986 15.632 8.946 1.00 41.53 C ATOM 724 CD2 LEU A 98 14.120 16.854 9.461 1.00 40.27 C ATOM 725 H LEU A 98 11.261 16.593 12.921 1.00 0.00 H TER 726 LEU A 98 ATOM 727 N GLY A 117 21.103 24.594 6.758 1.00 45.74 N ATOM 728 CA GLY A 117 21.180 23.660 7.885 1.00 45.21 C ATOM 729 C GLY A 117 20.019 22.675 7.938 1.00 44.24 C ATOM 730 O GLY A 117 18.862 23.085 8.072 1.00 46.31 O ATOM 731 HN3 GLY A 117 20.226 25.149 6.828 1.00 0.00 H ATOM 732 HN2 GLY A 117 21.106 24.060 5.866 1.00 0.00 H ATOM 733 HN1 GLY A 117 21.922 25.234 6.783 1.00 0.00 H ATOM 734 N VAL A 118 20.325 21.378 7.841 1.00 41.86 N ATOM 735 CA VAL A 118 19.305 20.309 7.942 1.00 39.17 C ATOM 736 C VAL A 118 18.898 19.960 9.390 1.00 36.89 C ATOM 737 O VAL A 118 17.821 19.403 9.618 1.00 37.60 O ATOM 738 CB VAL A 118 19.707 19.031 7.152 1.00 39.75 C ATOM 739 CG1 VAL A 118 19.893 19.374 5.678 1.00 40.97 C ATOM 740 CG2 VAL A 118 20.951 18.351 7.719 1.00 39.15 C ATOM 741 H VAL A 118 21.318 21.109 7.689 1.00 0.00 H ATOM 742 N GLY A 119 19.748 20.298 10.359 1.00 32.22 N ATOM 743 CA GLY A 119 19.422 20.138 11.762 1.00 29.00 C ATOM 744 C GLY A 119 20.015 18.855 12.294 1.00 26.11 C ATOM 745 O GLY A 119 20.181 17.868 11.562 1.00 25.80 O ATOM 746 H GLY A 119 20.676 20.690 10.100 1.00 0.00 H ATOM 747 N VAL A 120 20.368 18.879 13.576 1.00 22.65 N ATOM 748 CA VAL A 120 21.015 17.747 14.212 1.00 21.39 C ATOM 749 C VAL A 120 20.081 16.538 14.308 1.00 19.26 C ATOM 750 O VAL A 120 20.532 15.415 14.490 1.00 18.74 O ATOM 751 CB VAL A 120 21.548 18.136 15.616 1.00 21.56 C ATOM 752 CG1 VAL A 120 20.412 18.316 16.610 1.00 22.18 C ATOM 753 CG2 VAL A 120 22.548 17.110 16.122 1.00 22.38 C ATOM 754 H VAL A 120 20.175 19.733 14.138 1.00 0.00 H ATOM 755 N SER A 121 18.778 16.760 14.223 1.00 18.66 N ATOM 756 CA SER A 121 17.843 15.620 14.231 1.00 18.39 C ATOM 757 C SER A 121 18.122 14.637 13.078 1.00 18.28 C ATOM 758 O SER A 121 17.939 13.422 13.226 1.00 17.96 O ATOM 759 CB SER A 121 16.399 16.112 14.206 1.00 19.29 C ATOM 760 OG SER A 121 16.135 16.872 13.049 1.00 20.65 O ATOM 761 HG SER A 121 15.193 17.176 13.063 1.00 0.00 H ATOM 762 H SER A 121 18.417 17.733 14.151 1.00 0.00 H ATOM 763 N VAL A 122 18.567 15.164 11.937 1.00 17.96 N ATOM 764 CA VAL A 122 18.992 14.326 10.815 1.00 18.16 C ATOM 765 C VAL A 122 20.188 13.460 11.177 1.00 17.70 C ATOM 766 O VAL A 122 20.194 12.261 10.895 1.00 17.92 O ATOM 767 CB VAL A 122 19.297 15.183 9.566 1.00 18.40 C ATOM 768 CG1 VAL A 122 19.975 14.352 8.482 1.00 18.64 C ATOM 769 CG2 VAL A 122 18.004 15.784 9.053 1.00 18.99 C ATOM 770 H VAL A 122 18.613 16.199 11.842 1.00 0.00 H ATOM 771 N VAL A 123 21.185 14.055 11.840 1.00 17.17 N ATOM 772 CA VAL A 123 22.360 13.306 12.299 1.00 16.97 C ATOM 773 C VAL A 123 21.940 12.173 13.244 1.00 16.73 C ATOM 774 O VAL A 123 22.375 11.025 13.106 1.00 16.90 O ATOM 775 CB VAL A 123 23.404 14.233 12.956 1.00 16.49 C ATOM 776 CG1 VAL A 123 24.605 13.466 13.500 1.00 17.03 C ATOM 777 CG2 VAL A 123 23.868 15.281 11.954 1.00 16.95 C ATOM 778 H VAL A 123 21.126 15.075 12.035 1.00 0.00 H ATOM 779 N ASN A 124 21.064 12.507 14.177 1.00 16.63 N ATOM 780 CA ASN A 124 20.550 11.554 15.135 1.00 16.44 C ATOM 781 C ASN A 124 19.825 10.406 14.433 1.00 16.30 C ATOM 782 O ASN A 124 20.117 9.232 14.714 1.00 16.17 O ATOM 783 CB ASN A 124 19.614 12.280 16.100 1.00 16.58 C ATOM 784 CG ASN A 124 19.237 11.447 17.299 1.00 16.95 C ATOM 785 OD1 ASN A 124 19.969 10.556 17.714 1.00 17.03 O ATOM 786 ND2 ASN A 124 18.076 11.727 17.851 1.00 17.69 N ATOM 787 HD22 ASN A 124 17.488 12.493 17.465 1.00 0.00 H ATOM 788 HD21 ASN A 124 17.747 11.183 18.674 1.00 0.00 H ATOM 789 H ASN A 124 20.733 13.492 14.223 1.00 0.00 H ATOM 790 N ALA A 125 18.929 10.730 13.497 1.00 16.50 N ATOM 791 CA ALA A 125 18.166 9.676 12.763 1.00 17.28 C ATOM 792 C ALA A 125 19.081 8.643 12.084 1.00 17.56 C ATOM 793 O ALA A 125 18.745 7.445 12.009 1.00 18.07 O ATOM 794 CB ALA A 125 17.252 10.300 11.720 1.00 17.68 C ATOM 795 H ALA A 125 18.760 11.732 13.276 1.00 0.00 H ATOM 796 N LEU A 126 20.215 9.128 11.581 1.00 17.11 N ATOM 797 CA LEU A 126 21.159 8.347 10.786 1.00 17.43 C ATOM 798 C LEU A 126 22.368 7.840 11.567 1.00 17.64 C ATOM 799 O LEU A 126 23.353 7.346 10.966 1.00 18.01 O ATOM 800 CB LEU A 126 21.594 9.163 9.560 1.00 17.64 C ATOM 801 CG LEU A 126 20.413 9.660 8.712 1.00 18.10 C ATOM 802 CD1 LEU A 126 20.921 10.426 7.512 1.00 18.45 C ATOM 803 CD2 LEU A 126 19.523 8.494 8.261 1.00 18.91 C ATOM 804 H LEU A 126 20.443 10.126 11.766 1.00 0.00 H ATOM 805 N SER A 127 22.300 7.924 12.894 1.00 17.19 N ATOM 806 CA SER A 127 23.338 7.393 13.750 1.00 17.51 C ATOM 807 C SER A 127 22.836 6.164 14.474 1.00 18.03 C ATOM 808 O SER A 127 21.806 6.210 15.156 1.00 17.55 O ATOM 809 CB SER A 127 23.735 8.427 14.802 1.00 17.25 C ATOM 810 OG SER A 127 24.413 9.504 14.200 1.00 17.08 O ATOM 811 HG SER A 127 23.821 9.933 13.532 1.00 0.00 H ATOM 812 H SER A 127 21.475 8.385 13.328 1.00 0.00 H ATOM 813 N GLN A 128 23.584 5.072 14.389 1.00 19.19 N ATOM 814 CA GLN A 128 23.231 3.884 15.165 1.00 20.11 C ATOM 815 C GLN A 128 23.295 4.115 16.693 1.00 19.38 C ATOM 816 O GLN A 128 22.561 3.484 17.459 1.00 19.38 O ATOM 817 CB GLN A 128 24.054 2.665 14.718 1.00 22.57 C ATOM 818 CG GLN A 128 25.550 2.770 14.884 1.00 24.21 C ATOM 819 CD GLN A 128 26.309 1.581 14.285 1.00 27.61 C ATOM 820 OE1 GLN A 128 27.191 1.022 14.942 1.00 30.90 O ATOM 821 NE2 GLN A 128 25.968 1.181 13.051 1.00 28.24 N ATOM 822 HE22 GLN A 128 25.218 1.680 12.531 1.00 0.00 H ATOM 823 HE21 GLN A 128 26.453 0.372 12.614 1.00 0.00 H ATOM 824 H GLN A 128 24.421 5.061 13.771 1.00 0.00 H ATOM 825 N LYS A 129 24.160 5.026 17.129 1.00 18.87 N ATOM 826 CA LYS A 129 24.168 5.531 18.506 1.00 18.93 C ATOM 827 C LYS A 129 24.532 7.022 18.514 1.00 17.72 C ATOM 828 O LYS A 129 25.339 7.488 17.693 1.00 17.59 O ATOM 829 CB LYS A 129 25.159 4.746 19.358 1.00 20.28 C ATOM 830 CG LYS A 129 25.155 5.115 20.839 1.00 21.56 C ATOM 831 CD LYS A 129 26.148 4.261 21.620 1.00 24.17 C ATOM 832 CE LYS A 129 26.110 4.637 23.088 1.00 25.40 C ATOM 833 NZ LYS A 129 27.080 3.844 23.887 1.00 27.06 N ATOM 834 HZ1 LYS A 129 26.852 2.833 23.803 1.00 0.00 H ATOM 835 HZ2 LYS A 129 28.042 4.015 23.531 1.00 0.00 H ATOM 836 HZ3 LYS A 129 27.022 4.132 24.885 1.00 0.00 H ATOM 837 H LYS A 129 24.865 5.398 16.461 1.00 0.00 H ATOM 838 N LEU A 130 23.937 7.767 19.440 1.00 16.87 N ATOM 839 CA LEU A 130 24.312 9.167 19.673 1.00 16.17 C ATOM 840 C LEU A 130 24.231 9.449 21.179 1.00 16.60 C ATOM 841 O LEU A 130 23.232 9.130 21.819 1.00 16.39 O ATOM 842 CB LEU A 130 23.397 10.120 18.907 1.00 15.78 C ATOM 843 CG LEU A 130 23.713 11.625 19.036 1.00 15.50 C ATOM 844 CD1 LEU A 130 23.346 12.340 17.750 1.00 15.68 C ATOM 845 CD2 LEU A 130 23.007 12.294 20.205 1.00 15.94 C ATOM 846 H LEU A 130 23.182 7.345 20.018 1.00 0.00 H ATOM 847 N GLU A 131 25.290 10.019 21.722 1.00 17.62 N ATOM 848 CA GLU A 131 25.389 10.373 23.131 1.00 19.44 C ATOM 849 C GLU A 131 25.393 11.898 23.247 1.00 18.44 C ATOM 850 O GLU A 131 26.171 12.580 22.559 1.00 17.81 O ATOM 851 CB GLU A 131 26.678 9.778 23.722 1.00 22.86 C ATOM 852 CG GLU A 131 26.992 10.190 25.162 1.00 27.53 C ATOM 853 CD GLU A 131 28.425 9.850 25.591 1.00 31.84 C ATOM 854 OE1 GLU A 131 29.346 9.737 24.729 1.00 35.60 O ATOM 855 OE2 GLU A 131 28.638 9.694 26.809 1.00 35.64 O ATOM 856 H GLU A 131 26.102 10.228 21.107 1.00 0.00 H ATOM 857 N LEU A 132 24.500 12.409 24.091 1.00 17.23 N ATOM 858 CA LEU A 132 24.348 13.834 24.363 1.00 17.16 C ATOM 859 C LEU A 132 24.717 14.080 25.832 1.00 17.44 C ATOM 860 O LEU A 132 24.163 13.424 26.707 1.00 17.48 O ATOM 861 CB LEU A 132 22.895 14.251 24.135 1.00 17.52 C ATOM 862 CG LEU A 132 22.474 15.687 24.480 1.00 18.23 C ATOM 863 CD1 LEU A 132 23.232 16.710 23.653 1.00 18.34 C ATOM 864 CD2 LEU A 132 20.978 15.865 24.283 1.00 19.00 C ATOM 865 H LEU A 132 23.869 11.749 24.589 1.00 0.00 H ATOM 866 N VAL A 133 25.614 15.039 26.073 1.00 17.21 N ATOM 867 CA VAL A 133 25.988 15.473 27.428 1.00 17.89 C ATOM 868 C VAL A 133 25.912 16.993 27.496 1.00 18.62 C ATOM 869 O VAL A 133 26.588 17.690 26.721 1.00 18.46 O ATOM 870 CB VAL A 133 27.410 15.034 27.813 1.00 18.59 C ATOM 871 CG1 VAL A 133 27.708 15.422 29.256 1.00 19.44 C ATOM 872 CG2 VAL A 133 27.570 13.537 27.627 1.00 18.99 C ATOM 873 H VAL A 133 26.071 15.503 25.262 1.00 0.00 H ATOM 874 N ILE A 134 25.069 17.495 28.396 1.00 18.84 N ATOM 875 CA ILE A 134 24.878 18.936 28.571 1.00 19.86 C ATOM 876 C ILE A 134 25.268 19.312 29.980 1.00 21.37 C ATOM 877 O ILE A 134 24.794 18.687 30.929 1.00 22.24 O ATOM 878 CB ILE A 134 23.418 19.353 28.333 1.00 19.54 C ATOM 879 CG1 ILE A 134 22.974 18.971 26.919 1.00 18.99 C ATOM 880 CG2 ILE A 134 23.255 20.860 28.599 1.00 20.26 C ATOM 881 CD1 ILE A 134 21.462 18.894 26.770 1.00 18.98 C ATOM 882 H ILE A 134 24.527 16.841 28.996 1.00 0.00 H ATOM 883 N GLN A 135 26.137 20.314 30.104 1.00 22.01 N ATOM 884 CA GLN A 135 26.536 20.870 31.383 1.00 24.50 C ATOM 885 C GLN A 135 25.931 22.268 31.465 1.00 26.07 C ATOM 886 O GLN A 135 26.247 23.139 30.658 1.00 25.78 O ATOM 887 CB GLN A 135 28.063 20.895 31.496 1.00 25.44 C ATOM 888 CG GLN A 135 28.690 19.506 31.515 1.00 26.25 C ATOM 889 CD GLN A 135 30.201 19.545 31.523 1.00 27.99 C ATOM 890 OE1 GLN A 135 30.827 19.398 32.561 1.00 31.94 O ATOM 891 NE2 GLN A 135 30.795 19.784 30.371 1.00 28.66 N ATOM 892 HE22 GLN A 135 30.227 19.903 29.508 1.00 0.00 H ATOM 893 HE21 GLN A 135 31.832 19.853 30.325 1.00 0.00 H ATOM 894 H GLN A 135 26.551 20.718 29.240 1.00 0.00 H ATOM 895 N ARG A 136 25.029 22.462 32.416 1.00 28.08 N ATOM 896 CA ARG A 136 24.226 23.685 32.486 1.00 30.74 C ATOM 897 C ARG A 136 23.625 23.823 33.877 1.00 31.70 C ATOM 898 O ARG A 136 23.172 22.838 34.448 1.00 30.08 O ATOM 899 CB ARG A 136 23.101 23.592 31.454 1.00 32.54 C ATOM 900 CG ARG A 136 22.273 24.840 31.262 1.00 35.10 C ATOM 901 CD ARG A 136 21.200 24.572 30.234 1.00 36.75 C ATOM 902 NE ARG A 136 20.159 25.600 30.231 1.00 39.05 N ATOM 903 CZ ARG A 136 20.155 26.716 29.499 1.00 40.83 C ATOM 904 NH1 ARG A 136 21.160 27.026 28.669 1.00 41.19 N ATOM 905 NH2 ARG A 136 19.121 27.551 29.605 1.00 42.40 N ATOM 906 HE ARG A 136 19.344 25.447 30.859 1.00 0.00 H ATOM 907 HH12 ARG A 136 21.124 27.904 28.114 1.00 0.00 H ATOM 908 HH11 ARG A 136 21.977 26.388 28.580 1.00 0.00 H ATOM 909 HH22 ARG A 136 19.099 28.426 29.043 1.00 0.00 H ATOM 910 HH21 ARG A 136 18.336 27.328 30.250 1.00 0.00 H ATOM 911 H ARG A 136 24.887 21.724 33.134 1.00 0.00 H ATOM 912 N GLU A 137 23.611 25.047 34.398 1.00 32.94 N ATOM 913 CA GLU A 137 22.993 25.355 35.690 1.00 34.91 C ATOM 914 C GLU A 137 23.464 24.439 36.830 1.00 33.14 C ATOM 915 O GLU A 137 22.681 24.011 37.675 1.00 33.39 O ATOM 916 CB GLU A 137 21.469 25.347 35.543 1.00 37.82 C ATOM 917 CG GLU A 137 20.961 26.498 34.684 1.00 41.16 C ATOM 918 CD GLU A 137 19.466 26.436 34.450 1.00 44.07 C ATOM 919 OE1 GLU A 137 18.720 26.062 35.388 1.00 48.39 O ATOM 920 OE2 GLU A 137 19.039 26.766 33.325 1.00 46.94 O ATOM 921 H GLU A 137 24.059 25.819 33.864 1.00 0.00 H ATOM 922 N GLY A 138 24.761 24.151 36.832 1.00 31.17 N ATOM 923 CA GLY A 138 25.392 23.353 37.875 1.00 30.37 C ATOM 924 C GLY A 138 25.287 21.839 37.765 1.00 28.63 C ATOM 925 O GLY A 138 25.777 21.136 38.650 1.00 26.87 O ATOM 926 H GLY A 138 25.352 24.511 36.055 1.00 0.00 H ATOM 927 N LYS A 139 24.665 21.337 36.692 1.00 27.13 N ATOM 928 CA LYS A 139 24.314 19.914 36.560 1.00 26.47 C ATOM 929 C LYS A 139 24.802 19.323 35.237 1.00 24.75 C ATOM 930 O LYS A 139 24.832 20.007 34.218 1.00 24.48 O ATOM 931 CB LYS A 139 22.803 19.731 36.664 1.00 27.29 C ATOM 932 CG LYS A 139 22.191 20.081 38.021 1.00 28.94 C ATOM 933 CD LYS A 139 20.682 20.207 37.902 1.00 30.01 C ATOM 934 H LYS A 139 24.418 21.983 35.915 1.00 0.00 H ATOM 935 N ILE A 140 25.213 18.063 35.273 1.00 23.33 N ATOM 936 CA ILE A 140 25.511 17.287 34.077 1.00 22.46 C ATOM 937 C ILE A 140 24.230 16.546 33.710 1.00 21.56 C ATOM 938 O ILE A 140 23.573 15.975 34.585 1.00 21.24 O ATOM 939 CB ILE A 140 26.624 16.240 34.341 1.00 22.72 C ATOM 940 CG1 ILE A 140 27.876 16.910 34.890 1.00 23.86 C ATOM 941 CG2 ILE A 140 26.955 15.459 33.059 1.00 21.85 C ATOM 942 CD1 ILE A 140 28.858 15.965 35.541 1.00 24.80 C ATOM 943 H ILE A 140 25.328 17.607 36.200 1.00 0.00 H ATOM 944 N HIS A 141 23.870 16.571 32.432 1.00 20.68 N ATOM 945 CA HIS A 141 22.678 15.899 31.932 1.00 20.97 C ATOM 946 C HIS A 141 23.127 14.976 30.818 1.00 19.88 C ATOM 947 O HIS A 141 23.957 15.365 29.997 1.00 18.81 O ATOM 948 CB HIS A 141 21.654 16.880 31.346 1.00 22.04 C ATOM 949 CG HIS A 141 21.370 18.075 32.205 1.00 24.15 C ATOM 950 ND1 HIS A 141 20.175 18.253 32.865 1.00 26.49 N ATOM 951 CD2 HIS A 141 22.111 19.176 32.473 1.00 24.43 C ATOM 952 CE1 HIS A 141 20.200 19.400 33.521 1.00 26.09 C ATOM 953 NE2 HIS A 141 21.362 19.979 33.294 1.00 26.39 N ATOM 954 H HIS A 141 24.465 17.093 31.758 1.00 0.00 H ATOM 955 N ARG A 142 22.583 13.769 30.774 1.00 19.80 N ATOM 956 CA ARG A 142 22.978 12.798 29.753 1.00 19.47 C ATOM 957 C ARG A 142 21.780 12.153 29.103 1.00 18.44 C ATOM 958 O ARG A 142 20.745 11.925 29.761 1.00 18.21 O ATOM 959 CB ARG A 142 23.863 11.705 30.346 1.00 20.88 C ATOM 960 CG ARG A 142 25.244 12.172 30.757 1.00 22.64 C ATOM 961 CD ARG A 142 26.152 10.971 31.082 1.00 24.20 C ATOM 962 NE ARG A 142 27.460 11.459 31.512 1.00 26.36 N ATOM 963 CZ ARG A 142 28.574 11.533 30.785 1.00 26.96 C ATOM 964 NH1 ARG A 142 28.640 11.097 29.523 1.00 27.82 N ATOM 965 NH2 ARG A 142 29.664 12.038 31.351 1.00 28.51 N ATOM 966 HE ARG A 142 27.529 11.786 32.497 1.00 0.00 H ATOM 967 HH12 ARG A 142 29.531 11.174 28.992 1.00 0.00 H ATOM 968 HH11 ARG A 142 27.800 10.680 29.072 1.00 0.00 H ATOM 969 HH22 ARG A 142 30.548 12.108 30.807 1.00 0.00 H ATOM 970 HH21 ARG A 142 29.634 12.364 32.338 1.00 0.00 H ATOM 971 H ARG A 142 21.863 13.507 31.477 1.00 0.00 H ATOM 972 N GLN A 143 21.938 11.830 27.812 1.00 17.49 N ATOM 973 CA GLN A 143 20.934 11.060 27.089 1.00 17.32 C ATOM 974 C GLN A 143 21.572 10.261 25.961 1.00 17.32 C ATOM 975 O GLN A 143 22.526 10.709 25.333 1.00 16.85 O ATOM 976 CB GLN A 143 19.848 11.971 26.527 1.00 17.09 C ATOM 977 CG GLN A 143 18.584 11.228 26.159 1.00 17.13 C ATOM 978 CD GLN A 143 17.477 12.124 25.649 1.00 17.23 C ATOM 979 OE1 GLN A 143 17.707 13.260 25.201 1.00 17.41 O ATOM 980 NE2 GLN A 143 16.259 11.601 25.681 1.00 17.53 N ATOM 981 HE22 GLN A 143 16.113 10.646 26.065 1.00 0.00 H ATOM 982 HE21 GLN A 143 15.449 12.146 25.322 1.00 0.00 H ATOM 983 H GLN A 143 22.798 12.136 27.314 1.00 0.00 H ATOM 984 N ILE A 144 21.038 9.073 25.725 1.00 17.08 N ATOM 985 CA ILE A 144 21.520 8.214 24.669 1.00 17.57 C ATOM 986 C ILE A 144 20.388 7.947 23.701 1.00 17.14 C ATOM 987 O ILE A 144 19.267 7.661 24.111 1.00 16.99 O ATOM 988 CB ILE A 144 21.998 6.849 25.221 1.00 18.99 C ATOM 989 CG1 ILE A 144 23.116 7.043 26.245 1.00 20.45 C ATOM 990 CG2 ILE A 144 22.408 5.906 24.101 1.00 19.14 C ATOM 991 CD1 ILE A 144 24.357 7.656 25.715 1.00 21.09 C ATOM 992 H ILE A 144 20.248 8.749 26.318 1.00 0.00 H ATOM 993 N TYR A 145 20.723 7.990 22.418 1.00 16.84 N ATOM 994 CA TYR A 145 19.797 7.642 21.351 1.00 17.25 C ATOM 995 C TYR A 145 20.389 6.488 20.565 1.00 17.59 C ATOM 996 O TYR A 145 21.590 6.369 20.479 1.00 17.23 O ATOM 997 CB TYR A 145 19.586 8.812 20.396 1.00 16.84 C ATOM 998 CG TYR A 145 18.921 10.007 21.011 1.00 16.94 C ATOM 999 CD1 TYR A 145 19.636 10.909 21.804 1.00 17.07 C ATOM 1000 CD2 TYR A 145 17.555 10.236 20.824 1.00 17.32 C ATOM 1001 CE1 TYR A 145 19.006 12.011 22.378 1.00 17.30 C ATOM 1002 CE2 TYR A 145 16.931 11.333 21.394 1.00 17.43 C ATOM 1003 CZ TYR A 145 17.657 12.204 22.169 1.00 17.70 C ATOM 1004 OH TYR A 145 17.030 13.286 22.746 1.00 19.46 O ATOM 1005 HH TYR A 145 17.690 13.809 23.268 1.00 0.00 H ATOM 1006 H TYR A 145 21.688 8.285 22.164 1.00 0.00 H ATOM 1007 N GLU A 146 19.520 5.663 19.974 1.00 18.65 N ATOM 1008 CA GLU A 146 19.913 4.672 18.963 1.00 20.11 C ATOM 1009 C GLU A 146 18.996 4.778 17.769 1.00 19.26 C ATOM 1010 O GLU A 146 17.774 4.693 17.922 1.00 18.99 O ATOM 1011 CB GLU A 146 19.841 3.243 19.503 1.00 22.01 C ATOM 1012 CG GLU A 146 20.781 2.984 20.667 1.00 23.69 C ATOM 1013 CD GLU A 146 20.667 1.566 21.199 1.00 26.89 C ATOM 1014 OE1 GLU A 146 20.144 0.687 20.476 1.00 29.56 O ATOM 1015 OE2 GLU A 146 21.098 1.335 22.341 1.00 29.25 O ATOM 1016 H GLU A 146 18.517 5.725 20.243 1.00 0.00 H ATOM 1017 N HIS A 147 19.576 5.044 16.598 1.00 18.75 N ATOM 1018 CA HIS A 147 18.813 5.269 15.368 1.00 19.30 C ATOM 1019 C HIS A 147 17.739 6.339 15.550 1.00 19.10 C ATOM 1020 O HIS A 147 16.661 6.275 14.974 1.00 20.05 O ATOM 1021 CB HIS A 147 18.276 3.942 14.832 1.00 20.19 C ATOM 1022 CG HIS A 147 19.353 3.009 14.360 1.00 21.04 C ATOM 1023 ND1 HIS A 147 19.736 1.885 15.064 1.00 22.69 N ATOM 1024 CD2 HIS A 147 20.100 3.015 13.237 1.00 20.95 C ATOM 1025 CE1 HIS A 147 20.688 1.253 14.399 1.00 22.10 C ATOM 1026 NE2 HIS A 147 20.936 1.927 13.293 1.00 22.46 N ATOM 1027 H HIS A 147 20.614 5.094 16.556 1.00 0.00 H ATOM 1028 N GLY A 148 18.070 7.354 16.339 1.00 18.18 N ATOM 1029 CA GLY A 148 17.151 8.461 16.628 1.00 18.19 C ATOM 1030 C GLY A 148 16.127 8.268 17.722 1.00 18.14 C ATOM 1031 O GLY A 148 15.360 9.183 17.997 1.00 17.92 O ATOM 1032 H GLY A 148 19.017 7.365 16.769 1.00 0.00 H ATOM 1033 N VAL A 149 16.115 7.091 18.337 1.00 18.70 N ATOM 1034 CA VAL A 149 15.167 6.729 19.363 1.00 18.90 C ATOM 1035 C VAL A 149 15.806 6.957 20.740 1.00 18.30 C ATOM 1036 O VAL A 149 16.818 6.321 21.052 1.00 18.17 O ATOM 1037 CB VAL A 149 14.743 5.248 19.254 1.00 19.48 C ATOM 1038 CG1 VAL A 149 13.677 4.939 20.292 1.00 19.79 C ATOM 1039 CG2 VAL A 149 14.223 4.959 17.860 1.00 19.96 C ATOM 1040 H VAL A 149 16.831 6.389 18.063 1.00 0.00 H ATOM 1041 N PRO A 150 15.207 7.839 21.577 1.00 18.57 N ATOM 1042 CA PRO A 150 15.776 8.029 22.922 1.00 18.48 C ATOM 1043 C PRO A 150 15.661 6.750 23.764 1.00 18.97 C ATOM 1044 O PRO A 150 14.605 6.089 23.754 1.00 19.68 O ATOM 1045 CB PRO A 150 14.940 9.168 23.517 1.00 18.72 C ATOM 1046 CG PRO A 150 13.644 9.149 22.747 1.00 19.20 C ATOM 1047 CD PRO A 150 13.994 8.653 21.367 1.00 18.93 C ATOM 1048 N GLN A 151 16.728 6.396 24.466 1.00 19.00 N ATOM 1049 CA GLN A 151 16.717 5.192 25.303 1.00 19.75 C ATOM 1050 C GLN A 151 16.119 5.435 26.691 1.00 20.07 C ATOM 1051 O GLN A 151 15.630 4.493 27.349 1.00 19.96 O ATOM 1052 CB GLN A 151 18.113 4.577 25.351 1.00 20.75 C ATOM 1053 CG GLN A 151 18.628 4.224 23.958 1.00 21.72 C ATOM 1054 CD GLN A 151 17.712 3.259 23.214 1.00 22.55 C ATOM 1055 OE1 GLN A 151 17.080 3.604 22.206 1.00 23.57 O ATOM 1056 NE2 GLN A 151 17.618 2.061 23.723 1.00 23.15 N ATOM 1057 HE22 GLN A 151 18.166 1.812 24.571 1.00 0.00 H ATOM 1058 HE21 GLN A 151 16.995 1.356 23.281 1.00 0.00 H ATOM 1059 H GLN A 151 17.587 6.981 24.423 1.00 0.00 H ATOM 1060 N ALA A 152 16.143 6.698 27.123 1.00 18.63 N ATOM 1061 CA ALA A 152 15.531 7.157 28.358 1.00 19.23 C ATOM 1062 C ALA A 152 15.428 8.686 28.263 1.00 18.81 C ATOM 1063 O ALA A 152 16.082 9.290 27.403 1.00 18.39 O ATOM 1064 CB ALA A 152 16.361 6.758 29.587 1.00 19.52 C ATOM 1065 H ALA A 152 16.634 7.402 26.535 1.00 0.00 H ATOM 1066 N PRO A 153 14.626 9.310 29.135 1.00 19.22 N ATOM 1067 CA PRO A 153 14.549 10.766 29.124 1.00 19.20 C ATOM 1068 C PRO A 153 15.880 11.405 29.532 1.00 18.66 C ATOM 1069 O PRO A 153 16.663 10.794 30.268 1.00 19.04 O ATOM 1070 CB PRO A 153 13.458 11.067 30.158 1.00 19.96 C ATOM 1071 CG PRO A 153 12.682 9.799 30.303 1.00 20.31 C ATOM 1072 CD PRO A 153 13.709 8.721 30.135 1.00 19.89 C ATOM 1073 N LEU A 154 16.142 12.612 29.046 1.00 18.21 N ATOM 1074 CA LEU A 154 17.314 13.368 29.491 1.00 17.91 C ATOM 1075 C LEU A 154 17.331 13.369 31.027 1.00 18.52 C ATOM 1076 O LEU A 154 16.316 13.662 31.659 1.00 18.70 O ATOM 1077 CB LEU A 154 17.258 14.795 28.956 1.00 17.94 C ATOM 1078 CG LEU A 154 18.425 15.716 29.311 1.00 18.08 C ATOM 1079 CD1 LEU A 154 19.670 15.315 28.559 1.00 17.76 C ATOM 1080 CD2 LEU A 154 18.076 17.162 29.006 1.00 18.33 C ATOM 1081 H LEU A 154 15.504 13.028 28.337 1.00 0.00 H ATOM 1082 N ALA A 155 18.484 13.055 31.612 1.00 18.17 N ATOM 1083 CA ALA A 155 18.570 12.821 33.049 1.00 18.89 C ATOM 1084 C ALA A 155 19.774 13.520 33.648 1.00 19.18 C ATOM 1085 O ALA A 155 20.851 13.584 33.020 1.00 18.39 O ATOM 1086 CB ALA A 155 18.647 11.327 33.308 1.00 19.50 C ATOM 1087 H ALA A 155 19.343 12.975 31.032 1.00 0.00 H ATOM 1088 N VAL A 156 19.600 14.038 34.863 1.00 20.17 N ATOM 1089 CA VAL A 156 20.694 14.664 35.604 1.00 21.13 C ATOM 1090 C VAL A 156 21.537 13.544 36.218 1.00 21.62 C ATOM 1091 O VAL A 156 20.993 12.696 36.941 1.00 22.83 O ATOM 1092 CB VAL A 156 20.155 15.580 36.722 1.00 22.78 C ATOM 1093 CG1 VAL A 156 21.279 16.061 37.621 1.00 23.30 C ATOM 1094 CG2 VAL A 156 19.399 16.762 36.131 1.00 23.16 C ATOM 1095 H VAL A 156 18.656 13.996 35.298 1.00 0.00 H ATOM 1096 N THR A 157 22.843 13.534 35.949 1.00 21.16 N ATOM 1097 CA THR A 157 23.724 12.443 36.413 1.00 21.75 C ATOM 1098 C THR A 157 24.820 12.900 37.382 1.00 22.55 C ATOM 1099 O THR A 157 25.529 12.071 37.920 1.00 23.18 O ATOM 1100 CB THR A 157 24.407 11.749 35.223 1.00 21.70 C ATOM 1101 OG1 THR A 157 25.175 12.717 34.516 1.00 21.48 O ATOM 1102 CG2 THR A 157 23.392 11.180 34.293 1.00 21.08 C ATOM 1103 HG1 THR A 157 25.621 12.284 33.746 1.00 0.00 H ATOM 1104 H THR A 157 23.252 14.315 35.398 1.00 0.00 H ATOM 1105 N GLY A 158 24.947 14.198 37.616 1.00 22.99 N ATOM 1106 CA GLY A 158 25.987 14.716 38.497 1.00 23.98 C ATOM 1107 C GLY A 158 25.993 16.223 38.522 1.00 25.09 C ATOM 1108 O GLY A 158 25.129 16.874 37.908 1.00 23.80 O ATOM 1109 H GLY A 158 24.290 14.863 37.161 1.00 0.00 H ATOM 1110 N GLU A 159 26.966 16.762 39.246 1.00 26.60 N ATOM 1111 CA GLU A 159 27.168 18.199 39.387 1.00 29.20 C ATOM 1112 C GLU A 159 28.427 18.616 38.668 1.00 29.13 C ATOM 1113 O GLU A 159 29.339 17.810 38.460 1.00 28.80 O ATOM 1114 CB GLU A 159 27.270 18.584 40.867 1.00 31.82 C ATOM 1115 CG GLU A 159 25.949 18.463 41.599 1.00 33.74 C ATOM 1116 CD GLU A 159 26.017 18.957 43.037 1.00 37.20 C ATOM 1117 OE1 GLU A 159 27.042 18.738 43.727 1.00 39.23 O ATOM 1118 OE2 GLU A 159 25.027 19.560 43.483 1.00 39.87 O ATOM 1119 H GLU A 159 27.621 16.123 39.741 1.00 0.00 H ATOM 1120 N THR A 160 28.464 19.883 38.283 1.00 30.31 N ATOM 1121 CA THR A 160 29.617 20.448 37.587 1.00 31.25 C ATOM 1122 C THR A 160 29.619 21.953 37.722 1.00 33.26 C ATOM 1123 O THR A 160 28.564 22.581 37.856 1.00 33.27 O ATOM 1124 CB THR A 160 29.597 20.094 36.074 1.00 30.24 C ATOM 1125 OG1 THR A 160 30.728 20.685 35.419 1.00 30.59 O ATOM 1126 CG2 THR A 160 28.328 20.596 35.414 1.00 29.62 C ATOM 1127 HG1 THR A 160 30.708 20.455 34.456 1.00 0.00 H ATOM 1128 H THR A 160 27.647 20.494 38.483 1.00 0.00 H ATOM 1129 N GLU A 161 30.818 22.515 37.634 1.00 35.85 N ATOM 1130 CA GLU A 161 31.025 23.954 37.553 1.00 38.32 C ATOM 1131 C GLU A 161 31.048 24.441 36.103 1.00 37.31 C ATOM 1132 O GLU A 161 30.892 25.633 35.834 1.00 37.76 O ATOM 1133 CB GLU A 161 32.357 24.288 38.213 1.00 41.27 C ATOM 1134 CG GLU A 161 32.478 23.779 39.643 1.00 44.12 C ATOM 1135 CD GLU A 161 32.256 24.867 40.657 1.00 47.72 C ATOM 1136 OE1 GLU A 161 33.079 25.813 40.691 1.00 49.88 O ATOM 1137 OE2 GLU A 161 31.266 24.777 41.411 1.00 50.70 O ATOM 1138 H GLU A 161 31.653 21.895 37.622 1.00 0.00 H ATOM 1139 N LYS A 162 31.253 23.521 35.170 1.00 35.78 N ATOM 1140 CA LYS A 162 31.432 23.881 33.763 1.00 34.25 C ATOM 1141 C LYS A 162 30.109 23.997 33.018 1.00 31.72 C ATOM 1142 O LYS A 162 29.052 23.562 33.504 1.00 29.21 O ATOM 1143 CB LYS A 162 32.326 22.858 33.085 1.00 36.07 C ATOM 1144 CG LYS A 162 33.740 22.860 33.638 1.00 38.45 C ATOM 1145 CD LYS A 162 34.618 21.844 32.930 1.00 40.19 C ATOM 1146 CE LYS A 162 34.395 20.449 33.473 1.00 41.12 C ATOM 1147 NZ LYS A 162 35.050 19.433 32.612 1.00 42.60 N ATOM 1148 HZ1 LYS A 162 34.653 19.486 31.652 1.00 0.00 H ATOM 1149 HZ2 LYS A 162 36.073 19.618 32.576 1.00 0.00 H ATOM 1150 HZ3 LYS A 162 34.882 18.486 33.007 1.00 0.00 H ATOM 1151 H LYS A 162 31.287 22.519 35.445 1.00 0.00 H ATOM 1152 N THR A 163 30.184 24.595 31.829 1.00 29.52 N ATOM 1153 CA THR A 163 29.042 24.698 30.936 1.00 28.23 C ATOM 1154 C THR A 163 29.479 24.234 29.551 1.00 26.30 C ATOM 1155 O THR A 163 30.659 24.289 29.201 1.00 25.49 O ATOM 1156 CB THR A 163 28.437 26.121 30.867 1.00 29.52 C ATOM 1157 OG1 THR A 163 29.391 27.041 30.312 1.00 30.88 O ATOM 1158 CG2 THR A 163 28.004 26.597 32.265 1.00 30.99 C ATOM 1159 HG1 THR A 163 29.637 26.749 29.399 1.00 0.00 H ATOM 1160 H THR A 163 31.093 25.003 31.530 1.00 0.00 H ATOM 1161 N GLY A 164 28.522 23.734 28.792 1.00 24.88 N ATOM 1162 CA GLY A 164 28.790 23.286 27.439 1.00 23.36 C ATOM 1163 C GLY A 164 27.942 22.117 27.011 1.00 22.74 C ATOM 1164 O GLY A 164 27.194 21.539 27.793 1.00 21.97 O ATOM 1165 H GLY A 164 27.557 23.660 29.172 1.00 0.00 H ATOM 1166 N THR A 165 28.090 21.768 25.742 1.00 21.84 N ATOM 1167 CA THR A 165 27.379 20.643 25.166 1.00 21.11 C ATOM 1168 C THR A 165 28.395 19.763 24.447 1.00 20.60 C ATOM 1169 O THR A 165 29.397 20.259 23.902 1.00 20.16 O ATOM 1170 CB THR A 165 26.275 21.145 24.202 1.00 21.64 C ATOM 1171 OG1 THR A 165 25.421 22.068 24.887 1.00 22.56 O ATOM 1172 CG2 THR A 165 25.445 20.013 23.620 1.00 21.32 C ATOM 1173 HG1 THR A 165 25.956 22.838 25.204 1.00 0.00 H ATOM 1174 H THR A 165 28.736 22.318 25.140 1.00 0.00 H ATOM 1175 N MET A 166 28.117 18.456 24.445 1.00 19.30 N ATOM 1176 CA MET A 166 28.900 17.472 23.719 1.00 19.47 C ATOM 1177 C MET A 166 27.946 16.501 23.045 1.00 18.41 C ATOM 1178 O MET A 166 27.014 16.009 23.681 1.00 17.67 O ATOM 1179 CB MET A 166 29.865 16.754 24.657 1.00 21.05 C ATOM 1180 CG MET A 166 30.888 15.867 23.979 1.00 22.43 C ATOM 1181 SD MET A 166 30.279 14.294 23.334 1.00 24.95 S ATOM 1182 CE MET A 166 29.458 13.497 24.712 1.00 25.46 C ATOM 1183 H MET A 166 27.297 18.126 24.992 1.00 0.00 H ATOM 1184 N VAL A 167 28.156 16.261 21.749 1.00 17.52 N ATOM 1185 CA VAL A 167 27.445 15.210 21.030 1.00 16.89 C ATOM 1186 C VAL A 167 28.495 14.288 20.444 1.00 17.28 C ATOM 1187 O VAL A 167 29.456 14.749 19.813 1.00 16.81 O ATOM 1188 CB VAL A 167 26.533 15.768 19.912 1.00 16.99 C ATOM 1189 CG1 VAL A 167 26.042 14.666 18.980 1.00 17.41 C ATOM 1190 CG2 VAL A 167 25.354 16.500 20.524 1.00 17.10 C ATOM 1191 H VAL A 167 28.849 16.842 21.235 1.00 0.00 H ATOM 1192 N ARG A 168 28.336 12.995 20.685 1.00 17.45 N ATOM 1193 CA ARG A 168 29.161 11.972 20.064 1.00 18.12 C ATOM 1194 C ARG A 168 28.235 11.044 19.297 1.00 18.20 C ATOM 1195 O ARG A 168 27.200 10.616 19.832 1.00 17.87 O ATOM 1196 CB ARG A 168 29.975 11.197 21.103 1.00 18.68 C ATOM 1197 CG ARG A 168 30.899 10.152 20.497 1.00 19.87 C ATOM 1198 CD ARG A 168 31.827 9.603 21.558 1.00 21.25 C ATOM 1199 NE ARG A 168 32.592 8.451 21.094 1.00 23.23 N ATOM 1200 CZ ARG A 168 33.505 7.836 21.823 1.00 24.57 C ATOM 1201 NH1 ARG A 168 33.776 8.263 23.053 1.00 26.14 N ATOM 1202 NH2 ARG A 168 34.140 6.789 21.335 1.00 25.86 N ATOM 1203 HE ARG A 168 32.408 8.094 20.135 1.00 0.00 H ATOM 1204 HH12 ARG A 168 34.496 7.777 23.625 1.00 0.00 H ATOM 1205 HH11 ARG A 168 33.268 9.083 23.442 1.00 0.00 H ATOM 1206 HH22 ARG A 168 34.859 6.304 21.908 1.00 0.00 H ATOM 1207 HH21 ARG A 168 33.922 6.448 20.377 1.00 0.00 H ATOM 1208 H ARG A 168 27.590 12.700 21.346 1.00 0.00 H ATOM 1209 N PHE A 169 28.557 10.768 18.037 1.00 17.87 N ATOM 1210 CA PHE A 169 27.675 9.935 17.230 1.00 18.15 C ATOM 1211 C PHE A 169 28.435 8.861 16.473 1.00 18.83 C ATOM 1212 O PHE A 169 29.588 9.055 16.074 1.00 18.81 O ATOM 1213 CB PHE A 169 26.815 10.776 16.286 1.00 17.95 C ATOM 1214 CG PHE A 169 27.579 11.439 15.177 1.00 18.31 C ATOM 1215 CD1 PHE A 169 28.197 12.665 15.379 1.00 18.22 C ATOM 1216 CD2 PHE A 169 27.691 10.827 13.943 1.00 18.87 C ATOM 1217 CE1 PHE A 169 28.904 13.275 14.361 1.00 18.68 C ATOM 1218 CE2 PHE A 169 28.401 11.434 12.910 1.00 19.20 C ATOM 1219 CZ PHE A 169 28.994 12.669 13.121 1.00 18.62 C ATOM 1220 H PHE A 169 29.436 11.146 17.629 1.00 0.00 H ATOM 1221 N TRP A 170 27.766 7.726 16.311 1.00 19.02 N ATOM 1222 CA TRP A 170 28.296 6.590 15.597 1.00 20.28 C ATOM 1223 C TRP A 170 27.418 6.468 14.364 1.00 20.52 C ATOM 1224 O TRP A 170 26.262 6.100 14.486 1.00 20.37 O ATOM 1225 CB TRP A 170 28.160 5.344 16.456 1.00 20.89 C ATOM 1226 CG TRP A 170 29.114 5.252 17.612 1.00 21.56 C ATOM 1227 CD1 TRP A 170 30.222 4.446 17.671 1.00 22.57 C ATOM 1228 CD2 TRP A 170 29.040 5.918 18.893 1.00 21.35 C ATOM 1229 NE1 TRP A 170 30.842 4.590 18.888 1.00 22.58 N ATOM 1230 CE2 TRP A 170 30.155 5.490 19.647 1.00 21.91 C ATOM 1231 CE3 TRP A 170 28.157 6.848 19.469 1.00 21.29 C ATOM 1232 CZ2 TRP A 170 30.405 5.941 20.940 1.00 22.25 C ATOM 1233 CZ3 TRP A 170 28.405 7.299 20.767 1.00 21.45 C ATOM 1234 CH2 TRP A 170 29.522 6.836 21.488 1.00 21.86 C ATOM 1235 HE1 TRP A 170 31.704 4.089 19.185 1.00 0.00 H ATOM 1236 H TRP A 170 26.812 7.652 16.719 1.00 0.00 H ATOM 1237 N PRO A 171 27.944 6.822 13.174 1.00 21.40 N ATOM 1238 CA PRO A 171 27.119 6.775 11.954 1.00 21.38 C ATOM 1239 C PRO A 171 26.579 5.375 11.683 1.00 21.61 C ATOM 1240 O PRO A 171 27.304 4.411 11.865 1.00 20.96 O ATOM 1241 CB PRO A 171 28.089 7.157 10.840 1.00 22.26 C ATOM 1242 CG PRO A 171 29.223 7.816 11.498 1.00 22.67 C ATOM 1243 CD PRO A 171 29.263 7.425 12.944 1.00 22.02 C ATOM 1244 N SER A 172 25.322 5.274 11.261 1.00 21.69 N ATOM 1245 CA SER A 172 24.748 3.980 10.964 1.00 22.85 C ATOM 1246 C SER A 172 25.387 3.336 9.727 1.00 24.33 C ATOM 1247 O SER A 172 25.315 3.871 8.633 1.00 23.52 O ATOM 1248 CB SER A 172 23.253 4.075 10.747 1.00 22.55 C ATOM 1249 OG SER A 172 22.749 2.792 10.418 1.00 23.49 O ATOM 1250 HG SER A 172 21.771 2.850 10.275 1.00 0.00 H ATOM 1251 H SER A 172 24.747 6.133 11.144 1.00 0.00 H ATOM 1252 N LEU A 173 25.973 2.159 9.911 1.00 26.98 N ATOM 1253 CA LEU A 173 26.515 1.386 8.796 1.00 29.02 C ATOM 1254 C LEU A 173 25.432 0.687 7.966 1.00 29.76 C ATOM 1255 O LEU A 173 25.750 0.072 6.941 1.00 30.28 O ATOM 1256 CB LEU A 173 27.574 0.411 9.308 1.00 31.16 C ATOM 1257 CG LEU A 173 28.763 1.084 10.020 1.00 32.22 C ATOM 1258 CD1 LEU A 173 29.822 0.043 10.363 1.00 33.72 C ATOM 1259 CD2 LEU A 173 29.396 2.218 9.224 1.00 32.59 C ATOM 1260 H LEU A 173 26.048 1.777 10.875 1.00 0.00 H ATOM 1261 N GLU A 174 24.169 0.782 8.400 1.00 29.13 N ATOM 1262 CA GLU A 174 23.015 0.436 7.560 1.00 30.03 C ATOM 1263 C GLU A 174 22.738 1.478 6.487 1.00 29.57 C ATOM 1264 O GLU A 174 22.203 1.136 5.430 1.00 31.09 O ATOM 1265 CB GLU A 174 21.756 0.269 8.409 1.00 30.08 C ATOM 1266 CG GLU A 174 21.838 -0.895 9.367 1.00 31.06 C ATOM 1267 CD GLU A 174 20.709 -0.932 10.386 1.00 31.66 C ATOM 1268 OE1 GLU A 174 19.752 -0.113 10.319 1.00 30.99 O ATOM 1269 OE2 GLU A 174 20.791 -1.810 11.274 1.00 33.71 O ATOM 1270 H GLU A 174 23.998 1.114 9.371 1.00 0.00 H ATOM 1271 N THR A 175 23.077 2.735 6.772 1.00 28.21 N ATOM 1272 CA THR A 175 22.903 3.851 5.840 1.00 27.91 C ATOM 1273 C THR A 175 24.176 4.149 5.054 1.00 28.13 C ATOM 1274 O THR A 175 24.134 4.244 3.829 1.00 28.48 O ATOM 1275 CB THR A 175 22.475 5.128 6.590 1.00 27.23 C ATOM 1276 OG1 THR A 175 21.180 4.923 7.165 1.00 27.75 O ATOM 1277 CG2 THR A 175 22.422 6.350 5.676 1.00 27.40 C ATOM 1278 HG1 THR A 175 21.218 4.162 7.797 1.00 0.00 H ATOM 1279 H THR A 175 23.487 2.934 7.707 1.00 0.00 H ATOM 1280 N PHE A 176 25.291 4.321 5.757 1.00 26.88 N ATOM 1281 CA PHE A 176 26.549 4.726 5.113 1.00 27.56 C ATOM 1282 C PHE A 176 27.342 3.516 4.602 1.00 29.11 C ATOM 1283 O PHE A 176 27.718 2.634 5.374 1.00 29.02 O ATOM 1284 CB PHE A 176 27.346 5.647 6.050 1.00 26.50 C ATOM 1285 CG PHE A 176 26.581 6.896 6.420 1.00 25.60 C ATOM 1286 CD1 PHE A 176 26.485 7.964 5.522 1.00 25.43 C ATOM 1287 CD2 PHE A 176 25.904 6.987 7.630 1.00 24.53 C ATOM 1288 CE1 PHE A 176 25.745 9.100 5.839 1.00 25.03 C ATOM 1289 CE2 PHE A 176 25.163 8.118 7.953 1.00 24.19 C ATOM 1290 CZ PHE A 176 25.090 9.182 7.058 1.00 24.22 C ATOM 1291 H PHE A 176 25.273 4.166 6.785 1.00 0.00 H ATOM 1292 N THR A 177 27.572 3.484 3.287 1.00 30.35 N ATOM 1293 CA THR A 177 28.202 2.340 2.626 1.00 32.57 C ATOM 1294 C THR A 177 29.453 2.779 1.894 1.00 33.80 C ATOM 1295 O THR A 177 29.636 3.969 1.633 1.00 33.34 O ATOM 1296 CB THR A 177 27.234 1.692 1.629 1.00 33.70 C ATOM 1297 OG1 THR A 177 26.752 2.682 0.712 1.00 34.44 O ATOM 1298 CG2 THR A 177 26.056 1.087 2.359 1.00 33.50 C ATOM 1299 HG1 THR A 177 27.516 3.075 0.221 1.00 0.00 H ATOM 1300 H THR A 177 27.293 4.303 2.710 1.00 0.00 H ATOM 1301 N ASN A 178 30.312 1.803 1.586 1.00 35.50 N ATOM 1302 CA ASN A 178 31.544 2.019 0.833 1.00 36.91 C ATOM 1303 C ASN A 178 32.540 2.848 1.645 1.00 36.80 C ATOM 1304 O ASN A 178 33.454 2.291 2.244 1.00 37.65 O ATOM 1305 CB ASN A 178 31.222 2.625 -0.541 1.00 38.04 C ATOM 1306 CG ASN A 178 32.453 2.919 -1.360 1.00 39.39 C ATOM 1307 OD1 ASN A 178 33.440 2.188 -1.294 1.00 41.22 O ATOM 1308 ND2 ASN A 178 32.397 3.981 -2.156 1.00 39.51 N ATOM 1309 HD22 ASN A 178 31.540 4.570 -2.178 1.00 0.00 H ATOM 1310 HD21 ASN A 178 33.210 4.224 -2.757 1.00 0.00 H ATOM 1311 H ASN A 178 30.091 0.836 1.900 1.00 0.00 H ATOM 1312 N VAL A 179 32.342 4.164 1.691 1.00 36.46 N ATOM 1313 CA VAL A 179 33.131 5.034 2.553 1.00 35.79 C ATOM 1314 C VAL A 179 32.442 5.072 3.908 1.00 34.45 C ATOM 1315 O VAL A 179 31.372 5.658 4.049 1.00 33.44 O ATOM 1316 CB VAL A 179 33.265 6.453 1.974 1.00 35.82 C ATOM 1317 CG1 VAL A 179 34.023 7.359 2.944 1.00 34.96 C ATOM 1318 CG2 VAL A 179 33.976 6.400 0.624 1.00 37.03 C ATOM 1319 H VAL A 179 31.601 4.584 1.093 1.00 0.00 H ATOM 1320 N THR A 180 33.050 4.416 4.889 1.00 35.06 N ATOM 1321 CA THR A 180 32.493 4.311 6.238 1.00 34.45 C ATOM 1322 C THR A 180 33.400 4.891 7.300 1.00 34.24 C ATOM 1323 O THR A 180 32.988 4.964 8.452 1.00 34.13 O ATOM 1324 CB THR A 180 32.228 2.839 6.597 1.00 35.87 C ATOM 1325 OG1 THR A 180 33.446 2.103 6.476 1.00 36.47 O ATOM 1326 CG2 THR A 180 31.195 2.242 5.661 1.00 36.65 C ATOM 1327 HG1 THR A 180 33.281 1.154 6.706 1.00 0.00 H ATOM 1328 H THR A 180 33.962 3.957 4.690 1.00 0.00 H ATOM 1329 N GLU A 181 34.622 5.289 6.929 1.00 34.39 N ATOM 1330 CA GLU A 181 35.608 5.793 7.883 1.00 34.61 C ATOM 1331 C GLU A 181 35.848 7.261 7.592 1.00 32.52 C ATOM 1332 O GLU A 181 35.876 7.676 6.432 1.00 31.13 O ATOM 1333 CB GLU A 181 36.925 5.021 7.783 1.00 37.42 C ATOM 1334 CG GLU A 181 36.785 3.526 8.031 1.00 40.56 C ATOM 1335 CD GLU A 181 38.122 2.785 8.034 1.00 43.42 C ATOM 1336 OE1 GLU A 181 39.168 3.401 8.328 1.00 46.00 O ATOM 1337 OE2 GLU A 181 38.127 1.573 7.753 1.00 46.85 O ATOM 1338 H GLU A 181 34.880 5.238 5.923 1.00 0.00 H ATOM 1339 N PHE A 182 35.992 8.051 8.647 1.00 31.60 N ATOM 1340 CA PHE A 182 36.221 9.485 8.491 1.00 30.61 C ATOM 1341 C PHE A 182 37.633 9.773 7.979 1.00 32.34 C ATOM 1342 O PHE A 182 38.607 9.240 8.497 1.00 33.71 O ATOM 1343 CB PHE A 182 35.952 10.211 9.803 1.00 29.56 C ATOM 1344 CG PHE A 182 34.510 10.194 10.197 1.00 28.08 C ATOM 1345 CD1 PHE A 182 33.608 11.058 9.581 1.00 27.44 C ATOM 1346 CD2 PHE A 182 34.039 9.305 11.153 1.00 27.93 C ATOM 1347 CE1 PHE A 182 32.269 11.047 9.925 1.00 26.49 C ATOM 1348 CE2 PHE A 182 32.692 9.296 11.503 1.00 27.52 C ATOM 1349 CZ PHE A 182 31.809 10.175 10.886 1.00 26.66 C ATOM 1350 H PHE A 182 35.941 7.643 9.602 1.00 0.00 H ATOM 1351 N GLU A 183 37.706 10.507 6.873 1.00 32.15 N ATOM 1352 CA GLU A 183 38.943 11.106 6.363 1.00 33.24 C ATOM 1353 C GLU A 183 39.289 12.426 7.079 1.00 31.51 C ATOM 1354 O GLU A 183 38.548 13.416 6.986 1.00 30.17 O ATOM 1355 CB GLU A 183 38.833 11.320 4.849 1.00 35.40 C ATOM 1356 CG GLU A 183 40.189 11.437 4.164 1.00 39.05 C ATOM 1357 CD GLU A 183 40.127 11.620 2.654 1.00 41.50 C ATOM 1358 OE1 GLU A 183 39.098 11.286 2.022 1.00 43.71 O ATOM 1359 OE2 GLU A 183 41.141 12.093 2.089 1.00 44.38 O ATOM 1360 H GLU A 183 36.830 10.666 6.336 1.00 0.00 H ATOM 1361 N TYR A 184 40.418 12.422 7.786 1.00 31.18 N ATOM 1362 CA TYR A 184 40.924 13.594 8.516 1.00 30.05 C ATOM 1363 C TYR A 184 40.950 14.875 7.679 1.00 30.04 C ATOM 1364 O TYR A 184 40.520 15.921 8.149 1.00 28.50 O ATOM 1365 CB TYR A 184 42.344 13.333 9.040 1.00 30.98 C ATOM 1366 CG TYR A 184 42.885 14.433 9.923 1.00 30.07 C ATOM 1367 CD1 TYR A 184 43.504 15.566 9.389 1.00 30.60 C ATOM 1368 CD2 TYR A 184 42.745 14.356 11.295 1.00 29.80 C ATOM 1369 CE1 TYR A 184 43.988 16.577 10.218 1.00 30.28 C ATOM 1370 CE2 TYR A 184 43.218 15.350 12.127 1.00 29.56 C ATOM 1371 CZ TYR A 184 43.833 16.459 11.591 1.00 30.32 C ATOM 1372 OH TYR A 184 44.290 17.442 12.449 1.00 31.38 O ATOM 1373 HH TYR A 184 44.705 18.170 11.923 1.00 0.00 H ATOM 1374 H TYR A 184 40.972 11.542 7.824 1.00 0.00 H ATOM 1375 N GLU A 185 41.506 14.802 6.468 1.00 31.27 N ATOM 1376 CA GLU A 185 41.710 16.014 5.664 1.00 31.52 C ATOM 1377 C GLU A 185 40.409 16.652 5.160 1.00 29.55 C ATOM 1378 O GLU A 185 40.381 17.857 4.910 1.00 28.54 O ATOM 1379 CB GLU A 185 42.687 15.787 4.484 1.00 34.71 C ATOM 1380 CG GLU A 185 44.041 16.504 4.631 1.00 37.62 C ATOM 1381 CD GLU A 185 43.920 17.958 5.104 1.00 38.82 C ATOM 1382 OE1 GLU A 185 44.551 18.285 6.135 1.00 41.35 O ATOM 1383 OE2 GLU A 185 43.169 18.766 4.483 1.00 38.92 O ATOM 1384 H GLU A 185 41.798 13.878 6.090 1.00 0.00 H ATOM 1385 N ILE A 186 39.356 15.845 4.983 1.00 27.78 N ATOM 1386 CA ILE A 186 38.043 16.370 4.603 1.00 26.64 C ATOM 1387 C ILE A 186 37.509 17.208 5.753 1.00 25.16 C ATOM 1388 O ILE A 186 36.981 18.310 5.537 1.00 24.22 O ATOM 1389 CB ILE A 186 37.027 15.265 4.229 1.00 27.34 C ATOM 1390 CG1 ILE A 186 37.494 14.527 2.967 1.00 28.80 C ATOM 1391 CG2 ILE A 186 35.639 15.870 3.985 1.00 27.06 C ATOM 1392 CD1 ILE A 186 36.649 13.333 2.561 1.00 29.40 C ATOM 1393 H ILE A 186 39.473 14.821 5.119 1.00 0.00 H ATOM 1394 N LEU A 187 37.667 16.713 6.978 1.00 24.16 N ATOM 1395 CA LEU A 187 37.219 17.501 8.137 1.00 23.41 C ATOM 1396 C LEU A 187 38.094 18.729 8.329 1.00 23.40 C ATOM 1397 O LEU A 187 37.575 19.808 8.582 1.00 22.82 O ATOM 1398 CB LEU A 187 37.184 16.677 9.417 1.00 23.62 C ATOM 1399 CG LEU A 187 36.282 15.437 9.399 1.00 24.08 C ATOM 1400 CD1 LEU A 187 36.307 14.855 10.797 1.00 24.48 C ATOM 1401 CD2 LEU A 187 34.831 15.704 8.987 1.00 23.65 C ATOM 1402 H LEU A 187 38.103 15.779 7.115 1.00 0.00 H ATOM 1403 N ALA A 188 39.411 18.565 8.201 1.00 23.49 N ATOM 1404 CA ALA A 188 40.339 19.664 8.405 1.00 23.79 C ATOM 1405 C ALA A 188 40.106 20.820 7.429 1.00 24.31 C ATOM 1406 O ALA A 188 40.134 21.987 7.824 1.00 23.61 O ATOM 1407 CB ALA A 188 41.781 19.181 8.301 1.00 24.29 C ATOM 1408 H ALA A 188 39.783 17.627 7.949 1.00 0.00 H ATOM 1409 N LYS A 189 39.889 20.491 6.159 1.00 25.37 N ATOM 1410 CA LYS A 189 39.639 21.502 5.136 1.00 26.66 C ATOM 1411 C LYS A 189 38.474 22.414 5.515 1.00 25.32 C ATOM 1412 O LYS A 189 38.596 23.649 5.491 1.00 24.55 O ATOM 1413 CB LYS A 189 39.346 20.813 3.802 1.00 29.42 C ATOM 1414 CG LYS A 189 38.960 21.755 2.677 1.00 31.79 C ATOM 1415 CD LYS A 189 38.947 21.017 1.347 1.00 34.96 C ATOM 1416 CE LYS A 189 38.598 21.964 0.214 1.00 36.85 C ATOM 1417 NZ LYS A 189 38.113 21.187 -0.962 1.00 39.12 N ATOM 1418 HZ1 LYS A 189 38.859 20.534 -1.276 1.00 0.00 H ATOM 1419 HZ2 LYS A 189 37.267 20.645 -0.693 1.00 0.00 H ATOM 1420 HZ3 LYS A 189 37.876 21.842 -1.735 1.00 0.00 H ATOM 1421 H LYS A 189 39.898 19.487 5.887 1.00 0.00 H ATOM 1422 N ARG A 190 37.355 21.792 5.876 1.00 23.99 N ATOM 1423 CA ARG A 190 36.134 22.520 6.209 1.00 23.38 C ATOM 1424 C ARG A 190 36.258 23.326 7.504 1.00 21.43 C ATOM 1425 O ARG A 190 35.758 24.444 7.583 1.00 20.32 O ATOM 1426 CB ARG A 190 34.969 21.544 6.350 1.00 23.64 C ATOM 1427 CG ARG A 190 33.626 22.193 6.682 1.00 24.19 C ATOM 1428 CD ARG A 190 33.081 22.959 5.500 1.00 24.73 C ATOM 1429 NE ARG A 190 32.683 22.033 4.444 1.00 26.32 N ATOM 1430 CZ ARG A 190 31.447 21.583 4.217 1.00 27.04 C ATOM 1431 NH1 ARG A 190 30.405 21.982 4.942 1.00 27.12 N ATOM 1432 NH2 ARG A 190 31.246 20.752 3.197 1.00 27.44 N ATOM 1433 HE ARG A 190 33.433 21.692 3.809 1.00 0.00 H ATOM 1434 HH12 ARG A 190 29.456 21.610 4.737 1.00 0.00 H ATOM 1435 HH11 ARG A 190 30.540 22.666 5.714 1.00 0.00 H ATOM 1436 HH22 ARG A 190 30.291 20.389 3.002 1.00 0.00 H ATOM 1437 HH21 ARG A 190 32.044 20.465 2.595 1.00 0.00 H ATOM 1438 H ARG A 190 37.350 20.753 5.923 1.00 0.00 H ATOM 1439 N LEU A 191 36.902 22.758 8.516 1.00 20.82 N ATOM 1440 CA LEU A 191 37.072 23.462 9.788 1.00 20.69 C ATOM 1441 C LEU A 191 37.969 24.681 9.603 1.00 21.31 C ATOM 1442 O LEU A 191 37.709 25.737 10.192 1.00 20.04 O ATOM 1443 CB LEU A 191 37.601 22.535 10.881 1.00 20.92 C ATOM 1444 CG LEU A 191 36.676 21.383 11.305 1.00 20.57 C ATOM 1445 CD1 LEU A 191 37.336 20.418 12.288 1.00 20.63 C ATOM 1446 CD2 LEU A 191 35.363 21.900 11.880 1.00 20.33 C ATOM 1447 H LEU A 191 37.291 21.800 8.404 1.00 0.00 H ATOM 1448 N ARG A 192 38.989 24.552 8.749 1.00 21.94 N ATOM 1449 CA ARG A 192 39.804 25.721 8.368 1.00 23.34 C ATOM 1450 C ARG A 192 38.947 26.841 7.766 1.00 22.75 C ATOM 1451 O ARG A 192 39.043 27.983 8.212 1.00 22.56 O ATOM 1452 CB ARG A 192 40.924 25.338 7.395 1.00 25.30 C ATOM 1453 CG ARG A 192 41.781 26.519 6.976 1.00 27.03 C ATOM 1454 CD ARG A 192 43.031 26.089 6.223 1.00 29.38 C ATOM 1455 NE ARG A 192 43.695 27.244 5.601 1.00 31.14 N ATOM 1456 CZ ARG A 192 43.375 27.773 4.417 1.00 32.66 C ATOM 1457 NH1 ARG A 192 42.402 27.268 3.667 1.00 33.04 N ATOM 1458 NH2 ARG A 192 44.060 28.819 3.959 1.00 34.90 N ATOM 1459 HE ARG A 192 44.477 27.685 6.126 1.00 0.00 H ATOM 1460 HH12 ARG A 192 42.175 27.701 2.749 1.00 0.00 H ATOM 1461 HH11 ARG A 192 41.867 26.440 3.998 1.00 0.00 H ATOM 1462 HH22 ARG A 192 43.817 29.237 3.038 1.00 0.00 H ATOM 1463 HH21 ARG A 192 44.838 29.218 4.522 1.00 0.00 H ATOM 1464 H ARG A 192 39.210 23.618 8.349 1.00 0.00 H ATOM 1465 N GLU A 193 38.081 26.513 6.795 1.00 22.53 N ATOM 1466 CA GLU A 193 37.187 27.519 6.195 1.00 22.33 C ATOM 1467 C GLU A 193 36.340 28.180 7.289 1.00 21.36 C ATOM 1468 O GLU A 193 36.219 29.415 7.342 1.00 20.21 O ATOM 1469 CB GLU A 193 36.248 26.934 5.121 1.00 23.46 C ATOM 1470 CG GLU A 193 36.898 26.198 3.945 1.00 25.11 C ATOM 1471 CD GLU A 193 37.480 27.088 2.836 1.00 26.00 C ATOM 1472 OE1 GLU A 193 37.114 28.273 2.662 1.00 25.77 O ATOM 1473 OE2 GLU A 193 38.308 26.553 2.073 1.00 27.13 O ATOM 1474 H GLU A 193 38.040 25.530 6.459 1.00 0.00 H ATOM 1475 N LEU A 194 35.767 27.347 8.158 1.00 20.51 N ATOM 1476 CA LEU A 194 34.916 27.845 9.258 1.00 20.09 C ATOM 1477 C LEU A 194 35.635 28.767 10.238 1.00 20.09 C ATOM 1478 O LEU A 194 35.020 29.695 10.758 1.00 19.40 O ATOM 1479 CB LEU A 194 34.290 26.698 10.039 1.00 20.39 C ATOM 1480 CG LEU A 194 33.163 25.986 9.290 1.00 20.61 C ATOM 1481 CD1 LEU A 194 32.920 24.597 9.858 1.00 20.70 C ATOM 1482 CD2 LEU A 194 31.891 26.836 9.346 1.00 20.75 C ATOM 1483 H LEU A 194 35.923 26.323 8.059 1.00 0.00 H ATOM 1484 N SER A 195 36.913 28.497 10.499 1.00 20.70 N ATOM 1485 CA SER A 195 37.701 29.326 11.426 1.00 21.06 C ATOM 1486 C SER A 195 37.845 30.757 10.920 1.00 21.09 C ATOM 1487 O SER A 195 37.783 31.681 11.716 1.00 20.68 O ATOM 1488 CB SER A 195 39.089 28.733 11.717 1.00 22.07 C ATOM 1489 OG SER A 195 39.964 28.804 10.592 1.00 23.86 O ATOM 1490 HG SER A 195 39.570 28.300 9.837 1.00 0.00 H ATOM 1491 H SER A 195 37.365 27.682 10.037 1.00 0.00 H ATOM 1492 N PHE A 196 38.028 30.937 9.609 1.00 20.07 N ATOM 1493 CA PHE A 196 38.097 32.290 9.043 1.00 20.55 C ATOM 1494 C PHE A 196 36.769 33.032 9.115 1.00 20.75 C ATOM 1495 O PHE A 196 36.711 34.255 9.348 1.00 20.18 O ATOM 1496 CB PHE A 196 38.557 32.251 7.589 1.00 21.16 C ATOM 1497 CG PHE A 196 40.039 32.021 7.418 1.00 21.95 C ATOM 1498 CD1 PHE A 196 40.557 30.733 7.369 1.00 22.05 C ATOM 1499 CD2 PHE A 196 40.903 33.093 7.262 1.00 23.19 C ATOM 1500 CE1 PHE A 196 41.920 30.514 7.175 1.00 22.66 C ATOM 1501 CE2 PHE A 196 42.267 32.890 7.068 1.00 23.76 C ATOM 1502 CZ PHE A 196 42.777 31.598 7.034 1.00 23.47 C ATOM 1503 H PHE A 196 38.122 30.111 8.984 1.00 0.00 H ATOM 1504 N LEU A 197 35.696 32.302 8.848 1.00 21.40 N ATOM 1505 CA LEU A 197 34.376 32.902 8.857 1.00 22.76 C ATOM 1506 C LEU A 197 33.939 33.217 10.289 1.00 23.03 C ATOM 1507 O LEU A 197 33.302 34.239 10.536 1.00 24.88 O ATOM 1508 CB LEU A 197 33.385 31.966 8.173 1.00 23.41 C ATOM 1509 CG LEU A 197 31.966 32.482 7.987 1.00 24.71 C ATOM 1510 CD1 LEU A 197 31.939 33.743 7.153 1.00 25.53 C ATOM 1511 CD2 LEU A 197 31.112 31.395 7.344 1.00 24.86 C ATOM 1512 H LEU A 197 35.801 31.291 8.630 1.00 0.00 H ATOM 1513 N ASN A 198 34.277 32.339 11.225 1.00 23.15 N ATOM 1514 CA ASN A 198 33.906 32.496 12.632 1.00 24.20 C ATOM 1515 C ASN A 198 35.148 32.853 13.394 1.00 25.54 C ATOM 1516 O ASN A 198 35.665 32.086 14.193 1.00 25.25 O ATOM 1517 CB ASN A 198 33.314 31.212 13.144 1.00 23.55 C ATOM 1518 CG ASN A 198 32.063 30.836 12.392 1.00 23.27 C ATOM 1519 OD1 ASN A 198 32.084 30.008 11.471 1.00 23.72 O ATOM 1520 ND2 ASN A 198 30.977 31.476 12.741 1.00 23.47 N ATOM 1521 HD22 ASN A 198 31.006 32.163 13.521 1.00 0.00 H ATOM 1522 HD21 ASN A 198 30.084 31.298 12.238 1.00 0.00 H ATOM 1523 H ASN A 198 34.830 31.503 10.947 1.00 0.00 H ATOM 1524 N SER A 199 35.639 34.039 13.102 1.00 27.15 N ATOM 1525 CA SER A 199 36.878 34.498 13.677 1.00 28.97 C ATOM 1526 C SER A 199 36.618 34.750 15.145 1.00 30.29 C ATOM 1527 O SER A 199 35.515 35.105 15.549 1.00 32.91 O ATOM 1528 CB SER A 199 37.375 35.725 12.930 1.00 29.89 C ATOM 1529 OG SER A 199 36.386 36.696 12.759 1.00 30.53 O ATOM 1530 HG SER A 199 36.765 37.468 12.269 1.00 0.00 H ATOM 1531 H SER A 199 35.123 34.657 12.444 1.00 0.00 H ATOM 1532 N GLY A 200 37.614 34.503 15.966 1.00 31.65 N ATOM 1533 CA GLY A 200 37.378 34.513 17.412 1.00 30.61 C ATOM 1534 C GLY A 200 36.906 33.177 17.995 1.00 29.79 C ATOM 1535 O GLY A 200 36.849 33.054 19.210 1.00 30.60 O ATOM 1536 H GLY A 200 38.563 34.302 15.592 1.00 0.00 H ATOM 1537 N VAL A 201 36.557 32.180 17.167 1.00 27.43 N ATOM 1538 CA VAL A 201 36.257 30.856 17.691 1.00 25.75 C ATOM 1539 C VAL A 201 37.445 29.940 17.459 1.00 25.27 C ATOM 1540 O VAL A 201 37.921 29.788 16.337 1.00 25.31 O ATOM 1541 CB VAL A 201 34.991 30.261 17.079 1.00 25.65 C ATOM 1542 CG1 VAL A 201 34.738 28.873 17.641 1.00 25.14 C ATOM 1543 CG2 VAL A 201 33.801 31.161 17.406 1.00 26.16 C ATOM 1544 H VAL A 201 36.501 32.355 16.143 1.00 0.00 H ATOM 1545 N SER A 202 37.903 29.308 18.527 1.00 24.08 N ATOM 1546 CA SER A 202 38.967 28.319 18.425 1.00 23.80 C ATOM 1547 C SER A 202 38.386 26.958 18.045 1.00 22.95 C ATOM 1548 O SER A 202 37.444 26.481 18.692 1.00 22.06 O ATOM 1549 CB SER A 202 39.718 28.250 19.752 1.00 24.09 C ATOM 1550 OG SER A 202 40.662 27.196 19.745 1.00 24.56 O ATOM 1551 HG SER A 202 41.316 27.345 19.017 1.00 0.00 H ATOM 1552 H SER A 202 37.495 29.522 19.459 1.00 0.00 H ATOM 1553 N ILE A 203 38.963 26.324 17.022 1.00 22.82 N ATOM 1554 CA ILE A 203 38.552 24.984 16.590 1.00 22.68 C ATOM 1555 C ILE A 203 39.735 24.025 16.678 1.00 23.52 C ATOM 1556 O ILE A 203 40.721 24.168 15.943 1.00 24.77 O ATOM 1557 CB ILE A 203 38.017 24.992 15.141 1.00 22.59 C ATOM 1558 CG1 ILE A 203 36.887 26.025 15.021 1.00 22.78 C ATOM 1559 CG2 ILE A 203 37.600 23.589 14.708 1.00 22.81 C ATOM 1560 CD1 ILE A 203 36.255 26.163 13.640 1.00 23.00 C ATOM 1561 H ILE A 203 39.734 26.799 16.511 1.00 0.00 H ATOM 1562 N ARG A 204 39.600 23.024 17.536 1.00 23.67 N ATOM 1563 CA ARG A 204 40.585 21.956 17.648 1.00 24.77 C ATOM 1564 C ARG A 204 40.087 20.693 16.965 1.00 24.09 C ATOM 1565 O ARG A 204 38.919 20.350 17.096 1.00 24.24 O ATOM 1566 CB ARG A 204 40.877 21.692 19.105 1.00 26.39 C ATOM 1567 CG ARG A 204 41.548 22.875 19.768 1.00 28.42 C ATOM 1568 CD ARG A 204 42.293 22.436 21.004 1.00 30.66 C ATOM 1569 NE ARG A 204 42.922 23.571 21.656 1.00 31.98 N ATOM 1570 CZ ARG A 204 44.215 23.900 21.592 1.00 32.57 C ATOM 1571 NH1 ARG A 204 45.100 23.195 20.879 1.00 33.11 N ATOM 1572 NH2 ARG A 204 44.623 24.964 22.260 1.00 32.94 N ATOM 1573 HE ARG A 204 42.308 24.186 22.227 1.00 0.00 H ATOM 1574 HH12 ARG A 204 46.098 23.485 20.856 1.00 0.00 H ATOM 1575 HH11 ARG A 204 44.790 22.356 20.348 1.00 0.00 H ATOM 1576 HH22 ARG A 204 45.624 25.245 22.229 1.00 0.00 H ATOM 1577 HH21 ARG A 204 43.943 25.521 22.817 1.00 0.00 H ATOM 1578 H ARG A 204 38.762 23.000 18.151 1.00 0.00 H ATOM 1579 N LEU A 205 40.966 20.043 16.193 1.00 24.37 N ATOM 1580 CA LEU A 205 40.668 18.764 15.545 1.00 24.44 C ATOM 1581 C LEU A 205 41.659 17.733 16.052 1.00 25.40 C ATOM 1582 O LEU A 205 42.863 17.992 16.052 1.00 24.86 O ATOM 1583 CB LEU A 205 40.750 18.891 14.030 1.00 24.87 C ATOM 1584 CG LEU A 205 40.554 17.626 13.183 1.00 25.21 C ATOM 1585 CD1 LEU A 205 39.212 16.960 13.450 1.00 24.41 C ATOM 1586 CD2 LEU A 205 40.698 17.980 11.703 1.00 26.06 C ATOM 1587 H LEU A 205 41.905 20.466 16.046 1.00 0.00 H ATOM 1588 N ARG A 206 41.156 16.574 16.477 1.00 25.46 N ATOM 1589 CA ARG A 206 41.996 15.505 17.032 1.00 27.62 C ATOM 1590 C ARG A 206 41.619 14.172 16.408 1.00 27.70 C ATOM 1591 O ARG A 206 40.432 13.825 16.340 1.00 25.64 O ATOM 1592 CB ARG A 206 41.813 15.412 18.552 1.00 28.78 C ATOM 1593 CG ARG A 206 42.294 16.632 19.319 1.00 30.27 C ATOM 1594 CD ARG A 206 41.778 16.633 20.750 1.00 32.24 C ATOM 1595 NE ARG A 206 42.335 17.753 21.517 1.00 34.02 N ATOM 1596 CZ ARG A 206 41.986 18.085 22.765 1.00 35.40 C ATOM 1597 NH1 ARG A 206 41.063 17.393 23.428 1.00 34.93 N ATOM 1598 NH2 ARG A 206 42.578 19.119 23.362 1.00 36.78 N ATOM 1599 HE ARG A 206 43.060 18.336 21.053 1.00 0.00 H ATOM 1600 HH12 ARG A 206 40.805 17.666 24.398 1.00 0.00 H ATOM 1601 HH11 ARG A 206 40.600 16.579 22.977 1.00 0.00 H ATOM 1602 HH22 ARG A 206 42.311 19.382 24.332 1.00 0.00 H ATOM 1603 HH21 ARG A 206 43.307 19.663 22.858 1.00 0.00 H ATOM 1604 H ARG A 206 40.129 16.421 16.413 1.00 0.00 H ATOM 1605 N ASP A 207 42.625 13.428 15.956 1.00 28.09 N ATOM 1606 CA ASP A 207 42.422 12.078 15.433 1.00 28.73 C ATOM 1607 C ASP A 207 43.055 11.068 16.389 1.00 30.28 C ATOM 1608 O ASP A 207 44.276 10.957 16.471 1.00 30.44 O ATOM 1609 CB ASP A 207 43.029 11.970 14.036 1.00 29.58 C ATOM 1610 CG ASP A 207 42.530 10.763 13.257 1.00 30.24 C ATOM 1611 OD1 ASP A 207 42.112 9.744 13.862 1.00 30.82 O ATOM 1612 OD2 ASP A 207 42.556 10.822 12.010 1.00 30.76 O ATOM 1613 H ASP A 207 43.588 13.820 15.975 1.00 0.00 H ATOM 1614 N LYS A 208 42.216 10.331 17.117 1.00 30.63 N ATOM 1615 CA LYS A 208 42.704 9.320 18.065 1.00 31.95 C ATOM 1616 C LYS A 208 43.155 8.013 17.403 1.00 32.82 C ATOM 1617 O LYS A 208 43.646 7.134 18.087 1.00 32.99 O ATOM 1618 CB LYS A 208 41.640 9.024 19.114 1.00 32.34 C ATOM 1619 CG LYS A 208 41.307 10.226 19.982 1.00 32.57 C ATOM 1620 CD LYS A 208 40.285 9.881 21.049 1.00 33.21 C ATOM 1621 CE LYS A 208 40.900 9.081 22.185 1.00 34.97 C ATOM 1622 NZ LYS A 208 40.042 9.120 23.397 1.00 35.71 N ATOM 1623 HZ1 LYS A 208 39.929 10.106 23.709 1.00 0.00 H ATOM 1624 HZ2 LYS A 208 39.110 8.717 23.174 1.00 0.00 H ATOM 1625 HZ3 LYS A 208 40.489 8.565 24.155 1.00 0.00 H ATOM 1626 H LYS A 208 41.191 10.475 17.011 1.00 0.00 H ATOM 1627 N ARG A 209 42.944 7.870 16.095 1.00 33.49 N ATOM 1628 CA ARG A 209 43.417 6.702 15.356 1.00 35.43 C ATOM 1629 C ARG A 209 44.935 6.741 15.161 1.00 36.95 C ATOM 1630 O ARG A 209 45.591 5.698 15.221 1.00 38.08 O ATOM 1631 CB ARG A 209 42.697 6.580 14.003 1.00 35.86 C ATOM 1632 CG ARG A 209 41.183 6.401 14.137 1.00 35.67 C ATOM 1633 CD ARG A 209 40.418 6.591 12.836 1.00 35.94 C ATOM 1634 NE ARG A 209 40.670 7.884 12.206 1.00 35.67 N ATOM 1635 CZ ARG A 209 40.153 8.269 11.041 1.00 35.49 C ATOM 1636 NH1 ARG A 209 39.314 7.475 10.368 1.00 36.53 N ATOM 1637 NH2 ARG A 209 40.448 9.464 10.550 1.00 34.93 N ATOM 1638 HE ARG A 209 41.296 8.550 12.701 1.00 0.00 H ATOM 1639 HH12 ARG A 209 38.918 7.789 9.459 1.00 0.00 H ATOM 1640 HH11 ARG A 209 39.058 6.544 10.753 1.00 0.00 H ATOM 1641 HH22 ARG A 209 40.045 9.766 9.640 1.00 0.00 H ATOM 1642 HH21 ARG A 209 41.082 10.100 11.075 1.00 0.00 H ATOM 1643 H ARG A 209 42.426 8.613 15.584 1.00 0.00 H ATOM 1644 N ASP A 210 45.483 7.934 14.928 1.00 36.89 N ATOM 1645 CA ASP A 210 46.927 8.096 14.710 1.00 39.33 C ATOM 1646 C ASP A 210 47.582 9.273 15.445 1.00 39.67 C ATOM 1647 O ASP A 210 48.761 9.554 15.222 1.00 40.36 O ATOM 1648 CB ASP A 210 47.203 8.193 13.200 1.00 39.97 C ATOM 1649 CG ASP A 210 46.529 9.398 12.536 1.00 39.72 C ATOM 1650 OD1 ASP A 210 45.953 10.273 13.237 1.00 38.45 O ATOM 1651 OD2 ASP A 210 46.585 9.460 11.286 1.00 40.23 O ATOM 1652 H ASP A 210 44.871 8.774 14.900 1.00 0.00 H ATOM 1653 N GLY A 211 46.834 9.962 16.303 1.00 38.96 N ATOM 1654 CA GLY A 211 47.357 11.120 17.016 1.00 38.26 C ATOM 1655 C GLY A 211 47.497 12.415 16.232 1.00 37.23 C ATOM 1656 O GLY A 211 48.001 13.377 16.780 1.00 38.07 O ATOM 1657 H GLY A 211 45.851 9.666 16.469 1.00 0.00 H ATOM 1658 N LYS A 212 47.058 12.474 14.970 1.00 36.62 N ATOM 1659 CA LYS A 212 47.108 13.731 14.206 1.00 36.09 C ATOM 1660 C LYS A 212 46.236 14.782 14.893 1.00 35.06 C ATOM 1661 O LYS A 212 45.198 14.451 15.467 1.00 34.68 O ATOM 1662 CB LYS A 212 46.649 13.528 12.753 1.00 35.70 C ATOM 1663 H LYS A 212 46.675 11.618 14.521 1.00 0.00 H ATOM 1664 N GLU A 213 46.675 16.034 14.871 1.00 34.74 N ATOM 1665 CA GLU A 213 45.900 17.113 15.472 1.00 33.64 C ATOM 1666 C GLU A 213 46.155 18.463 14.814 1.00 32.50 C ATOM 1667 O GLU A 213 47.218 18.695 14.235 1.00 32.01 O ATOM 1668 CB GLU A 213 46.137 17.184 16.978 1.00 35.41 C ATOM 1669 CG GLU A 213 47.562 17.503 17.398 1.00 38.26 C ATOM 1670 CD GLU A 213 47.699 17.546 18.911 1.00 40.11 C ATOM 1671 OE1 GLU A 213 47.464 16.512 19.568 1.00 42.55 O ATOM 1672 OE2 GLU A 213 48.033 18.618 19.446 1.00 42.08 O ATOM 1673 H GLU A 213 47.586 16.249 14.418 1.00 0.00 H ATOM 1674 N ASP A 214 45.147 19.331 14.885 1.00 30.14 N ATOM 1675 CA ASP A 214 45.233 20.682 14.333 1.00 30.04 C ATOM 1676 C ASP A 214 44.481 21.661 15.210 1.00 28.35 C ATOM 1677 O ASP A 214 43.587 21.284 15.975 1.00 27.14 O ATOM 1678 CB ASP A 214 44.680 20.749 12.906 1.00 30.74 C ATOM 1679 CG ASP A 214 45.696 20.370 11.873 1.00 32.69 C ATOM 1680 OD1 ASP A 214 46.603 21.181 11.610 1.00 34.47 O ATOM 1681 OD2 ASP A 214 45.592 19.262 11.310 1.00 34.69 O ATOM 1682 H ASP A 214 44.265 19.036 15.351 1.00 0.00 H ATOM 1683 N HIS A 215 44.850 22.928 15.066 1.00 27.64 N ATOM 1684 CA HIS A 215 44.242 24.002 15.814 1.00 27.30 C ATOM 1685 C HIS A 215 44.012 25.182 14.889 1.00 27.12 C ATOM 1686 O HIS A 215 44.967 25.868 14.501 1.00 26.63 O ATOM 1687 CB HIS A 215 45.149 24.407 16.985 1.00 28.82 C ATOM 1688 CG HIS A 215 44.547 25.439 17.883 1.00 28.84 C ATOM 1689 ND1 HIS A 215 45.295 26.157 18.790 1.00 29.77 N ATOM 1690 CD2 HIS A 215 43.270 25.875 18.020 1.00 28.62 C ATOM 1691 CE1 HIS A 215 44.504 26.984 19.453 1.00 30.01 C ATOM 1692 NE2 HIS A 215 43.272 26.838 18.999 1.00 29.10 N ATOM 1693 H HIS A 215 45.606 23.155 14.389 1.00 0.00 H ATOM 1694 N PHE A 216 42.749 25.412 14.544 1.00 26.02 N ATOM 1695 CA PHE A 216 42.359 26.513 13.673 1.00 26.30 C ATOM 1696 C PHE A 216 41.820 27.662 14.524 1.00 26.21 C ATOM 1697 O PHE A 216 40.866 27.495 15.265 1.00 25.16 O ATOM 1698 CB PHE A 216 41.327 26.027 12.655 1.00 25.90 C ATOM 1699 CG PHE A 216 41.736 24.772 11.938 1.00 26.28 C ATOM 1700 CD1 PHE A 216 42.712 24.813 10.939 1.00 27.78 C ATOM 1701 CD2 PHE A 216 41.182 23.548 12.277 1.00 26.19 C ATOM 1702 CE1 PHE A 216 43.089 23.655 10.273 1.00 28.27 C ATOM 1703 CE2 PHE A 216 41.565 22.380 11.621 1.00 26.34 C ATOM 1704 CZ PHE A 216 42.518 22.436 10.620 1.00 27.34 C ATOM 1705 H PHE A 216 42.009 24.780 14.911 1.00 0.00 H ATOM 1706 N HIS A 217 42.453 28.827 14.410 1.00 26.82 N ATOM 1707 CA HIS A 217 42.066 29.995 15.190 1.00 27.97 C ATOM 1708 C HIS A 217 42.549 31.264 14.497 1.00 29.44 C ATOM 1709 O HIS A 217 43.753 31.540 14.489 1.00 29.85 O ATOM 1710 CB HIS A 217 42.604 29.898 16.631 1.00 28.20 C ATOM 1711 CG HIS A 217 44.097 29.762 16.739 1.00 28.84 C ATOM 1712 ND1 HIS A 217 44.780 28.641 16.319 1.00 29.10 N ATOM 1713 CD2 HIS A 217 45.031 30.587 17.273 1.00 30.08 C ATOM 1714 CE1 HIS A 217 46.069 28.793 16.557 1.00 29.60 C ATOM 1715 NE2 HIS A 217 46.248 29.961 17.144 1.00 30.28 N ATOM 1716 H HIS A 217 43.248 28.906 13.744 1.00 0.00 H ATOM 1717 N TYR A 218 41.614 32.031 13.928 1.00 29.99 N ATOM 1718 CA TYR A 218 41.956 33.215 13.129 1.00 32.30 C ATOM 1719 C TYR A 218 42.186 34.459 14.008 1.00 35.19 C ATOM 1720 O TYR A 218 42.061 34.391 15.230 1.00 36.07 O ATOM 1721 CB TYR A 218 40.879 33.466 12.064 1.00 33.71 C ATOM 1722 CG TYR A 218 41.117 34.731 11.248 1.00 36.03 C ATOM 1723 CD1 TYR A 218 42.354 35.001 10.665 1.00 37.68 C ATOM 1724 CD2 TYR A 218 40.110 35.670 11.085 1.00 37.84 C ATOM 1725 CE1 TYR A 218 42.564 36.179 9.954 1.00 39.25 C ATOM 1726 CE2 TYR A 218 40.307 36.847 10.374 1.00 38.76 C ATOM 1727 CZ TYR A 218 41.530 37.098 9.820 1.00 39.03 C ATOM 1728 OH TYR A 218 41.725 38.262 9.117 1.00 41.59 O ATOM 1729 HH TYR A 218 42.656 38.292 8.783 1.00 0.00 H ATOM 1730 H TYR A 218 40.612 31.782 14.055 1.00 0.00 H TER 1731 TYR A 218 HETATM 1732 O HOH 1 28.888 20.812 20.840 1.00 30.00 O HETATM 1733 O HOH 2 34.925 29.670 2.884 1.00 21.16 O HETATM 1734 O HOH 3 29.472 6.723 2.583 1.00 32.98 O HETATM 1735 O HOH 4 17.266 4.422 6.746 1.00 32.67 O HETATM 1736 O HOH 5 20.471 3.498 9.294 1.00 25.89 O HETATM 1737 O HOH 6 18.990 4.958 11.114 1.00 28.53 O HETATM 1738 O HOH 7 25.911 28.652 24.259 1.00 33.01 O HETATM 1739 O HOH 8 16.380 21.126 33.605 1.00 39.84 O HETATM 1740 O HOH 9 12.092 10.738 26.776 1.00 24.28 O HETATM 1741 O HOH 10 38.893 31.170 14.235 1.00 24.70 O HETATM 1742 O HOH 11 10.547 5.797 7.272 1.00 35.98 O HETATM 1743 O HOH 12 12.575 5.802 25.531 1.00 32.46 O HETATM 1744 O HOH 13 32.840 10.364 24.509 1.00 38.65 O HETATM 1745 O HOH 14 14.383 13.932 27.232 1.00 17.71 O HETATM 1746 O HOH 15 28.241 25.911 7.708 1.00 38.19 O HETATM 1747 O HOH 16 46.880 23.376 13.241 1.00 36.41 O HETATM 1748 O HOH 17 6.822 9.467 2.114 1.00 33.71 O HETATM 1749 O HOH 18 29.908 23.160 9.919 1.00 26.82 O HETATM 1750 O HOH 19 26.427 24.649 24.844 1.00 26.76 O HETATM 1751 O HOH 20 19.549 3.625 5.357 1.00 33.00 O HETATM 1752 O HOH 21 19.158 9.651 29.924 1.00 20.87 O HETATM 1753 O HOH 22 35.505 16.201 20.877 1.00 21.40 O HETATM 1754 O HOH 23 28.675 15.276 40.850 1.00 26.66 O HETATM 1755 O HOH 24 28.548 9.264 2.720 1.00 27.22 O HETATM 1756 O HOH 25 29.872 3.890 12.818 1.00 36.47 O HETATM 1757 O HOH 26 13.702 14.494 31.143 1.00 20.23 O HETATM 1758 O HOH 27 22.349 0.753 18.029 1.00 42.30 O HETATM 1759 O HOH 28 30.962 11.309 27.971 1.00 42.07 O HETATM 1760 O HOH 29 39.411 6.422 20.633 1.00 36.66 O HETATM 1761 O HOH 30 20.746 7.884 17.287 1.00 16.78 O HETATM 1762 O HOH 31 16.546 2.165 18.130 1.00 23.93 O HETATM 1763 O HOH 32 19.907 21.319 14.927 1.00 35.31 O HETATM 1764 O HOH 33 37.673 23.733 25.277 1.00 31.70 O HETATM 1765 O HOH 34 29.691 29.481 10.034 1.00 29.53 O HETATM 1766 O HOH 35 38.471 31.665 21.103 1.00 31.85 O HETATM 1767 O HOH 36 15.470 1.764 20.716 1.00 28.12 O HETATM 1768 O HOH 37 35.373 23.087 23.872 1.00 28.89 O HETATM 1769 O HOH 38 42.021 10.040 7.576 1.00 36.42 O HETATM 1770 O HOH 39 19.372 7.854 27.752 1.00 24.78 O HETATM 1771 O HOH 40 48.150 25.684 18.949 1.00 36.74 O HETATM 1772 O HOH 41 31.213 20.216 26.449 1.00 32.18 O HETATM 1773 O HOH 42 37.159 4.561 20.230 1.00 40.01 O HETATM 1774 O HOH 43 35.874 3.868 4.367 1.00 36.62 O HETATM 1775 O HOH 44 28.539 -0.144 5.778 1.00 40.16 O HETATM 1776 O HOH 45 22.860 8.407 -1.460 1.00 38.60 O HETATM 1777 O HOH 46 43.007 12.444 5.521 1.00 38.35 O HETATM 1778 O HOH 47 18.245 8.437 -0.127 1.00 35.85 O HETATM 1779 O HOH 48 34.606 13.734 23.640 1.00 42.70 O HETATM 1780 O HOH 49 11.296 21.779 33.074 1.00 28.79 O HETATM 1781 O HOH 50 29.185 18.717 27.818 1.00 24.61 O HETATM 1782 O HOH 51 30.293 23.877 7.323 1.00 27.82 O HETATM 1783 O HOH 52 29.891 -0.846 3.126 1.00 46.45 O HETATM 1784 O HOH 53 34.231 21.897 26.077 1.00 35.84 O HETATM 1785 O HOH 54 43.235 28.980 10.503 1.00 46.51 O HETATM 1786 O HOH 55 12.307 8.024 27.203 1.00 30.16 O HETATM 1787 O HOH 56 46.346 29.243 6.326 1.00 47.03 O HETATM 1788 O HOH 57 8.523 8.962 12.860 1.00 38.86 O HETATM 1789 O HOH 58 31.147 16.467 28.118 1.00 31.13 O HETATM 1790 O HOH 59 7.841 6.513 6.445 1.00 39.94 O HETATM 1791 O HOH 60 20.029 5.223 28.467 1.00 30.55 O HETATM 1792 O HOH 61 16.886 3.862 9.367 1.00 33.21 O HETATM 1793 O HOH 62 38.363 21.885 27.387 1.00 52.50 O HETATM 1794 CAA UNN A 63 19.431 26.755 21.791 1.00 -0.07 C HETATM 1795 CAH UNN A 63 19.299 25.454 21.015 1.00 -0.05 C HETATM 1796 CAI UNN A 63 20.504 25.165 20.134 1.00 -0.03 C HETATM 1797 CAJ UNN A 63 20.415 23.885 19.339 1.00 0.08 C HETATM 1798 OAK UNN A 63 21.649 23.144 19.543 1.00 -0.28 O HETATM 1799 CAL UNN A 63 21.803 21.980 18.895 1.00 0.25 C HETATM 1800 OAB UNN A 63 20.986 21.530 18.129 1.00 -0.36 O HETATM 1801 CAN UNN A 63 23.120 21.340 19.182 1.00 0.05 C HETATM 1802 CAF UNN A 63 24.106 21.991 19.924 1.00 -0.05 C HETATM 1803 CAD UNN A 63 25.377 21.455 20.040 1.00 -0.03 C HETATM 1804 CAM UNN A 63 25.679 20.247 19.427 1.00 0.09 C HETATM 1805 OAC UNN A 63 26.936 19.723 19.516 1.00 -0.33 O HETATM 1806 H12 UNN A 63 27.152 19.574 20.429 1.00 0.25 H HETATM 1807 CAE UNN A 63 24.699 19.574 18.710 1.00 -0.03 C HETATM 1808 CAG UNN A 63 23.432 20.116 18.592 1.00 -0.05 C HETATM 1809 H14 UNN A 63 22.672 19.582 18.034 1.00 0.06 H HETATM 1810 H13 UNN A 63 24.927 18.623 18.242 1.00 0.06 H HETATM 1811 H11 UNN A 63 26.136 21.979 20.610 1.00 0.06 H HETATM 1812 H10 UNN A 63 23.874 22.929 20.416 1.00 0.06 H HETATM 1813 H8 UNN A 63 20.291 24.117 18.271 1.00 0.06 H HETATM 1814 H9 UNN A 63 19.559 23.288 19.687 1.00 0.06 H HETATM 1815 H6 UNN A 63 21.393 25.106 20.779 1.00 0.03 H HETATM 1816 H7 UNN A 63 20.619 26.000 19.427 1.00 0.03 H HETATM 1817 H4 UNN A 63 18.405 25.515 20.377 1.00 0.03 H HETATM 1818 H5 UNN A 63 19.183 24.628 21.732 1.00 0.03 H HETATM 1819 H1 UNN A 63 18.532 26.907 22.407 1.00 0.02 H HETATM 1820 H2 UNN A 63 19.539 27.593 21.087 1.00 0.02 H HETATM 1821 H3 UNN A 63 20.317 26.706 22.441 1.00 0.02 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 727 728 731 732 733 CONECT 731 727 CONECT 732 727 CONECT 733 727 CONECT 1794 1795 1819 1820 1821 CONECT 1795 1794 1796 1817 1818 CONECT 1796 1795 1797 1815 1816 CONECT 1797 1796 1798 1813 1814 CONECT 1798 1797 1799 CONECT 1799 1798 1800 1801 CONECT 1800 1799 CONECT 1801 1799 1802 1808 CONECT 1802 1801 1803 1812 CONECT 1803 1802 1804 1811 CONECT 1804 1803 1805 1807 CONECT 1805 1804 1806 CONECT 1806 1805 CONECT 1807 1804 1808 1810 CONECT 1808 1801 1807 1809 CONECT 1809 1808 CONECT 1810 1807 CONECT 1811 1803 CONECT 1812 1802 CONECT 1813 1797 CONECT 1814 1797 CONECT 1815 1796 CONECT 1816 1796 CONECT 1817 1795 CONECT 1818 1795 CONECT 1819 1794 CONECT 1820 1794 CONECT 1821 1794 MASTER 0 0 0 0 0 0 0 0 1819 2 36 15 END
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Structure:
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Protein
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Related entries of code: 5z9e
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
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PDBbind
219aa, >1AJ6_1|Chain... at 93%
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PDBbind
205aa, >1KZN_1|Chain... at 100%
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RCSB PDB
PDBbind
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RCSB PDB
PDBbind
377aa, >4ZVI_1|Chain... at 100%
5l3j
RCSB PDB
PDBbind
378aa, >5L3J_1|Chain... *
5z4h
RCSB PDB
PDBbind
207aa, >5Z4H_1|Chains... at 100%
5z4o
RCSB PDB
PDBbind
207aa, >5Z4O_1|Chains... at 100%
6f96
RCSB PDB
PDBbind
221aa, >6F96_1|Chain... at 93%
6f94
RCSB PDB
PDBbind
221aa, >6F94_1|Chain... at 93%
6f8j
RCSB PDB
PDBbind
221aa, >6F8J_1|Chain... at 93%
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RCSB PDB
PDBbind
206aa, >6F86_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
4mg9
RCSB PDB
PDBbind
27K
Entry Information
PDB ID
5z9e
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
DNA gyrase ATPase domain
Ligand Name
27K
EC.Number
E.C.-.-.-.-
Resolution
1.8(Å)
Affinity (Kd/Ki/IC50)
IC50=0.33mM
Release Year
2018
Protein/NA Sequence
Check fasta file
Primary Reference
(2018) Medchemcomm Vol. 9: pp. 1619-1629
Ligand Properties
Formula
C
1
1
H
1
4
O
3
Molecular Weight
194.227
Exact Mass
194.094
No. of atoms
28
No. of bonds
28
Polar Surface Area
46.53
LOGP Value
2.67 (
Computed with XLOGP3
)
2.35 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 6
No. of Nitrogen and Oxygen Atoms: 3
No. of Rings: 1
Canonical SMILES
CCCCOC(=O)c1ccc(cc1)O
InChI String
InChI=1S/C11H14O3/c1-2-3-8-14-11(13)9-4-6-10(12)7-5-9/h4-7,12H,2-3,8H2,1H3
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):
P0AES6
Entrez Gene ID
NCBI Entrez Gene ID:
61752852
948211
ASD
Information of known allosteric effects of PDB entries
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