Browse entries in the PDBbind-CN Database
HEADER 1SHC_COMPLEX COMPND 1SHC_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 195 GLY SER HIS MET GLY GLN LEU GLY GLY GLU GLU TRP THR SEQRES 2 A 195 ARG HIS GLY SER PHE VAL ASN LYS PRO THR ARG GLY TRP SEQRES 3 A 195 LEU HIS PRO ASN ASP LYS VAL MET GLY PRO GLY VAL SER SEQRES 4 A 195 TYR LEU VAL ARG TYR MET GLY CYS VAL GLU VAL LEU GLN SEQRES 5 A 195 SER MET ARG ALA LEU ASP PHE ASN THR ARG THR GLN VAL SEQRES 6 A 195 THR ARG GLU ALA ILE SER LEU VAL CYS GLU ALA VAL PRO SEQRES 7 A 195 GLY ALA LYS GLY ALA THR ARG ARG ARG LYS PRO CYS SER SEQRES 8 A 195 ARG PRO LEU SER SER ILE LEU GLY ARG SER ASN LEU LYS SEQRES 9 A 195 PHE ALA GLY MET PRO ILE THR LEU THR VAL SER THR SER SEQRES 10 A 195 SER LEU ASN LEU MET ALA ALA ASP CYS LYS GLN ILE ILE SEQRES 11 A 195 ALA ASN HIS HIS MET GLN SER ILE SER PHE ALA SER GLY SEQRES 12 A 195 GLY ASP PRO ASP THR ALA GLU TYR VAL ALA TYR VAL ALA SEQRES 13 A 195 LYS ASP PRO VAL ASN GLN ARG ALA CYS HIS ILE LEU GLU SEQRES 14 A 195 CYS PRO GLU GLY LEU ALA GLN ASP VAL ILE SER THR ILE SEQRES 15 A 195 GLY GLN ALA PHE GLU LEU ARG PHE LYS GLN TYR LEU ARG HET HIS A 196 196 ATOM 1 N GLY A 13 -44.206 10.505 -12.834 1.00 25.56 N ATOM 2 CA GLY A 13 -44.501 9.371 -11.914 1.00 25.44 C ATOM 3 C GLY A 13 -43.909 9.666 -10.534 1.00 24.86 C ATOM 4 O GLY A 13 -43.116 8.907 -10.013 1.00 24.63 O ATOM 5 HA3 GLY A 13 -44.060 8.457 -12.311 1.00 0.00 H ATOM 6 HA2 GLY A 13 -45.580 9.244 -11.827 1.00 0.00 H ATOM 7 HN3 GLY A 13 -43.176 10.624 -12.916 1.00 0.00 H ATOM 8 HN2 GLY A 13 -44.628 11.377 -12.454 1.00 0.00 H ATOM 9 HN1 GLY A 13 -44.609 10.303 -13.771 1.00 0.00 H ATOM 10 N SER A 14 -44.287 10.764 -9.939 1.00 24.71 N ATOM 11 CA SER A 14 -43.745 11.108 -8.594 1.00 24.24 C ATOM 12 C SER A 14 -44.812 10.842 -7.529 1.00 23.55 C ATOM 13 O SER A 14 -45.971 11.159 -7.707 1.00 23.67 O ATOM 14 CB SER A 14 -43.354 12.586 -8.565 1.00 24.45 C ATOM 15 OG SER A 14 -42.107 12.754 -9.226 1.00 24.58 O ATOM 16 HA SER A 14 -42.867 10.495 -8.389 1.00 0.00 H ATOM 17 HB2 SER A 14 -43.267 12.920 -7.531 1.00 0.00 H ATOM 18 HB3 SER A 14 -44.118 13.175 -9.072 1.00 0.00 H ATOM 19 HG SER A 14 -41.415 12.218 -8.764 1.00 0.00 H ATOM 20 H SER A 14 -44.967 11.399 -10.404 1.00 0.00 H ATOM 21 N HIS A 15 -44.430 10.261 -6.424 1.00 22.93 N ATOM 22 CA HIS A 15 -45.424 9.976 -5.351 1.00 22.34 C ATOM 23 C HIS A 15 -44.728 9.290 -4.174 1.00 21.91 C ATOM 24 O HIS A 15 -45.042 9.537 -3.026 1.00 21.69 O ATOM 25 CB HIS A 15 -46.517 9.058 -5.900 1.00 22.19 C ATOM 26 CG HIS A 15 -45.910 8.079 -6.867 1.00 21.90 C ATOM 27 ND1 HIS A 15 -45.898 8.302 -8.234 1.00 21.86 N ATOM 28 CD2 HIS A 15 -45.290 6.869 -6.679 1.00 21.74 C ATOM 29 CE1 HIS A 15 -45.289 7.250 -8.812 1.00 21.70 C ATOM 30 NE2 HIS A 15 -44.898 6.347 -7.908 1.00 21.63 N ATOM 31 HA HIS A 15 -45.869 10.912 -5.013 1.00 0.00 H ATOM 32 HB2 HIS A 15 -46.983 8.515 -5.078 1.00 0.00 H ATOM 33 HB3 HIS A 15 -47.271 9.656 -6.413 1.00 0.00 H ATOM 34 HD2 HIS A 15 -45.129 6.390 -5.713 1.00 0.00 H ATOM 35 HE1 HIS A 15 -45.134 7.147 -9.886 1.00 0.00 H ATOM 36 H HIS A 15 -43.433 9.997 -6.293 1.00 0.00 H ATOM 37 N MET A 16 -43.785 8.429 -4.447 1.00 21.90 N ATOM 38 CA MET A 16 -43.072 7.729 -3.341 1.00 21.63 C ATOM 39 C MET A 16 -42.495 8.762 -2.369 1.00 20.88 C ATOM 40 O MET A 16 -43.051 9.019 -1.320 1.00 20.84 O ATOM 41 CB MET A 16 -41.941 6.878 -3.921 1.00 22.25 C ATOM 42 CG MET A 16 -42.476 5.486 -4.266 1.00 22.81 C ATOM 43 SD MET A 16 -41.278 4.616 -5.308 1.00 23.23 S ATOM 44 CE MET A 16 -42.015 5.033 -6.907 1.00 23.43 C ATOM 45 HA MET A 16 -43.771 7.085 -2.808 1.00 0.00 H ATOM 46 HB2 MET A 16 -41.554 7.353 -4.823 1.00 0.00 H ATOM 47 HB3 MET A 16 -41.140 6.788 -3.187 1.00 0.00 H ATOM 48 HG2 MET A 16 -43.420 5.582 -4.802 1.00 0.00 H ATOM 49 HG3 MET A 16 -42.637 4.921 -3.348 1.00 0.00 H ATOM 50 HE1 MET A 16 -43.033 4.645 -6.949 1.00 0.00 H ATOM 51 HE2 MET A 16 -42.032 6.116 -7.026 1.00 0.00 H ATOM 52 HE3 MET A 16 -41.422 4.588 -7.706 1.00 0.00 H ATOM 53 H MET A 16 -43.531 8.232 -5.436 1.00 0.00 H ATOM 54 N GLY A 17 -41.383 9.357 -2.707 1.00 20.39 N ATOM 55 CA GLY A 17 -40.777 10.371 -1.799 1.00 19.76 C ATOM 56 C GLY A 17 -40.584 11.688 -2.554 1.00 19.26 C ATOM 57 O GLY A 17 -39.669 12.434 -2.272 1.00 19.28 O ATOM 58 HA3 GLY A 17 -39.811 10.010 -1.446 1.00 0.00 H ATOM 59 HA2 GLY A 17 -41.436 10.535 -0.947 1.00 0.00 H ATOM 60 H GLY A 17 -40.921 9.123 -3.609 1.00 0.00 H ATOM 61 N GLN A 18 -41.448 11.964 -3.506 1.00 18.91 N ATOM 62 CA GLN A 18 -41.362 13.225 -4.317 1.00 18.54 C ATOM 63 C GLN A 18 -39.905 13.547 -4.682 1.00 18.16 C ATOM 64 O GLN A 18 -39.047 12.688 -4.660 1.00 18.27 O ATOM 65 CB GLN A 18 -42.010 14.393 -3.544 1.00 18.54 C ATOM 66 CG GLN A 18 -41.172 14.799 -2.321 1.00 18.72 C ATOM 67 CD GLN A 18 -41.676 14.052 -1.083 1.00 19.29 C ATOM 68 OE1 GLN A 18 -40.904 13.443 -0.370 1.00 19.50 O ATOM 69 NE2 GLN A 18 -42.948 14.078 -0.792 1.00 19.64 N ATOM 70 HA GLN A 18 -41.909 13.078 -5.249 1.00 0.00 H ATOM 71 HB2 GLN A 18 -42.101 15.251 -4.211 1.00 0.00 H ATOM 72 HB3 GLN A 18 -43.001 14.088 -3.208 1.00 0.00 H ATOM 73 HG2 GLN A 18 -40.126 14.546 -2.497 1.00 0.00 H ATOM 74 HG3 GLN A 18 -41.263 15.873 -2.159 1.00 0.00 H ATOM 75 HE22 GLN A 18 -43.610 14.599 -1.401 1.00 0.00 H ATOM 76 HE21 GLN A 18 -43.299 13.578 0.049 1.00 0.00 H ATOM 77 H GLN A 18 -42.214 11.289 -3.703 1.00 0.00 H ATOM 78 N LEU A 19 -39.620 14.776 -5.020 1.00 17.83 N ATOM 79 CA LEU A 19 -38.223 15.144 -5.386 1.00 17.59 C ATOM 80 C LEU A 19 -37.757 14.282 -6.562 1.00 17.60 C ATOM 81 O LEU A 19 -38.488 13.452 -7.065 1.00 17.96 O ATOM 82 CB LEU A 19 -37.300 14.910 -4.189 1.00 17.60 C ATOM 83 CG LEU A 19 -36.992 16.245 -3.510 1.00 17.61 C ATOM 84 CD1 LEU A 19 -38.291 17.021 -3.291 1.00 17.75 C ATOM 85 CD2 LEU A 19 -36.323 15.986 -2.158 1.00 17.78 C ATOM 86 HA LEU A 19 -38.191 16.196 -5.670 1.00 0.00 H ATOM 87 HB2 LEU A 19 -37.790 14.245 -3.477 1.00 0.00 H ATOM 88 HB3 LEU A 19 -36.371 14.454 -4.531 1.00 0.00 H ATOM 89 HG LEU A 19 -36.324 16.827 -4.144 1.00 0.00 H ATOM 90 HD21 LEU A 19 -36.994 15.403 -1.528 1.00 0.00 H ATOM 91 HD22 LEU A 19 -35.396 15.433 -2.313 1.00 0.00 H ATOM 92 HD23 LEU A 19 -36.104 16.938 -1.674 1.00 0.00 H ATOM 93 HD11 LEU A 19 -38.769 17.205 -4.253 1.00 0.00 H ATOM 94 HD12 LEU A 19 -38.959 16.437 -2.657 1.00 0.00 H ATOM 95 HD13 LEU A 19 -38.068 17.972 -2.807 1.00 0.00 H ATOM 96 H LEU A 19 -40.368 15.498 -5.034 1.00 0.00 H ATOM 97 N GLY A 20 -36.544 14.473 -7.004 1.00 17.33 N ATOM 98 CA GLY A 20 -36.030 13.667 -8.148 1.00 17.49 C ATOM 99 C GLY A 20 -34.871 12.775 -7.687 1.00 17.05 C ATOM 100 O GLY A 20 -34.572 11.770 -8.301 1.00 17.35 O ATOM 101 HA3 GLY A 20 -35.679 14.337 -8.933 1.00 0.00 H ATOM 102 HA2 GLY A 20 -36.833 13.042 -8.538 1.00 0.00 H ATOM 103 H GLY A 20 -35.935 15.188 -6.558 1.00 0.00 H ATOM 104 N GLY A 21 -34.214 13.128 -6.614 1.00 16.48 N ATOM 105 CA GLY A 21 -33.078 12.292 -6.130 1.00 16.19 C ATOM 106 C GLY A 21 -33.559 11.349 -5.024 1.00 15.84 C ATOM 107 O GLY A 21 -32.794 10.937 -4.174 1.00 15.96 O ATOM 108 HA3 GLY A 21 -32.294 12.940 -5.738 1.00 0.00 H ATOM 109 HA2 GLY A 21 -32.682 11.705 -6.959 1.00 0.00 H ATOM 110 H GLY A 21 -34.483 13.990 -6.099 1.00 0.00 H ATOM 111 N GLU A 22 -34.819 11.000 -5.024 1.00 15.57 N ATOM 112 CA GLU A 22 -35.336 10.083 -3.969 1.00 15.40 C ATOM 113 C GLU A 22 -36.670 9.480 -4.415 1.00 15.72 C ATOM 114 O GLU A 22 -37.519 9.164 -3.605 1.00 16.08 O ATOM 115 CB GLU A 22 -35.539 10.858 -2.664 1.00 15.50 C ATOM 116 CG GLU A 22 -36.103 12.248 -2.970 1.00 15.58 C ATOM 117 CD GLU A 22 -34.998 13.294 -2.809 1.00 15.81 C ATOM 118 OE1 GLU A 22 -34.766 13.714 -1.688 1.00 15.89 O ATOM 119 OE2 GLU A 22 -34.405 13.659 -3.811 1.00 16.05 O ATOM 120 HA GLU A 22 -34.613 9.283 -3.807 1.00 0.00 H ATOM 121 HB2 GLU A 22 -36.237 10.316 -2.026 1.00 0.00 H ATOM 122 HB3 GLU A 22 -34.583 10.960 -2.151 1.00 0.00 H ATOM 123 HG2 GLU A 22 -36.479 12.271 -3.993 1.00 0.00 H ATOM 124 HG3 GLU A 22 -36.917 12.470 -2.280 1.00 0.00 H ATOM 125 H GLU A 22 -35.460 11.362 -5.759 1.00 0.00 H ATOM 126 N GLU A 23 -36.863 9.315 -5.695 1.00 15.74 N ATOM 127 CA GLU A 23 -38.143 8.729 -6.185 1.00 16.24 C ATOM 128 C GLU A 23 -37.875 7.354 -6.805 1.00 16.18 C ATOM 129 O GLU A 23 -38.600 6.918 -7.676 1.00 16.59 O ATOM 130 CB GLU A 23 -38.754 9.651 -7.241 1.00 16.95 C ATOM 131 CG GLU A 23 -40.252 9.368 -7.358 1.00 17.49 C ATOM 132 CD GLU A 23 -41.036 10.448 -6.611 1.00 18.00 C ATOM 133 OE1 GLU A 23 -41.246 11.504 -7.184 1.00 17.99 O ATOM 134 OE2 GLU A 23 -41.412 10.201 -5.477 1.00 18.50 O ATOM 135 HA GLU A 23 -38.834 8.622 -5.349 1.00 0.00 H ATOM 136 HB2 GLU A 23 -38.602 10.690 -6.949 1.00 0.00 H ATOM 137 HB3 GLU A 23 -38.274 9.471 -8.203 1.00 0.00 H ATOM 138 HG2 GLU A 23 -40.541 9.370 -8.409 1.00 0.00 H ATOM 139 HG3 GLU A 23 -40.473 8.393 -6.924 1.00 0.00 H ATOM 140 H GLU A 23 -36.124 9.592 -6.373 1.00 0.00 H ATOM 141 N TRP A 24 -36.843 6.680 -6.341 1.00 15.79 N ATOM 142 CA TRP A 24 -36.478 5.321 -6.858 1.00 15.86 C ATOM 143 C TRP A 24 -36.744 5.205 -8.356 1.00 16.03 C ATOM 144 O TRP A 24 -37.370 4.279 -8.831 1.00 15.81 O ATOM 145 CB TRP A 24 -37.267 4.294 -6.068 1.00 15.52 C ATOM 146 CG TRP A 24 -37.220 4.707 -4.635 1.00 14.87 C ATOM 147 CD1 TRP A 24 -38.279 4.798 -3.808 1.00 14.58 C ATOM 148 CD2 TRP A 24 -36.064 5.123 -3.865 1.00 14.61 C ATOM 149 NE1 TRP A 24 -37.841 5.218 -2.563 1.00 14.18 N ATOM 150 CE2 TRP A 24 -36.477 5.433 -2.551 1.00 14.17 C ATOM 151 CE3 TRP A 24 -34.708 5.247 -4.182 1.00 14.85 C ATOM 152 CZ2 TRP A 24 -35.567 5.855 -1.581 1.00 13.97 C ATOM 153 CZ3 TRP A 24 -33.784 5.673 -3.213 1.00 14.63 C ATOM 154 CH2 TRP A 24 -34.214 5.975 -1.913 1.00 14.20 C ATOM 155 HA TRP A 24 -35.410 5.146 -6.726 1.00 0.00 H ATOM 156 HB2 TRP A 24 -38.300 4.268 -6.416 1.00 0.00 H ATOM 157 HB3 TRP A 24 -36.820 3.307 -6.187 1.00 0.00 H ATOM 158 HE1 TRP A 24 -38.462 5.354 -1.740 1.00 0.00 H ATOM 159 HD1 TRP A 24 -39.312 4.577 -4.075 1.00 0.00 H ATOM 160 HZ2 TRP A 24 -35.908 6.089 -0.573 1.00 0.00 H ATOM 161 HH2 TRP A 24 -33.495 6.303 -1.162 1.00 0.00 H ATOM 162 HZ3 TRP A 24 -32.730 5.769 -3.473 1.00 0.00 H ATOM 163 HE3 TRP A 24 -34.365 5.011 -5.189 1.00 0.00 H ATOM 164 H TRP A 24 -36.262 7.105 -5.591 1.00 0.00 H ATOM 165 N THR A 25 -36.254 6.156 -9.092 1.00 16.57 N ATOM 166 CA THR A 25 -36.441 6.153 -10.571 1.00 16.94 C ATOM 167 C THR A 25 -35.413 7.098 -11.194 1.00 17.34 C ATOM 168 O THR A 25 -35.758 8.071 -11.834 1.00 17.74 O ATOM 169 CB THR A 25 -37.854 6.633 -10.912 1.00 17.43 C ATOM 170 OG1 THR A 25 -38.010 6.671 -12.324 1.00 17.43 O ATOM 171 CG2 THR A 25 -38.073 8.032 -10.334 1.00 17.55 C ATOM 172 HA THR A 25 -36.306 5.145 -10.962 1.00 0.00 H ATOM 173 HB THR A 25 -38.585 5.948 -10.483 1.00 0.00 H ATOM 174 HG1 THR A 25 -37.345 7.294 -12.712 1.00 0.00 H ATOM 175 HG23 THR A 25 -37.953 7.999 -9.251 1.00 0.00 H ATOM 176 HG21 THR A 25 -37.342 8.719 -10.761 1.00 0.00 H ATOM 177 HG22 THR A 25 -39.079 8.371 -10.579 1.00 0.00 H ATOM 178 H THR A 25 -35.724 6.930 -8.644 1.00 0.00 H ATOM 179 N ARG A 26 -34.151 6.827 -11.004 1.00 17.33 N ATOM 180 CA ARG A 26 -33.107 7.721 -11.578 1.00 17.79 C ATOM 181 C ARG A 26 -31.871 6.904 -11.966 1.00 17.29 C ATOM 182 O ARG A 26 -31.884 5.690 -11.940 1.00 17.16 O ATOM 183 CB ARG A 26 -32.713 8.782 -10.537 1.00 18.16 C ATOM 184 CG ARG A 26 -33.085 8.312 -9.122 1.00 19.17 C ATOM 185 CD ARG A 26 -32.261 7.075 -8.755 1.00 19.78 C ATOM 186 NE ARG A 26 -32.932 6.325 -7.657 1.00 20.59 N ATOM 187 CZ ARG A 26 -32.700 5.047 -7.509 1.00 21.07 C ATOM 188 NH1 ARG A 26 -32.751 4.250 -8.541 1.00 21.47 N ATOM 189 NH2 ARG A 26 -32.419 4.566 -6.330 1.00 21.23 N ATOM 190 HA ARG A 26 -33.505 8.209 -12.468 1.00 0.00 H ATOM 191 HB2 ARG A 26 -31.638 8.953 -10.588 1.00 0.00 H ATOM 192 HB3 ARG A 26 -33.238 9.712 -10.756 1.00 0.00 H ATOM 193 HG2 ARG A 26 -32.878 9.110 -8.409 1.00 0.00 H ATOM 194 HG3 ARG A 26 -34.146 8.064 -9.090 1.00 0.00 H ATOM 195 HD2 ARG A 26 -31.269 7.386 -8.427 1.00 0.00 H ATOM 196 HD3 ARG A 26 -32.168 6.430 -9.629 1.00 0.00 H ATOM 197 HE ARG A 26 -33.582 6.816 -7.011 1.00 0.00 H ATOM 198 HH12 ARG A 26 -32.566 3.233 -8.423 1.00 0.00 H ATOM 199 HH11 ARG A 26 -32.976 4.631 -9.482 1.00 0.00 H ATOM 200 HH22 ARG A 26 -32.235 3.549 -6.214 1.00 0.00 H ATOM 201 HH21 ARG A 26 -32.379 5.199 -5.506 1.00 0.00 H ATOM 202 H ARG A 26 -33.875 5.989 -10.453 1.00 0.00 H ATOM 203 N HIS A 27 -30.802 7.563 -12.321 1.00 17.13 N ATOM 204 CA HIS A 27 -29.567 6.825 -12.702 1.00 16.76 C ATOM 205 C HIS A 27 -28.988 6.144 -11.456 1.00 16.16 C ATOM 206 O HIS A 27 -29.622 6.091 -10.421 1.00 16.16 O ATOM 207 CB HIS A 27 -28.547 7.810 -13.281 1.00 17.34 C ATOM 208 CG HIS A 27 -28.340 8.943 -12.314 1.00 17.73 C ATOM 209 ND1 HIS A 27 -27.489 8.838 -11.227 1.00 17.97 N ATOM 210 CD2 HIS A 27 -28.868 10.209 -12.258 1.00 18.09 C ATOM 211 CE1 HIS A 27 -27.528 10.011 -10.567 1.00 18.44 C ATOM 212 NE2 HIS A 27 -28.353 10.882 -11.153 1.00 18.54 N ATOM 213 HA HIS A 27 -29.799 6.070 -13.453 1.00 0.00 H ATOM 214 HB2 HIS A 27 -27.600 7.297 -13.448 1.00 0.00 H ATOM 215 HB3 HIS A 27 -28.918 8.203 -14.228 1.00 0.00 H ATOM 216 HD2 HIS A 27 -29.581 10.624 -12.970 1.00 0.00 H ATOM 217 HE1 HIS A 27 -26.956 10.224 -9.664 1.00 0.00 H ATOM 218 H HIS A 27 -30.813 8.603 -12.338 1.00 0.00 H ATOM 219 N GLY A 28 -27.796 5.621 -11.543 1.00 15.78 N ATOM 220 CA GLY A 28 -27.190 4.944 -10.359 1.00 15.32 C ATOM 221 C GLY A 28 -26.919 5.965 -9.250 1.00 14.37 C ATOM 222 O GLY A 28 -27.793 6.704 -8.844 1.00 14.03 O ATOM 223 HA3 GLY A 28 -26.252 4.474 -10.653 1.00 0.00 H ATOM 224 HA2 GLY A 28 -27.876 4.182 -9.988 1.00 0.00 H ATOM 225 H GLY A 28 -27.268 5.676 -12.437 1.00 0.00 H ATOM 226 N SER A 29 -25.708 6.006 -8.758 1.00 14.09 N ATOM 227 CA SER A 29 -25.359 6.971 -7.672 1.00 13.31 C ATOM 228 C SER A 29 -26.080 6.581 -6.378 1.00 12.88 C ATOM 229 O SER A 29 -26.743 7.393 -5.770 1.00 13.39 O ATOM 230 CB SER A 29 -25.766 8.387 -8.080 1.00 13.34 C ATOM 231 OG SER A 29 -25.430 8.597 -9.445 1.00 13.94 O ATOM 232 HA SER A 29 -24.282 6.942 -7.507 1.00 0.00 H ATOM 233 HB2 SER A 29 -25.238 9.111 -7.459 1.00 0.00 H ATOM 234 HB3 SER A 29 -26.841 8.510 -7.946 1.00 0.00 H ATOM 235 HG SER A 29 -25.910 7.938 -10.007 1.00 0.00 H ATOM 236 H SER A 29 -24.981 5.360 -9.126 1.00 0.00 H ATOM 237 N PHE A 30 -25.929 5.339 -5.969 1.00 12.10 N ATOM 238 CA PHE A 30 -26.564 4.806 -4.716 1.00 11.85 C ATOM 239 C PHE A 30 -27.984 5.364 -4.513 1.00 11.57 C ATOM 240 O PHE A 30 -28.941 4.766 -4.958 1.00 11.99 O ATOM 241 CB PHE A 30 -25.676 5.116 -3.493 1.00 11.87 C ATOM 242 CG PHE A 30 -24.614 6.128 -3.861 1.00 11.97 C ATOM 243 CD1 PHE A 30 -23.484 5.725 -4.584 1.00 12.04 C ATOM 244 CD2 PHE A 30 -24.762 7.471 -3.487 1.00 12.21 C ATOM 245 CE1 PHE A 30 -22.504 6.662 -4.932 1.00 12.30 C ATOM 246 CE2 PHE A 30 -23.782 8.407 -3.837 1.00 12.49 C ATOM 247 CZ PHE A 30 -22.654 8.002 -4.559 1.00 12.51 C ATOM 248 HA PHE A 30 -26.653 3.725 -4.823 1.00 0.00 H ATOM 249 HB2 PHE A 30 -26.295 5.519 -2.691 1.00 0.00 H ATOM 250 HB3 PHE A 30 -25.197 4.198 -3.154 1.00 0.00 H ATOM 251 HD2 PHE A 30 -25.640 7.786 -2.924 1.00 0.00 H ATOM 252 HE2 PHE A 30 -23.898 9.451 -3.547 1.00 0.00 H ATOM 253 HZ PHE A 30 -21.891 8.731 -4.831 1.00 0.00 H ATOM 254 HE1 PHE A 30 -21.624 6.348 -5.493 1.00 0.00 H ATOM 255 HD1 PHE A 30 -23.368 4.681 -4.876 1.00 0.00 H ATOM 256 H PHE A 30 -25.343 4.697 -6.540 1.00 0.00 H ATOM 257 N VAL A 31 -28.105 6.497 -3.850 1.00 11.03 N ATOM 258 CA VAL A 31 -29.440 7.145 -3.585 1.00 10.95 C ATOM 259 C VAL A 31 -30.113 6.520 -2.353 1.00 10.79 C ATOM 260 O VAL A 31 -30.561 7.221 -1.468 1.00 10.80 O ATOM 261 CB VAL A 31 -30.373 7.022 -4.794 1.00 11.54 C ATOM 262 CG1 VAL A 31 -31.575 7.950 -4.599 1.00 11.83 C ATOM 263 CG2 VAL A 31 -29.620 7.423 -6.064 1.00 11.52 C ATOM 264 HA VAL A 31 -29.254 8.202 -3.397 1.00 0.00 H ATOM 265 HB VAL A 31 -30.716 5.992 -4.888 1.00 0.00 H ATOM 266 HG11 VAL A 31 -32.110 7.664 -3.693 1.00 0.00 H ATOM 267 HG12 VAL A 31 -31.227 8.979 -4.508 1.00 0.00 H ATOM 268 HG13 VAL A 31 -32.241 7.865 -5.458 1.00 0.00 H ATOM 269 HG21 VAL A 31 -29.278 8.454 -5.972 1.00 0.00 H ATOM 270 HG22 VAL A 31 -28.762 6.765 -6.199 1.00 0.00 H ATOM 271 HG23 VAL A 31 -30.286 7.335 -6.923 1.00 0.00 H ATOM 272 H VAL A 31 -27.245 6.962 -3.496 1.00 0.00 H ATOM 273 N ASN A 32 -30.198 5.218 -2.283 1.00 10.86 N ATOM 274 CA ASN A 32 -30.848 4.574 -1.107 1.00 10.98 C ATOM 275 C ASN A 32 -30.193 5.067 0.186 1.00 10.58 C ATOM 276 O ASN A 32 -30.812 5.097 1.232 1.00 10.92 O ATOM 277 CB ASN A 32 -30.698 3.055 -1.209 1.00 11.72 C ATOM 278 CG ASN A 32 -32.035 2.438 -1.622 1.00 12.33 C ATOM 279 OD1 ASN A 32 -32.581 1.614 -0.915 1.00 12.41 O ATOM 280 ND2 ASN A 32 -32.590 2.804 -2.745 1.00 12.91 N ATOM 281 HA ASN A 32 -31.906 4.836 -1.095 1.00 0.00 H ATOM 282 HB2 ASN A 32 -29.940 2.814 -1.954 1.00 0.00 H ATOM 283 HB3 ASN A 32 -30.395 2.654 -0.242 1.00 0.00 H ATOM 284 HD22 ASN A 32 -32.123 3.509 -3.350 1.00 0.00 H ATOM 285 HD21 ASN A 32 -33.499 2.391 -3.035 1.00 0.00 H ATOM 286 H ASN A 32 -29.811 4.630 -3.049 1.00 0.00 H ATOM 287 N LYS A 33 -28.948 5.455 0.128 1.00 10.04 N ATOM 288 CA LYS A 33 -28.268 5.945 1.360 1.00 9.82 C ATOM 289 C LYS A 33 -27.591 7.288 1.071 1.00 9.03 C ATOM 290 O LYS A 33 -27.338 7.621 -0.070 1.00 8.57 O ATOM 291 CB LYS A 33 -27.216 4.927 1.810 1.00 10.03 C ATOM 292 CG LYS A 33 -26.627 4.216 0.589 1.00 9.88 C ATOM 293 CD LYS A 33 -27.482 2.994 0.246 1.00 10.49 C ATOM 294 CE LYS A 33 -27.406 2.722 -1.257 1.00 10.64 C ATOM 295 NZ LYS A 33 -26.063 2.170 -1.595 1.00 10.91 N ATOM 296 HA LYS A 33 -29.006 6.073 2.152 1.00 0.00 H ATOM 297 HB2 LYS A 33 -26.420 5.442 2.348 1.00 0.00 H ATOM 298 HB3 LYS A 33 -27.681 4.192 2.468 1.00 0.00 H ATOM 299 HG2 LYS A 33 -26.615 4.901 -0.259 1.00 0.00 H ATOM 300 HG3 LYS A 33 -25.609 3.896 0.811 1.00 0.00 H ATOM 301 HD2 LYS A 33 -27.111 2.126 0.791 1.00 0.00 H ATOM 302 HD3 LYS A 33 -28.517 3.184 0.529 1.00 0.00 H ATOM 303 HE2 LYS A 33 -27.565 3.652 -1.803 1.00 0.00 H ATOM 304 HE3 LYS A 33 -28.176 2.002 -1.536 1.00 0.00 H ATOM 305 HZ1 LYS A 33 -25.330 2.858 -1.329 1.00 0.00 H ATOM 306 HZ2 LYS A 33 -25.913 1.283 -1.074 1.00 0.00 H ATOM 307 HZ3 LYS A 33 -26.013 1.985 -2.617 1.00 0.00 H ATOM 308 H LYS A 33 -28.433 5.422 -0.775 1.00 0.00 H ATOM 309 N PRO A 34 -27.320 8.021 2.120 1.00 9.13 N ATOM 310 CA PRO A 34 -26.677 9.335 2.035 1.00 8.70 C ATOM 311 C PRO A 34 -25.176 9.174 1.779 1.00 7.89 C ATOM 312 O PRO A 34 -24.574 9.942 1.055 1.00 7.88 O ATOM 313 CB PRO A 34 -26.911 9.994 3.387 1.00 9.37 C ATOM 314 CG PRO A 34 -27.069 8.783 4.341 1.00 10.03 C ATOM 315 CD PRO A 34 -27.634 7.607 3.505 1.00 9.96 C ATOM 316 HA PRO A 34 -27.084 9.931 1.218 1.00 0.00 H ATOM 317 HD3 PRO A 34 -27.139 6.669 3.758 1.00 0.00 H ATOM 318 HD2 PRO A 34 -28.709 7.500 3.651 1.00 0.00 H ATOM 319 HG3 PRO A 34 -27.758 9.031 5.149 1.00 0.00 H ATOM 320 HG2 PRO A 34 -26.101 8.511 4.762 1.00 0.00 H ATOM 321 HB2 PRO A 34 -26.060 10.612 3.675 1.00 0.00 H ATOM 322 HB3 PRO A 34 -27.814 10.604 3.375 1.00 0.00 H ATOM 323 N THR A 35 -24.566 8.184 2.371 1.00 7.42 N ATOM 324 CA THR A 35 -23.105 7.980 2.163 1.00 6.75 C ATOM 325 C THR A 35 -22.827 7.731 0.669 1.00 6.24 C ATOM 326 O THR A 35 -22.780 8.662 -0.109 1.00 6.57 O ATOM 327 CB THR A 35 -22.632 6.796 3.014 1.00 6.86 C ATOM 328 OG1 THR A 35 -23.588 5.747 2.935 1.00 7.48 O ATOM 329 CG2 THR A 35 -22.478 7.240 4.469 1.00 7.14 C ATOM 330 HA THR A 35 -22.556 8.870 2.471 1.00 0.00 H ATOM 331 HB THR A 35 -21.671 6.441 2.642 1.00 0.00 H ATOM 332 HG1 THR A 35 -23.283 4.982 3.484 1.00 0.00 H ATOM 333 HG23 THR A 35 -21.745 8.044 4.526 1.00 0.00 H ATOM 334 HG21 THR A 35 -23.438 7.595 4.843 1.00 0.00 H ATOM 335 HG22 THR A 35 -22.142 6.396 5.071 1.00 0.00 H ATOM 336 H THR A 35 -25.099 7.538 2.987 1.00 0.00 H ATOM 337 N ARG A 36 -22.645 6.497 0.251 1.00 5.76 N ATOM 338 CA ARG A 36 -22.376 6.230 -1.192 1.00 5.61 C ATOM 339 C ARG A 36 -22.051 4.747 -1.391 1.00 4.98 C ATOM 340 O ARG A 36 -22.390 4.160 -2.400 1.00 5.23 O ATOM 341 CB ARG A 36 -21.191 7.074 -1.678 1.00 6.00 C ATOM 342 CG ARG A 36 -20.056 7.047 -0.648 1.00 6.44 C ATOM 343 CD ARG A 36 -19.769 8.471 -0.167 1.00 7.12 C ATOM 344 NE ARG A 36 -19.617 9.373 -1.343 1.00 7.81 N ATOM 345 CZ ARG A 36 -20.469 10.343 -1.536 1.00 8.51 C ATOM 346 NH1 ARG A 36 -20.762 11.158 -0.560 1.00 9.15 N ATOM 347 NH2 ARG A 36 -21.030 10.498 -2.705 1.00 8.79 N ATOM 348 HA ARG A 36 -23.264 6.494 -1.766 1.00 0.00 H ATOM 349 HB2 ARG A 36 -20.828 6.672 -2.624 1.00 0.00 H ATOM 350 HB3 ARG A 36 -21.519 8.103 -1.824 1.00 0.00 H ATOM 351 HG2 ARG A 36 -20.350 6.429 0.200 1.00 0.00 H ATOM 352 HG3 ARG A 36 -19.159 6.630 -1.106 1.00 0.00 H ATOM 353 HD2 ARG A 36 -18.849 8.479 0.418 1.00 0.00 H ATOM 354 HD3 ARG A 36 -20.595 8.819 0.453 1.00 0.00 H ATOM 355 HE ARG A 36 -18.832 9.230 -2.010 1.00 0.00 H ATOM 356 HH12 ARG A 36 -21.441 11.931 -0.714 1.00 0.00 H ATOM 357 HH11 ARG A 36 -20.317 11.035 0.372 1.00 0.00 H ATOM 358 HH22 ARG A 36 -21.709 11.271 -2.858 1.00 0.00 H ATOM 359 HH21 ARG A 36 -20.798 9.848 -3.483 1.00 0.00 H ATOM 360 H ARG A 36 -22.689 5.707 0.927 1.00 0.00 H ATOM 361 N GLY A 37 -21.395 4.136 -0.442 1.00 4.40 N ATOM 362 CA GLY A 37 -21.050 2.693 -0.587 1.00 3.92 C ATOM 363 C GLY A 37 -19.687 2.560 -1.269 1.00 3.10 C ATOM 364 O GLY A 37 -18.711 2.175 -0.656 1.00 3.23 O ATOM 365 HA3 GLY A 37 -21.809 2.197 -1.192 1.00 0.00 H ATOM 366 HA2 GLY A 37 -21.011 2.228 0.398 1.00 0.00 H ATOM 367 H GLY A 37 -21.113 4.655 0.414 1.00 0.00 H ATOM 368 N TRP A 38 -19.612 2.876 -2.534 1.00 2.62 N ATOM 369 CA TRP A 38 -18.312 2.768 -3.255 1.00 2.05 C ATOM 370 C TRP A 38 -17.750 1.355 -3.089 1.00 1.53 C ATOM 371 O TRP A 38 -18.441 0.450 -2.666 1.00 1.86 O ATOM 372 CB TRP A 38 -17.326 3.783 -2.683 1.00 2.41 C ATOM 373 CG TRP A 38 -17.020 4.803 -3.729 1.00 2.55 C ATOM 374 CD1 TRP A 38 -17.863 5.780 -4.131 1.00 2.86 C ATOM 375 CD2 TRP A 38 -15.808 4.957 -4.518 1.00 2.59 C ATOM 376 NE1 TRP A 38 -17.240 6.531 -5.112 1.00 3.03 N ATOM 377 CE2 TRP A 38 -15.971 6.062 -5.386 1.00 2.91 C ATOM 378 CE3 TRP A 38 -14.595 4.252 -4.560 1.00 2.56 C ATOM 379 CZ2 TRP A 38 -14.962 6.454 -6.267 1.00 3.17 C ATOM 380 CZ3 TRP A 38 -13.576 4.642 -5.445 1.00 2.88 C ATOM 381 CH2 TRP A 38 -13.759 5.742 -6.296 1.00 3.17 C ATOM 382 HA TRP A 38 -18.467 2.972 -4.314 1.00 0.00 H ATOM 383 HB2 TRP A 38 -17.766 4.271 -1.813 1.00 0.00 H ATOM 384 HB3 TRP A 38 -16.408 3.275 -2.387 1.00 0.00 H ATOM 385 HE1 TRP A 38 -17.675 7.349 -5.585 1.00 0.00 H ATOM 386 HD1 TRP A 38 -18.869 5.949 -3.746 1.00 0.00 H ATOM 387 HZ2 TRP A 38 -15.111 7.308 -6.927 1.00 0.00 H ATOM 388 HH2 TRP A 38 -12.964 6.041 -6.979 1.00 0.00 H ATOM 389 HZ3 TRP A 38 -12.638 4.087 -5.471 1.00 0.00 H ATOM 390 HE3 TRP A 38 -14.443 3.397 -3.902 1.00 0.00 H ATOM 391 H TRP A 38 -20.460 3.203 -3.039 1.00 0.00 H ATOM 392 N LEU A 39 -16.502 1.155 -3.418 1.00 1.00 N ATOM 393 CA LEU A 39 -15.910 -0.204 -3.275 1.00 0.68 C ATOM 394 C LEU A 39 -15.876 -0.594 -1.786 1.00 0.63 C ATOM 395 O LEU A 39 -16.289 0.159 -0.915 1.00 0.61 O ATOM 396 CB LEU A 39 -14.485 -0.217 -3.839 1.00 0.79 C ATOM 397 CG LEU A 39 -14.501 -0.237 -5.366 1.00 0.84 C ATOM 398 CD1 LEU A 39 -13.057 -0.214 -5.877 1.00 0.71 C ATOM 399 CD2 LEU A 39 -15.183 -1.516 -5.850 1.00 1.61 C ATOM 400 HA LEU A 39 -16.519 -0.919 -3.828 1.00 0.00 H ATOM 401 HB2 LEU A 39 -13.959 0.675 -3.499 1.00 0.00 H ATOM 402 HB3 LEU A 39 -13.966 -1.104 -3.476 1.00 0.00 H ATOM 403 HG LEU A 39 -15.044 0.630 -5.741 1.00 0.00 H ATOM 404 HD21 LEU A 39 -14.634 -2.382 -5.480 1.00 0.00 H ATOM 405 HD22 LEU A 39 -16.206 -1.545 -5.474 1.00 0.00 H ATOM 406 HD23 LEU A 39 -15.194 -1.530 -6.940 1.00 0.00 H ATOM 407 HD11 LEU A 39 -12.563 0.691 -5.525 1.00 0.00 H ATOM 408 HD12 LEU A 39 -12.526 -1.089 -5.502 1.00 0.00 H ATOM 409 HD13 LEU A 39 -13.058 -0.228 -6.967 1.00 0.00 H ATOM 410 H LEU A 39 -15.924 1.941 -3.778 1.00 0.00 H ATOM 411 N HIS A 40 -15.386 -1.769 -1.490 1.00 0.66 N ATOM 412 CA HIS A 40 -15.327 -2.227 -0.070 1.00 0.66 C ATOM 413 C HIS A 40 -14.151 -1.609 0.737 1.00 0.59 C ATOM 414 O HIS A 40 -14.274 -1.506 1.936 1.00 0.63 O ATOM 415 CB HIS A 40 -15.233 -3.758 -0.026 1.00 0.78 C ATOM 416 CG HIS A 40 -13.912 -4.218 -0.577 1.00 0.91 C ATOM 417 ND1 HIS A 40 -13.817 -4.959 -1.744 1.00 1.48 N ATOM 418 CD2 HIS A 40 -12.624 -4.054 -0.132 1.00 1.17 C ATOM 419 CE1 HIS A 40 -12.513 -5.212 -1.959 1.00 1.95 C ATOM 420 NE2 HIS A 40 -11.742 -4.683 -1.006 1.00 1.70 N ATOM 421 HA HIS A 40 -16.245 -1.881 0.405 1.00 0.00 H ATOM 422 HB2 HIS A 40 -15.329 -4.094 1.006 1.00 0.00 H ATOM 423 HB3 HIS A 40 -16.039 -4.185 -0.622 1.00 0.00 H ATOM 424 HD2 HIS A 40 -12.336 -3.513 0.769 1.00 0.00 H ATOM 425 HE1 HIS A 40 -12.132 -5.780 -2.808 1.00 0.00 H ATOM 426 H HIS A 40 -15.035 -2.389 -2.248 1.00 0.00 H ATOM 427 N PRO A 41 -13.048 -1.210 0.118 1.00 0.56 N ATOM 428 CA PRO A 41 -11.925 -0.616 0.860 1.00 0.54 C ATOM 429 C PRO A 41 -12.387 0.678 1.542 1.00 0.51 C ATOM 430 O PRO A 41 -12.052 0.950 2.677 1.00 0.51 O ATOM 431 CB PRO A 41 -10.852 -0.295 -0.182 1.00 0.69 C ATOM 432 CG PRO A 41 -11.237 -1.217 -1.353 1.00 0.69 C ATOM 433 CD PRO A 41 -12.772 -1.290 -1.329 1.00 0.65 C ATOM 434 HA PRO A 41 -11.548 -1.290 1.629 1.00 0.00 H ATOM 435 HD3 PRO A 41 -13.219 -0.454 -1.867 1.00 0.00 H ATOM 436 HD2 PRO A 41 -13.133 -2.227 -1.752 1.00 0.00 H ATOM 437 HG3 PRO A 41 -10.806 -2.209 -1.216 1.00 0.00 H ATOM 438 HG2 PRO A 41 -10.890 -0.799 -2.298 1.00 0.00 H ATOM 439 HB2 PRO A 41 -10.890 0.754 -0.477 1.00 0.00 H ATOM 440 HB3 PRO A 41 -9.856 -0.529 0.193 1.00 0.00 H ATOM 441 N ASN A 42 -13.151 1.480 0.848 1.00 0.53 N ATOM 442 CA ASN A 42 -13.631 2.762 1.441 1.00 0.58 C ATOM 443 C ASN A 42 -14.841 2.521 2.345 1.00 0.53 C ATOM 444 O ASN A 42 -14.910 3.043 3.439 1.00 0.53 O ATOM 445 CB ASN A 42 -14.022 3.724 0.318 1.00 0.68 C ATOM 446 CG ASN A 42 -14.700 4.959 0.913 1.00 1.45 C ATOM 447 OD1 ASN A 42 -14.054 5.954 1.174 1.00 2.10 O ATOM 448 ND2 ASN A 42 -15.985 4.936 1.141 1.00 2.30 N ATOM 449 HA ASN A 42 -12.828 3.192 2.040 1.00 0.00 H ATOM 450 HB2 ASN A 42 -13.128 4.028 -0.227 1.00 0.00 H ATOM 451 HB3 ASN A 42 -14.710 3.225 -0.364 1.00 0.00 H ATOM 452 HD22 ASN A 42 -16.538 4.084 0.917 1.00 0.00 H ATOM 453 HD21 ASN A 42 -16.456 5.770 1.546 1.00 0.00 H ATOM 454 H ASN A 42 -13.425 1.223 -0.122 1.00 0.00 H ATOM 455 N ASP A 43 -15.800 1.749 1.909 1.00 0.53 N ATOM 456 CA ASP A 43 -16.993 1.509 2.775 1.00 0.53 C ATOM 457 C ASP A 43 -16.547 0.972 4.142 1.00 0.50 C ATOM 458 O ASP A 43 -17.127 1.281 5.168 1.00 0.58 O ATOM 459 CB ASP A 43 -17.912 0.488 2.103 1.00 0.55 C ATOM 460 CG ASP A 43 -19.345 0.687 2.598 1.00 0.88 C ATOM 461 OD1 ASP A 43 -19.683 1.808 2.940 1.00 1.40 O ATOM 462 OD2 ASP A 43 -20.081 -0.286 2.628 1.00 1.55 O ATOM 463 HA ASP A 43 -17.528 2.448 2.916 1.00 0.00 H ATOM 464 HB2 ASP A 43 -17.879 0.625 1.022 1.00 0.00 H ATOM 465 HB3 ASP A 43 -17.579 -0.520 2.351 1.00 0.00 H ATOM 466 H ASP A 43 -15.734 1.307 0.970 1.00 0.00 H ATOM 467 N LYS A 44 -15.524 0.169 4.164 1.00 0.44 N ATOM 468 CA LYS A 44 -15.043 -0.396 5.455 1.00 0.42 C ATOM 469 C LYS A 44 -14.103 0.590 6.149 1.00 0.41 C ATOM 470 O LYS A 44 -14.073 0.664 7.362 1.00 0.43 O ATOM 471 CB LYS A 44 -14.306 -1.706 5.195 1.00 0.42 C ATOM 472 CG LYS A 44 -14.871 -2.798 6.105 1.00 0.58 C ATOM 473 CD LYS A 44 -15.836 -3.679 5.311 1.00 0.86 C ATOM 474 CE LYS A 44 -15.276 -5.100 5.224 1.00 1.37 C ATOM 475 NZ LYS A 44 -15.927 -5.824 4.096 1.00 1.96 N ATOM 476 HA LYS A 44 -15.901 -0.579 6.101 1.00 0.00 H ATOM 477 HB2 LYS A 44 -14.438 -1.997 4.153 1.00 0.00 H ATOM 478 HB3 LYS A 44 -13.244 -1.573 5.402 1.00 0.00 H ATOM 479 HG2 LYS A 44 -14.054 -3.409 6.489 1.00 0.00 H ATOM 480 HG3 LYS A 44 -15.402 -2.338 6.938 1.00 0.00 H ATOM 481 HD2 LYS A 44 -16.804 -3.700 5.811 1.00 0.00 H ATOM 482 HD3 LYS A 44 -15.956 -3.273 4.306 1.00 0.00 H ATOM 483 HE2 LYS A 44 -15.475 -5.627 6.157 1.00 0.00 H ATOM 484 HE3 LYS A 44 -14.200 -5.057 5.055 1.00 0.00 H ATOM 485 HZ1 LYS A 44 -16.953 -5.865 4.258 1.00 0.00 H ATOM 486 HZ2 LYS A 44 -15.736 -5.321 3.206 1.00 0.00 H ATOM 487 HZ3 LYS A 44 -15.545 -6.790 4.039 1.00 0.00 H ATOM 488 H LYS A 44 -15.041 -0.079 3.277 1.00 0.00 H ATOM 489 N VAL A 45 -13.339 1.351 5.403 1.00 0.40 N ATOM 490 CA VAL A 45 -12.416 2.326 6.054 1.00 0.41 C ATOM 491 C VAL A 45 -13.249 3.205 6.978 1.00 0.44 C ATOM 492 O VAL A 45 -12.861 3.509 8.088 1.00 0.44 O ATOM 493 CB VAL A 45 -11.725 3.193 4.999 1.00 0.44 C ATOM 494 CG1 VAL A 45 -11.447 4.581 5.581 1.00 0.44 C ATOM 495 CG2 VAL A 45 -10.400 2.542 4.601 1.00 0.47 C ATOM 496 HA VAL A 45 -11.645 1.797 6.614 1.00 0.00 H ATOM 497 HB VAL A 45 -12.370 3.285 4.125 1.00 0.00 H ATOM 498 HG11 VAL A 45 -12.388 5.046 5.874 1.00 0.00 H ATOM 499 HG12 VAL A 45 -10.800 4.485 6.453 1.00 0.00 H ATOM 500 HG13 VAL A 45 -10.955 5.197 4.829 1.00 0.00 H ATOM 501 HG21 VAL A 45 -9.761 2.456 5.480 1.00 0.00 H ATOM 502 HG22 VAL A 45 -10.592 1.550 4.191 1.00 0.00 H ATOM 503 HG23 VAL A 45 -9.906 3.158 3.850 1.00 0.00 H ATOM 504 H VAL A 45 -13.376 1.276 4.366 1.00 0.00 H ATOM 505 N MET A 46 -14.407 3.596 6.527 1.00 0.52 N ATOM 506 CA MET A 46 -15.287 4.435 7.377 1.00 0.59 C ATOM 507 C MET A 46 -15.997 3.516 8.374 1.00 0.58 C ATOM 508 O MET A 46 -16.286 3.897 9.491 1.00 0.67 O ATOM 509 CB MET A 46 -16.317 5.154 6.504 1.00 0.65 C ATOM 510 CG MET A 46 -15.694 6.428 5.931 1.00 0.85 C ATOM 511 SD MET A 46 -16.199 7.851 6.929 1.00 1.37 S ATOM 512 CE MET A 46 -14.554 8.573 7.142 1.00 1.39 C ATOM 513 HA MET A 46 -14.701 5.185 7.908 1.00 0.00 H ATOM 514 HB2 MET A 46 -16.623 4.499 5.688 1.00 0.00 H ATOM 515 HB3 MET A 46 -17.188 5.413 7.106 1.00 0.00 H ATOM 516 HG2 MET A 46 -16.031 6.567 4.904 1.00 0.00 H ATOM 517 HG3 MET A 46 -14.608 6.340 5.947 1.00 0.00 H ATOM 518 HE1 MET A 46 -13.907 7.857 7.648 1.00 0.00 H ATOM 519 HE2 MET A 46 -14.136 8.815 6.165 1.00 0.00 H ATOM 520 HE3 MET A 46 -14.632 9.481 7.741 1.00 0.00 H ATOM 521 H MET A 46 -14.714 3.320 5.572 1.00 0.00 H ATOM 522 N GLY A 47 -16.271 2.297 7.976 1.00 0.52 N ATOM 523 CA GLY A 47 -16.952 1.344 8.896 1.00 0.56 C ATOM 524 C GLY A 47 -15.947 0.868 9.961 1.00 0.60 C ATOM 525 O GLY A 47 -15.196 1.668 10.483 1.00 0.71 O ATOM 526 HA3 GLY A 47 -17.318 0.487 8.330 1.00 0.00 H ATOM 527 HA2 GLY A 47 -17.791 1.842 9.382 1.00 0.00 H ATOM 528 H GLY A 47 -16.012 1.995 7.015 1.00 0.00 H ATOM 529 N PRO A 48 -15.952 -0.414 10.262 1.00 0.60 N ATOM 530 CA PRO A 48 -15.044 -0.994 11.261 1.00 0.66 C ATOM 531 C PRO A 48 -13.608 -1.044 10.722 1.00 0.60 C ATOM 532 O PRO A 48 -12.655 -1.005 11.473 1.00 0.67 O ATOM 533 CB PRO A 48 -15.560 -2.405 11.524 1.00 0.72 C ATOM 534 CG PRO A 48 -16.310 -2.746 10.215 1.00 0.92 C ATOM 535 CD PRO A 48 -16.856 -1.414 9.646 1.00 0.71 C ATOM 536 HA PRO A 48 -15.022 -0.397 12.172 1.00 0.00 H ATOM 537 HD3 PRO A 48 -16.788 -1.391 8.558 1.00 0.00 H ATOM 538 HD2 PRO A 48 -17.891 -1.250 9.947 1.00 0.00 H ATOM 539 HG3 PRO A 48 -17.133 -3.430 10.422 1.00 0.00 H ATOM 540 HG2 PRO A 48 -15.627 -3.206 9.501 1.00 0.00 H ATOM 541 HB2 PRO A 48 -14.737 -3.098 11.697 1.00 0.00 H ATOM 542 HB3 PRO A 48 -16.235 -2.423 12.380 1.00 0.00 H ATOM 543 N GLY A 49 -13.444 -1.131 9.429 1.00 0.52 N ATOM 544 CA GLY A 49 -12.068 -1.183 8.854 1.00 0.50 C ATOM 545 C GLY A 49 -11.916 -2.442 7.997 1.00 0.41 C ATOM 546 O GLY A 49 -12.171 -3.543 8.442 1.00 0.63 O ATOM 547 HA3 GLY A 49 -11.337 -1.204 9.663 1.00 0.00 H ATOM 548 HA2 GLY A 49 -11.899 -0.301 8.236 1.00 0.00 H ATOM 549 H GLY A 49 -14.272 -1.164 8.801 1.00 0.00 H ATOM 550 N VAL A 50 -11.505 -2.287 6.767 1.00 0.52 N ATOM 551 CA VAL A 50 -11.341 -3.485 5.880 1.00 0.41 C ATOM 552 C VAL A 50 -10.355 -4.459 6.515 1.00 0.40 C ATOM 553 O VAL A 50 -9.761 -4.171 7.532 1.00 0.92 O ATOM 554 CB VAL A 50 -10.813 -3.088 4.495 1.00 0.46 C ATOM 555 CG1 VAL A 50 -11.983 -2.720 3.592 1.00 0.44 C ATOM 556 CG2 VAL A 50 -9.864 -1.895 4.606 1.00 0.77 C ATOM 557 HA VAL A 50 -12.320 -3.950 5.763 1.00 0.00 H ATOM 558 HB VAL A 50 -10.269 -3.933 4.072 1.00 0.00 H ATOM 559 HG11 VAL A 50 -12.649 -3.577 3.496 1.00 0.00 H ATOM 560 HG12 VAL A 50 -12.527 -1.882 4.028 1.00 0.00 H ATOM 561 HG13 VAL A 50 -11.607 -2.438 2.609 1.00 0.00 H ATOM 562 HG21 VAL A 50 -10.396 -1.048 5.039 1.00 0.00 H ATOM 563 HG22 VAL A 50 -9.021 -2.161 5.244 1.00 0.00 H ATOM 564 HG23 VAL A 50 -9.500 -1.628 3.614 1.00 0.00 H ATOM 565 H VAL A 50 -11.292 -1.336 6.404 1.00 0.00 H ATOM 566 N SER A 51 -10.179 -5.610 5.915 1.00 0.55 N ATOM 567 CA SER A 51 -9.230 -6.616 6.474 1.00 0.43 C ATOM 568 C SER A 51 -8.975 -7.714 5.438 1.00 0.37 C ATOM 569 O SER A 51 -9.707 -8.680 5.351 1.00 0.50 O ATOM 570 CB SER A 51 -9.829 -7.236 7.737 1.00 0.46 C ATOM 571 OG SER A 51 -11.146 -7.693 7.456 1.00 0.64 O ATOM 572 HA SER A 51 -8.288 -6.126 6.721 1.00 0.00 H ATOM 573 HB2 SER A 51 -9.864 -6.488 8.529 1.00 0.00 H ATOM 574 HB3 SER A 51 -9.213 -8.075 8.059 1.00 0.00 H ATOM 575 HG SER A 51 -11.112 -8.372 6.736 1.00 0.00 H ATOM 576 H SER A 51 -10.704 -5.824 5.043 1.00 0.00 H ATOM 577 N TYR A 52 -7.939 -7.575 4.654 1.00 0.38 N ATOM 578 CA TYR A 52 -7.637 -8.615 3.628 1.00 0.36 C ATOM 579 C TYR A 52 -6.569 -9.565 4.172 1.00 0.33 C ATOM 580 O TYR A 52 -6.281 -9.575 5.353 1.00 0.33 O ATOM 581 CB TYR A 52 -7.116 -7.951 2.353 1.00 0.47 C ATOM 582 CG TYR A 52 -7.830 -6.641 2.128 1.00 0.47 C ATOM 583 CD1 TYR A 52 -9.160 -6.632 1.692 1.00 1.05 C ATOM 584 CD2 TYR A 52 -7.158 -5.433 2.351 1.00 1.53 C ATOM 585 CE1 TYR A 52 -9.818 -5.415 1.478 1.00 1.13 C ATOM 586 CE2 TYR A 52 -7.815 -4.217 2.137 1.00 1.79 C ATOM 587 CZ TYR A 52 -9.145 -4.207 1.701 1.00 1.11 C ATOM 588 OH TYR A 52 -9.793 -3.008 1.488 1.00 1.50 O ATOM 589 HA TYR A 52 -8.547 -9.170 3.400 1.00 0.00 H ATOM 590 HB3 TYR A 52 -7.293 -8.610 1.503 1.00 0.00 H ATOM 591 HB2 TYR A 52 -6.046 -7.768 2.452 1.00 0.00 H ATOM 592 HD2 TYR A 52 -6.123 -5.440 2.691 1.00 0.00 H ATOM 593 HE2 TYR A 52 -7.291 -3.277 2.310 1.00 0.00 H ATOM 594 HE1 TYR A 52 -10.854 -5.407 1.138 1.00 0.00 H ATOM 595 HD1 TYR A 52 -9.683 -7.572 1.519 1.00 0.00 H ATOM 596 HH TYR A 52 -9.310 -2.492 0.795 1.00 0.00 H ATOM 597 H TYR A 52 -7.326 -6.740 4.745 1.00 0.00 H ATOM 598 N LEU A 53 -5.973 -10.365 3.326 1.00 0.36 N ATOM 599 CA LEU A 53 -4.927 -11.304 3.819 1.00 0.39 C ATOM 600 C LEU A 53 -3.709 -11.247 2.899 1.00 0.41 C ATOM 601 O LEU A 53 -3.684 -11.850 1.844 1.00 0.46 O ATOM 602 CB LEU A 53 -5.483 -12.730 3.848 1.00 0.45 C ATOM 603 CG LEU A 53 -5.986 -13.054 5.255 1.00 0.57 C ATOM 604 CD1 LEU A 53 -7.440 -12.601 5.396 1.00 0.78 C ATOM 605 CD2 LEU A 53 -5.898 -14.563 5.491 1.00 0.89 C ATOM 606 HA LEU A 53 -4.632 -11.013 4.827 1.00 0.00 H ATOM 607 HB2 LEU A 53 -6.307 -12.813 3.139 1.00 0.00 H ATOM 608 HB3 LEU A 53 -4.696 -13.432 3.573 1.00 0.00 H ATOM 609 HG LEU A 53 -5.371 -12.533 5.989 1.00 0.00 H ATOM 610 HD21 LEU A 53 -6.513 -15.081 4.755 1.00 0.00 H ATOM 611 HD22 LEU A 53 -4.862 -14.885 5.391 1.00 0.00 H ATOM 612 HD23 LEU A 53 -6.257 -14.794 6.494 1.00 0.00 H ATOM 613 HD11 LEU A 53 -7.502 -11.526 5.227 1.00 0.00 H ATOM 614 HD12 LEU A 53 -8.054 -13.122 4.662 1.00 0.00 H ATOM 615 HD13 LEU A 53 -7.796 -12.833 6.400 1.00 0.00 H ATOM 616 H LEU A 53 -6.227 -10.346 2.318 1.00 0.00 H ATOM 617 N VAL A 54 -2.697 -10.530 3.295 1.00 0.41 N ATOM 618 CA VAL A 54 -1.473 -10.433 2.454 1.00 0.45 C ATOM 619 C VAL A 54 -0.289 -10.977 3.253 1.00 0.43 C ATOM 620 O VAL A 54 -0.071 -10.602 4.388 1.00 0.47 O ATOM 621 CB VAL A 54 -1.226 -8.967 2.062 1.00 0.47 C ATOM 622 CG1 VAL A 54 -2.219 -8.060 2.791 1.00 0.48 C ATOM 623 CG2 VAL A 54 0.199 -8.553 2.439 1.00 0.65 C ATOM 624 HA VAL A 54 -1.597 -11.016 1.542 1.00 0.00 H ATOM 625 HB VAL A 54 -1.359 -8.868 0.985 1.00 0.00 H ATOM 626 HG11 VAL A 54 -3.236 -8.341 2.515 1.00 0.00 H ATOM 627 HG12 VAL A 54 -2.089 -8.172 3.867 1.00 0.00 H ATOM 628 HG13 VAL A 54 -2.037 -7.023 2.508 1.00 0.00 H ATOM 629 HG21 VAL A 54 0.336 -8.664 3.515 1.00 0.00 H ATOM 630 HG22 VAL A 54 0.912 -9.189 1.914 1.00 0.00 H ATOM 631 HG23 VAL A 54 0.361 -7.513 2.156 1.00 0.00 H ATOM 632 H VAL A 54 -2.744 -10.023 4.202 1.00 0.00 H ATOM 633 N ARG A 55 0.477 -11.866 2.679 1.00 0.59 N ATOM 634 CA ARG A 55 1.635 -12.425 3.430 1.00 0.57 C ATOM 635 C ARG A 55 2.836 -11.485 3.309 1.00 0.53 C ATOM 636 O ARG A 55 3.173 -11.010 2.243 1.00 0.55 O ATOM 637 CB ARG A 55 1.979 -13.821 2.894 1.00 0.65 C ATOM 638 CG ARG A 55 3.308 -13.789 2.134 1.00 1.31 C ATOM 639 CD ARG A 55 3.566 -15.163 1.515 1.00 1.40 C ATOM 640 NE ARG A 55 2.820 -15.274 0.231 1.00 2.09 N ATOM 641 CZ ARG A 55 2.755 -16.420 -0.390 1.00 2.24 C ATOM 642 NH1 ARG A 55 3.794 -17.210 -0.411 1.00 2.57 N ATOM 643 NH2 ARG A 55 1.652 -16.777 -0.988 1.00 2.64 N ATOM 644 HA ARG A 55 1.373 -12.515 4.484 1.00 0.00 H ATOM 645 HB2 ARG A 55 2.059 -14.517 3.729 1.00 0.00 H ATOM 646 HB3 ARG A 55 1.188 -14.153 2.221 1.00 0.00 H ATOM 647 HG2 ARG A 55 3.260 -13.037 1.346 1.00 0.00 H ATOM 648 HG3 ARG A 55 4.116 -13.541 2.822 1.00 0.00 H ATOM 649 HD2 ARG A 55 3.229 -15.940 2.201 1.00 0.00 H ATOM 650 HD3 ARG A 55 4.633 -15.283 1.328 1.00 0.00 H ATOM 651 HE ARG A 55 2.350 -14.438 -0.171 1.00 0.00 H ATOM 652 HH12 ARG A 55 3.743 -18.123 -0.906 1.00 0.00 H ATOM 653 HH11 ARG A 55 4.673 -16.926 0.067 1.00 0.00 H ATOM 654 HH22 ARG A 55 1.601 -17.690 -1.483 1.00 0.00 H ATOM 655 HH21 ARG A 55 0.824 -16.148 -0.970 1.00 0.00 H ATOM 656 H ARG A 55 0.280 -12.180 1.707 1.00 0.00 H ATOM 657 N TYR A 56 3.477 -11.214 4.411 1.00 0.56 N ATOM 658 CA TYR A 56 4.656 -10.306 4.406 1.00 0.54 C ATOM 659 C TYR A 56 5.877 -11.052 3.864 1.00 0.50 C ATOM 660 O TYR A 56 5.969 -12.260 3.957 1.00 0.55 O ATOM 661 CB TYR A 56 4.923 -9.845 5.841 1.00 0.60 C ATOM 662 CG TYR A 56 5.868 -8.670 5.842 1.00 0.97 C ATOM 663 CD1 TYR A 56 5.641 -7.581 4.993 1.00 1.84 C ATOM 664 CD2 TYR A 56 6.972 -8.669 6.701 1.00 1.80 C ATOM 665 CE1 TYR A 56 6.518 -6.491 5.004 1.00 2.55 C ATOM 666 CE2 TYR A 56 7.848 -7.581 6.711 1.00 2.60 C ATOM 667 CZ TYR A 56 7.621 -6.492 5.863 1.00 2.75 C ATOM 668 OH TYR A 56 8.484 -5.418 5.875 1.00 3.67 O ATOM 669 HA TYR A 56 4.461 -9.443 3.770 1.00 0.00 H ATOM 670 HB3 TYR A 56 5.366 -10.665 6.406 1.00 0.00 H ATOM 671 HB2 TYR A 56 3.982 -9.551 6.306 1.00 0.00 H ATOM 672 HD2 TYR A 56 7.149 -9.517 7.362 1.00 0.00 H ATOM 673 HE2 TYR A 56 8.709 -7.581 7.380 1.00 0.00 H ATOM 674 HE1 TYR A 56 6.342 -5.642 4.344 1.00 0.00 H ATOM 675 HD1 TYR A 56 4.781 -7.582 4.323 1.00 0.00 H ATOM 676 HH TYR A 56 8.499 -5.018 6.780 1.00 0.00 H ATOM 677 H TYR A 56 3.160 -11.638 5.306 1.00 0.00 H ATOM 678 N MET A 57 6.815 -10.340 3.296 1.00 0.48 N ATOM 679 CA MET A 57 8.030 -11.005 2.745 1.00 0.49 C ATOM 680 C MET A 57 9.285 -10.284 3.242 1.00 0.60 C ATOM 681 O MET A 57 10.035 -9.720 2.469 1.00 1.15 O ATOM 682 CB MET A 57 7.986 -10.956 1.217 1.00 0.63 C ATOM 683 CG MET A 57 8.683 -12.192 0.645 1.00 0.69 C ATOM 684 SD MET A 57 7.891 -12.664 -0.913 1.00 1.24 S ATOM 685 CE MET A 57 8.903 -11.636 -2.006 1.00 0.79 C ATOM 686 HA MET A 57 8.056 -12.043 3.078 1.00 0.00 H ATOM 687 HB2 MET A 57 6.948 -10.937 0.884 1.00 0.00 H ATOM 688 HB3 MET A 57 8.495 -10.058 0.867 1.00 0.00 H ATOM 689 HG2 MET A 57 8.606 -13.015 1.356 1.00 0.00 H ATOM 690 HG3 MET A 57 9.734 -11.966 0.465 1.00 0.00 H ATOM 691 HE1 MET A 57 8.789 -10.589 -1.726 1.00 0.00 H ATOM 692 HE2 MET A 57 9.949 -11.927 -1.911 1.00 0.00 H ATOM 693 HE3 MET A 57 8.578 -11.775 -3.037 1.00 0.00 H ATOM 694 H MET A 57 6.713 -9.307 3.228 1.00 0.00 H ATOM 695 N GLY A 58 9.521 -10.298 4.524 1.00 0.72 N ATOM 696 CA GLY A 58 10.730 -9.616 5.069 1.00 0.89 C ATOM 697 C GLY A 58 10.617 -8.106 4.851 1.00 0.83 C ATOM 698 O GLY A 58 9.619 -7.611 4.367 1.00 1.13 O ATOM 699 HA3 GLY A 58 11.618 -9.990 4.559 1.00 0.00 H ATOM 700 HA2 GLY A 58 10.812 -9.823 6.136 1.00 0.00 H ATOM 701 H GLY A 58 8.865 -10.785 5.167 1.00 0.00 H ATOM 702 N CYS A 59 11.636 -7.371 5.208 1.00 0.53 N ATOM 703 CA CYS A 59 11.590 -5.890 5.025 1.00 0.50 C ATOM 704 C CYS A 59 12.948 -5.392 4.535 1.00 0.51 C ATOM 705 O CYS A 59 13.979 -5.778 5.048 1.00 0.53 O ATOM 706 CB CYS A 59 11.270 -5.220 6.362 1.00 0.52 C ATOM 707 SG CYS A 59 10.737 -6.471 7.555 1.00 1.35 S ATOM 708 HA CYS A 59 10.821 -5.643 4.293 1.00 0.00 H ATOM 709 HB2 CYS A 59 10.473 -4.490 6.221 1.00 0.00 H ATOM 710 HB3 CYS A 59 12.160 -4.716 6.738 1.00 0.00 H ATOM 711 HG CYS A 59 9.609 -7.108 7.079 1.00 0.00 H ATOM 712 H CYS A 59 12.480 -7.818 5.620 1.00 0.00 H ATOM 713 N VAL A 60 12.959 -4.534 3.553 1.00 0.53 N ATOM 714 CA VAL A 60 14.255 -4.011 3.040 1.00 0.55 C ATOM 715 C VAL A 60 14.459 -2.591 3.567 1.00 0.52 C ATOM 716 O VAL A 60 13.554 -1.786 3.560 1.00 0.61 O ATOM 717 CB VAL A 60 14.228 -3.992 1.509 1.00 0.58 C ATOM 718 CG1 VAL A 60 13.798 -5.365 0.988 1.00 0.62 C ATOM 719 CG2 VAL A 60 13.232 -2.935 1.028 1.00 0.53 C ATOM 720 HA VAL A 60 15.072 -4.650 3.376 1.00 0.00 H ATOM 721 HB VAL A 60 15.223 -3.754 1.134 1.00 0.00 H ATOM 722 HG11 VAL A 60 14.506 -6.120 1.330 1.00 0.00 H ATOM 723 HG12 VAL A 60 12.803 -5.600 1.366 1.00 0.00 H ATOM 724 HG13 VAL A 60 13.779 -5.349 -0.102 1.00 0.00 H ATOM 725 HG21 VAL A 60 12.238 -3.175 1.406 1.00 0.00 H ATOM 726 HG22 VAL A 60 13.536 -1.956 1.398 1.00 0.00 H ATOM 727 HG23 VAL A 60 13.215 -2.923 -0.062 1.00 0.00 H ATOM 728 H VAL A 60 12.064 -4.216 3.129 1.00 0.00 H ATOM 729 N GLU A 61 15.637 -2.273 4.027 1.00 0.58 N ATOM 730 CA GLU A 61 15.876 -0.899 4.551 1.00 0.58 C ATOM 731 C GLU A 61 16.598 -0.073 3.501 1.00 0.55 C ATOM 732 O GLU A 61 17.298 -0.593 2.655 1.00 0.65 O ATOM 733 CB GLU A 61 16.719 -0.968 5.826 1.00 0.62 C ATOM 734 CG GLU A 61 16.036 -1.885 6.842 1.00 0.76 C ATOM 735 CD GLU A 61 16.477 -1.499 8.255 1.00 1.26 C ATOM 736 OE1 GLU A 61 17.668 -1.327 8.455 1.00 1.88 O ATOM 737 OE2 GLU A 61 15.617 -1.382 9.112 1.00 1.84 O ATOM 738 HA GLU A 61 14.919 -0.431 4.783 1.00 0.00 H ATOM 739 HB2 GLU A 61 17.707 -1.362 5.587 1.00 0.00 H ATOM 740 HB3 GLU A 61 16.820 0.031 6.249 1.00 0.00 H ATOM 741 HG2 GLU A 61 14.954 -1.780 6.757 1.00 0.00 H ATOM 742 HG3 GLU A 61 16.316 -2.920 6.644 1.00 0.00 H ATOM 743 H GLU A 61 16.405 -2.974 4.028 1.00 0.00 H ATOM 744 N VAL A 62 16.423 1.215 3.544 1.00 0.52 N ATOM 745 CA VAL A 62 17.088 2.079 2.542 1.00 0.51 C ATOM 746 C VAL A 62 18.017 3.075 3.219 1.00 0.52 C ATOM 747 O VAL A 62 18.043 3.211 4.426 1.00 0.60 O ATOM 748 CB VAL A 62 16.031 2.858 1.776 1.00 0.58 C ATOM 749 CG1 VAL A 62 16.542 3.129 0.372 1.00 0.88 C ATOM 750 CG2 VAL A 62 14.742 2.045 1.702 1.00 1.01 C ATOM 751 HA VAL A 62 17.668 1.445 1.871 1.00 0.00 H ATOM 752 HB VAL A 62 15.828 3.800 2.286 1.00 0.00 H ATOM 753 HG11 VAL A 62 17.462 3.711 0.428 1.00 0.00 H ATOM 754 HG12 VAL A 62 16.739 2.182 -0.130 1.00 0.00 H ATOM 755 HG13 VAL A 62 15.790 3.688 -0.185 1.00 0.00 H ATOM 756 HG21 VAL A 62 14.937 1.103 1.190 1.00 0.00 H ATOM 757 HG22 VAL A 62 14.382 1.844 2.711 1.00 0.00 H ATOM 758 HG23 VAL A 62 13.989 2.609 1.152 1.00 0.00 H ATOM 759 H VAL A 62 15.819 1.636 4.278 1.00 0.00 H ATOM 760 N LEU A 63 18.774 3.783 2.431 1.00 0.51 N ATOM 761 CA LEU A 63 19.703 4.790 2.991 1.00 0.56 C ATOM 762 C LEU A 63 19.698 6.022 2.084 1.00 0.58 C ATOM 763 O LEU A 63 20.672 6.742 1.993 1.00 0.62 O ATOM 764 CB LEU A 63 21.116 4.209 3.063 1.00 0.65 C ATOM 765 CG LEU A 63 21.300 3.472 4.391 1.00 0.79 C ATOM 766 CD1 LEU A 63 22.371 2.392 4.230 1.00 1.09 C ATOM 767 CD2 LEU A 63 21.738 4.467 5.468 1.00 1.13 C ATOM 768 HA LEU A 63 19.384 5.067 3.996 1.00 0.00 H ATOM 769 HB2 LEU A 63 21.265 3.513 2.238 1.00 0.00 H ATOM 770 HB3 LEU A 63 21.845 5.016 2.992 1.00 0.00 H ATOM 771 HG LEU A 63 20.358 3.009 4.684 1.00 0.00 H ATOM 772 HD21 LEU A 63 22.681 4.928 5.173 1.00 0.00 H ATOM 773 HD22 LEU A 63 20.975 5.237 5.581 1.00 0.00 H ATOM 774 HD23 LEU A 63 21.869 3.942 6.414 1.00 0.00 H ATOM 775 HD11 LEU A 63 22.059 1.685 3.461 1.00 0.00 H ATOM 776 HD12 LEU A 63 23.313 2.857 3.938 1.00 0.00 H ATOM 777 HD13 LEU A 63 22.501 1.867 5.177 1.00 0.00 H ATOM 778 H LEU A 63 18.726 3.640 1.402 1.00 0.00 H ATOM 779 N GLN A 64 18.605 6.269 1.408 1.00 0.64 N ATOM 780 CA GLN A 64 18.544 7.454 0.507 1.00 0.71 C ATOM 781 C GLN A 64 17.734 8.567 1.177 1.00 0.71 C ATOM 782 O GLN A 64 17.192 8.394 2.251 1.00 0.75 O ATOM 783 CB GLN A 64 17.874 7.056 -0.810 1.00 0.76 C ATOM 784 CG GLN A 64 16.360 6.974 -0.610 1.00 1.44 C ATOM 785 CD GLN A 64 15.746 6.106 -1.710 1.00 2.26 C ATOM 786 OE1 GLN A 64 16.183 4.995 -1.939 1.00 2.74 O ATOM 787 NE2 GLN A 64 14.744 6.568 -2.407 1.00 3.01 N ATOM 788 HA GLN A 64 19.554 7.812 0.309 1.00 0.00 H ATOM 789 HB2 GLN A 64 18.100 7.802 -1.572 1.00 0.00 H ATOM 790 HB3 GLN A 64 18.251 6.085 -1.130 1.00 0.00 H ATOM 791 HG2 GLN A 64 16.145 6.533 0.363 1.00 0.00 H ATOM 792 HG3 GLN A 64 15.932 7.976 -0.656 1.00 0.00 H ATOM 793 HE22 GLN A 64 14.369 7.518 -2.212 1.00 0.00 H ATOM 794 HE21 GLN A 64 14.320 5.986 -3.157 1.00 0.00 H ATOM 795 H GLN A 64 17.782 5.640 1.499 1.00 0.00 H ATOM 796 N SER A 65 17.648 9.709 0.551 1.00 0.76 N ATOM 797 CA SER A 65 16.874 10.833 1.150 1.00 0.81 C ATOM 798 C SER A 65 15.403 10.430 1.269 1.00 0.80 C ATOM 799 O SER A 65 15.038 9.298 1.024 1.00 0.99 O ATOM 800 CB SER A 65 16.994 12.068 0.255 1.00 0.92 C ATOM 801 OG SER A 65 17.494 13.157 1.021 1.00 1.22 O ATOM 802 HA SER A 65 17.270 11.062 2.139 1.00 0.00 H ATOM 803 HB2 SER A 65 16.013 12.324 -0.146 1.00 0.00 H ATOM 804 HB3 SER A 65 17.677 11.857 -0.568 1.00 0.00 H ATOM 805 HG SER A 65 17.572 13.957 0.443 1.00 0.00 H ATOM 806 H SER A 65 18.120 9.835 -0.367 1.00 0.00 H ATOM 807 N MET A 66 14.554 11.349 1.642 1.00 0.97 N ATOM 808 CA MET A 66 13.107 11.016 1.775 1.00 1.07 C ATOM 809 C MET A 66 12.273 12.084 1.065 1.00 0.95 C ATOM 810 O MET A 66 12.799 13.041 0.533 1.00 1.47 O ATOM 811 CB MET A 66 12.728 10.970 3.257 1.00 1.49 C ATOM 812 CG MET A 66 11.806 9.776 3.515 1.00 2.27 C ATOM 813 SD MET A 66 12.532 8.281 2.801 1.00 2.79 S ATOM 814 CE MET A 66 11.125 7.824 1.758 1.00 2.71 C ATOM 815 HA MET A 66 12.913 10.044 1.322 1.00 0.00 H ATOM 816 HB2 MET A 66 13.631 10.868 3.859 1.00 0.00 H ATOM 817 HB3 MET A 66 12.213 11.892 3.529 1.00 0.00 H ATOM 818 HG2 MET A 66 10.835 9.962 3.057 1.00 0.00 H ATOM 819 HG3 MET A 66 11.680 9.641 4.589 1.00 0.00 H ATOM 820 HE1 MET A 66 10.248 7.662 2.384 1.00 0.00 H ATOM 821 HE2 MET A 66 10.924 8.627 1.049 1.00 0.00 H ATOM 822 HE3 MET A 66 11.359 6.909 1.214 1.00 0.00 H ATOM 823 H MET A 66 14.887 12.313 1.846 1.00 0.00 H ATOM 824 N ARG A 67 10.977 11.928 1.051 1.00 0.90 N ATOM 825 CA ARG A 67 10.113 12.935 0.372 1.00 1.04 C ATOM 826 C ARG A 67 10.583 13.099 -1.075 1.00 1.04 C ATOM 827 O ARG A 67 10.948 14.177 -1.503 1.00 1.39 O ATOM 828 CB ARG A 67 10.217 14.275 1.105 1.00 1.21 C ATOM 829 CG ARG A 67 9.345 14.241 2.363 1.00 1.24 C ATOM 830 CD ARG A 67 10.239 14.178 3.602 1.00 1.84 C ATOM 831 NE ARG A 67 9.417 14.426 4.819 1.00 2.71 N ATOM 832 CZ ARG A 67 9.958 14.973 5.872 1.00 3.34 C ATOM 833 NH1 ARG A 67 10.327 16.224 5.839 1.00 3.95 N ATOM 834 NH2 ARG A 67 10.129 14.269 6.957 1.00 3.77 N ATOM 835 HA ARG A 67 9.075 12.602 0.384 1.00 0.00 H ATOM 836 HB2 ARG A 67 11.254 14.455 1.387 1.00 0.00 H ATOM 837 HB3 ARG A 67 9.876 15.075 0.448 1.00 0.00 H ATOM 838 HG2 ARG A 67 8.730 15.140 2.404 1.00 0.00 H ATOM 839 HG3 ARG A 67 8.700 13.363 2.335 1.00 0.00 H ATOM 840 HD2 ARG A 67 11.018 14.937 3.528 1.00 0.00 H ATOM 841 HD3 ARG A 67 10.700 13.192 3.669 1.00 0.00 H ATOM 842 HE ARG A 67 8.411 14.163 4.829 1.00 0.00 H ATOM 843 HH12 ARG A 67 10.759 16.661 6.678 1.00 0.00 H ATOM 844 HH11 ARG A 67 10.190 16.784 4.973 1.00 0.00 H ATOM 845 HH22 ARG A 67 10.560 14.705 7.797 1.00 0.00 H ATOM 846 HH21 ARG A 67 9.834 13.272 6.982 1.00 0.00 H ATOM 847 H ARG A 67 10.548 11.101 1.513 1.00 0.00 H ATOM 848 N ALA A 68 10.578 12.035 -1.832 1.00 0.87 N ATOM 849 CA ALA A 68 11.022 12.116 -3.247 1.00 0.88 C ATOM 850 C ALA A 68 10.152 11.189 -4.091 1.00 0.78 C ATOM 851 O ALA A 68 9.625 10.209 -3.602 1.00 0.82 O ATOM 852 CB ALA A 68 12.481 11.670 -3.345 1.00 1.00 C ATOM 853 HA ALA A 68 10.930 13.141 -3.607 1.00 0.00 H ATOM 854 HB1 ALA A 68 13.101 12.322 -2.729 1.00 0.00 H ATOM 855 HB2 ALA A 68 12.570 10.643 -2.992 1.00 0.00 H ATOM 856 HB3 ALA A 68 12.809 11.729 -4.383 1.00 0.00 H ATOM 857 H ALA A 68 10.261 11.125 -1.441 1.00 0.00 H ATOM 858 N LEU A 69 9.995 11.483 -5.351 1.00 0.84 N ATOM 859 CA LEU A 69 9.156 10.606 -6.211 1.00 0.88 C ATOM 860 C LEU A 69 10.025 10.006 -7.321 1.00 0.84 C ATOM 861 O LEU A 69 10.354 8.840 -7.291 1.00 1.65 O ATOM 862 CB LEU A 69 8.010 11.436 -6.812 1.00 1.11 C ATOM 863 CG LEU A 69 7.108 10.566 -7.702 1.00 1.23 C ATOM 864 CD1 LEU A 69 7.694 10.499 -9.112 1.00 1.92 C ATOM 865 CD2 LEU A 69 7.000 9.151 -7.127 1.00 1.32 C ATOM 866 HA LEU A 69 8.732 9.794 -5.620 1.00 0.00 H ATOM 867 HB2 LEU A 69 7.413 11.858 -6.004 1.00 0.00 H ATOM 868 HB3 LEU A 69 8.431 12.244 -7.411 1.00 0.00 H ATOM 869 HG LEU A 69 6.113 11.010 -7.737 1.00 0.00 H ATOM 870 HD21 LEU A 69 7.992 8.703 -7.079 1.00 0.00 H ATOM 871 HD22 LEU A 69 6.573 9.199 -6.125 1.00 0.00 H ATOM 872 HD23 LEU A 69 6.358 8.547 -7.769 1.00 0.00 H ATOM 873 HD11 LEU A 69 7.753 11.505 -9.528 1.00 0.00 H ATOM 874 HD12 LEU A 69 8.692 10.063 -9.069 1.00 0.00 H ATOM 875 HD13 LEU A 69 7.053 9.882 -9.742 1.00 0.00 H ATOM 876 H LEU A 69 10.454 12.326 -5.753 1.00 0.00 H ATOM 877 N ASP A 70 10.403 10.796 -8.294 1.00 0.93 N ATOM 878 CA ASP A 70 11.255 10.278 -9.411 1.00 0.80 C ATOM 879 C ASP A 70 10.539 9.127 -10.125 1.00 0.82 C ATOM 880 O ASP A 70 10.399 8.041 -9.601 1.00 0.85 O ATOM 881 CB ASP A 70 12.589 9.774 -8.866 1.00 0.78 C ATOM 882 CG ASP A 70 12.946 10.525 -7.581 1.00 1.22 C ATOM 883 OD1 ASP A 70 13.505 11.604 -7.685 1.00 1.71 O ATOM 884 OD2 ASP A 70 12.654 10.007 -6.516 1.00 1.85 O ATOM 885 HA ASP A 70 11.435 11.091 -10.115 1.00 0.00 H ATOM 886 HB2 ASP A 70 12.512 8.708 -8.652 1.00 0.00 H ATOM 887 HB3 ASP A 70 13.369 9.939 -9.610 1.00 0.00 H ATOM 888 H ASP A 70 10.109 11.793 -8.291 1.00 0.00 H ATOM 889 N PHE A 71 10.088 9.362 -11.321 1.00 0.87 N ATOM 890 CA PHE A 71 9.378 8.292 -12.080 1.00 0.95 C ATOM 891 C PHE A 71 10.374 7.232 -12.557 1.00 0.86 C ATOM 892 O PHE A 71 10.026 6.083 -12.743 1.00 0.93 O ATOM 893 CB PHE A 71 8.681 8.911 -13.294 1.00 1.08 C ATOM 894 CG PHE A 71 7.318 8.286 -13.465 1.00 1.63 C ATOM 895 CD1 PHE A 71 7.194 7.031 -14.074 1.00 2.14 C ATOM 896 CD2 PHE A 71 6.177 8.960 -13.014 1.00 2.57 C ATOM 897 CE1 PHE A 71 5.930 6.451 -14.233 1.00 3.00 C ATOM 898 CE2 PHE A 71 4.913 8.380 -13.172 1.00 3.37 C ATOM 899 CZ PHE A 71 4.789 7.126 -13.781 1.00 3.44 C ATOM 900 HA PHE A 71 8.643 7.822 -11.427 1.00 0.00 H ATOM 901 HB2 PHE A 71 8.572 9.985 -13.142 1.00 0.00 H ATOM 902 HB3 PHE A 71 9.279 8.730 -14.188 1.00 0.00 H ATOM 903 HD2 PHE A 71 6.273 9.937 -12.540 1.00 0.00 H ATOM 904 HE2 PHE A 71 4.025 8.905 -12.821 1.00 0.00 H ATOM 905 HZ PHE A 71 3.804 6.675 -13.904 1.00 0.00 H ATOM 906 HE1 PHE A 71 5.834 5.475 -14.708 1.00 0.00 H ATOM 907 HD1 PHE A 71 8.082 6.506 -14.424 1.00 0.00 H ATOM 908 H PHE A 71 10.223 10.300 -11.750 1.00 0.00 H ATOM 909 N ASN A 72 11.608 7.602 -12.762 1.00 0.76 N ATOM 910 CA ASN A 72 12.612 6.605 -13.232 1.00 0.73 C ATOM 911 C ASN A 72 13.459 6.120 -12.053 1.00 0.67 C ATOM 912 O ASN A 72 13.795 4.956 -11.955 1.00 0.68 O ATOM 913 CB ASN A 72 13.522 7.253 -14.277 1.00 0.72 C ATOM 914 CG ASN A 72 13.155 6.730 -15.667 1.00 1.02 C ATOM 915 OD1 ASN A 72 12.066 6.231 -15.872 1.00 1.92 O ATOM 916 ND2 ASN A 72 14.022 6.825 -16.637 1.00 1.25 N ATOM 917 HA ASN A 72 12.091 5.755 -13.673 1.00 0.00 H ATOM 918 HB2 ASN A 72 13.394 8.335 -14.250 1.00 0.00 H ATOM 919 HB3 ASN A 72 14.561 7.006 -14.058 1.00 0.00 H ATOM 920 HD22 ASN A 72 14.954 7.252 -16.462 1.00 0.00 H ATOM 921 HD21 ASN A 72 13.781 6.474 -17.586 1.00 0.00 H ATOM 922 H ASN A 72 11.891 8.589 -12.598 1.00 0.00 H ATOM 923 N THR A 73 13.811 7.002 -11.160 1.00 0.67 N ATOM 924 CA THR A 73 14.640 6.588 -9.993 1.00 0.69 C ATOM 925 C THR A 73 13.812 5.714 -9.047 1.00 0.70 C ATOM 926 O THR A 73 14.340 4.871 -8.349 1.00 0.75 O ATOM 927 CB THR A 73 15.123 7.833 -9.246 1.00 0.70 C ATOM 928 OG1 THR A 73 15.270 8.907 -10.165 1.00 0.83 O ATOM 929 CG2 THR A 73 16.469 7.541 -8.581 1.00 0.65 C ATOM 930 HA THR A 73 15.498 6.016 -10.347 1.00 0.00 H ATOM 931 HB THR A 73 14.394 8.105 -8.482 1.00 0.00 H ATOM 932 HG1 THR A 73 15.583 9.713 -9.682 1.00 0.00 H ATOM 933 HG23 THR A 73 16.354 6.717 -7.877 1.00 0.00 H ATOM 934 HG21 THR A 73 17.198 7.269 -9.344 1.00 0.00 H ATOM 935 HG22 THR A 73 16.811 8.429 -8.050 1.00 0.00 H ATOM 936 H THR A 73 13.514 7.993 -11.262 1.00 0.00 H ATOM 937 N ARG A 74 12.521 5.905 -9.013 1.00 0.71 N ATOM 938 CA ARG A 74 11.676 5.079 -8.104 1.00 0.76 C ATOM 939 C ARG A 74 11.508 3.673 -8.680 1.00 0.72 C ATOM 940 O ARG A 74 11.390 2.710 -7.954 1.00 0.69 O ATOM 941 CB ARG A 74 10.298 5.724 -7.956 1.00 0.84 C ATOM 942 CG ARG A 74 9.347 4.739 -7.275 1.00 1.20 C ATOM 943 CD ARG A 74 8.485 5.483 -6.255 1.00 1.36 C ATOM 944 NE ARG A 74 7.383 4.593 -5.794 1.00 1.92 N ATOM 945 CZ ARG A 74 7.486 3.965 -4.654 1.00 2.41 C ATOM 946 NH1 ARG A 74 8.637 3.480 -4.278 1.00 2.88 N ATOM 947 NH2 ARG A 74 6.437 3.825 -3.890 1.00 3.05 N ATOM 948 HA ARG A 74 12.162 5.017 -7.130 1.00 0.00 H ATOM 949 HB2 ARG A 74 10.382 6.627 -7.351 1.00 0.00 H ATOM 950 HB3 ARG A 74 9.910 5.983 -8.941 1.00 0.00 H ATOM 951 HG2 ARG A 74 8.705 4.276 -8.025 1.00 0.00 H ATOM 952 HG3 ARG A 74 9.926 3.967 -6.768 1.00 0.00 H ATOM 953 HD2 ARG A 74 8.063 6.375 -6.717 1.00 0.00 H ATOM 954 HD3 ARG A 74 9.099 5.773 -5.402 1.00 0.00 H ATOM 955 HE ARG A 74 6.532 4.472 -6.380 1.00 0.00 H ATOM 956 HH12 ARG A 74 8.719 2.980 -3.370 1.00 0.00 H ATOM 957 HH11 ARG A 74 9.473 3.594 -4.886 1.00 0.00 H ATOM 958 HH22 ARG A 74 6.518 3.325 -2.982 1.00 0.00 H ATOM 959 HH21 ARG A 74 5.520 4.214 -4.189 1.00 0.00 H ATOM 960 H ARG A 74 12.084 6.630 -9.617 1.00 0.00 H ATOM 961 N THR A 75 11.491 3.545 -9.976 1.00 0.74 N ATOM 962 CA THR A 75 11.323 2.195 -10.585 1.00 0.74 C ATOM 963 C THR A 75 12.662 1.453 -10.603 1.00 0.69 C ATOM 964 O THR A 75 12.707 0.240 -10.589 1.00 0.65 O ATOM 965 CB THR A 75 10.806 2.345 -12.017 1.00 0.84 C ATOM 966 OG1 THR A 75 11.462 3.438 -12.644 1.00 0.91 O ATOM 967 CG2 THR A 75 9.298 2.598 -11.992 1.00 1.24 C ATOM 968 HA THR A 75 10.609 1.624 -9.992 1.00 0.00 H ATOM 969 HB THR A 75 11.010 1.431 -12.575 1.00 0.00 H ATOM 970 HG1 THR A 75 12.438 3.271 -12.660 1.00 0.00 H ATOM 971 HG23 THR A 75 8.798 1.758 -11.510 1.00 0.00 H ATOM 972 HG21 THR A 75 9.093 3.512 -11.435 1.00 0.00 H ATOM 973 HG22 THR A 75 8.932 2.704 -13.013 1.00 0.00 H ATOM 974 H THR A 75 11.594 4.382 -10.584 1.00 0.00 H ATOM 975 N GLN A 76 13.754 2.167 -10.637 1.00 0.71 N ATOM 976 CA GLN A 76 15.083 1.490 -10.660 1.00 0.71 C ATOM 977 C GLN A 76 15.453 1.000 -9.258 1.00 0.65 C ATOM 978 O GLN A 76 15.890 -0.120 -9.081 1.00 0.62 O ATOM 979 CB GLN A 76 16.147 2.475 -11.147 1.00 0.79 C ATOM 980 CG GLN A 76 15.945 2.754 -12.637 1.00 0.88 C ATOM 981 CD GLN A 76 16.582 4.098 -12.994 1.00 1.05 C ATOM 982 OE1 GLN A 76 16.807 4.925 -12.132 1.00 1.66 O ATOM 983 NE2 GLN A 76 16.884 4.354 -14.238 1.00 1.48 N ATOM 984 HA GLN A 76 15.032 0.635 -11.334 1.00 0.00 H ATOM 985 HB2 GLN A 76 16.062 3.407 -10.588 1.00 0.00 H ATOM 986 HB3 GLN A 76 17.137 2.047 -10.989 1.00 0.00 H ATOM 987 HG2 GLN A 76 16.413 1.963 -13.222 1.00 0.00 H ATOM 988 HG3 GLN A 76 14.878 2.786 -12.860 1.00 0.00 H ATOM 989 HE22 GLN A 76 16.692 3.647 -14.976 1.00 0.00 H ATOM 990 HE21 GLN A 76 17.317 5.265 -14.491 1.00 0.00 H ATOM 991 H GLN A 76 13.698 3.205 -10.648 1.00 0.00 H ATOM 992 N VAL A 77 15.290 1.824 -8.261 1.00 0.67 N ATOM 993 CA VAL A 77 15.644 1.393 -6.879 1.00 0.64 C ATOM 994 C VAL A 77 14.556 0.471 -6.321 1.00 0.59 C ATOM 995 O VAL A 77 14.840 -0.497 -5.641 1.00 0.56 O ATOM 996 CB VAL A 77 15.786 2.625 -5.981 1.00 0.68 C ATOM 997 CG1 VAL A 77 14.405 3.211 -5.683 1.00 0.71 C ATOM 998 CG2 VAL A 77 16.461 2.221 -4.668 1.00 0.63 C ATOM 999 HA VAL A 77 16.589 0.850 -6.905 1.00 0.00 H ATOM 1000 HB VAL A 77 16.392 3.374 -6.490 1.00 0.00 H ATOM 1001 HG11 VAL A 77 13.925 3.499 -6.618 1.00 0.00 H ATOM 1002 HG12 VAL A 77 13.796 2.463 -5.176 1.00 0.00 H ATOM 1003 HG13 VAL A 77 14.514 4.087 -5.044 1.00 0.00 H ATOM 1004 HG21 VAL A 77 15.852 1.470 -4.164 1.00 0.00 H ATOM 1005 HG22 VAL A 77 17.447 1.808 -4.880 1.00 0.00 H ATOM 1006 HG23 VAL A 77 16.562 3.098 -4.028 1.00 0.00 H ATOM 1007 H VAL A 77 14.914 2.779 -8.430 1.00 0.00 H ATOM 1008 N THR A 78 13.313 0.760 -6.597 1.00 0.60 N ATOM 1009 CA THR A 78 12.219 -0.105 -6.072 1.00 0.57 C ATOM 1010 C THR A 78 12.259 -1.468 -6.762 1.00 0.53 C ATOM 1011 O THR A 78 12.113 -2.490 -6.127 1.00 0.54 O ATOM 1012 CB THR A 78 10.863 0.556 -6.331 1.00 0.61 C ATOM 1013 OG1 THR A 78 10.830 1.829 -5.702 1.00 0.95 O ATOM 1014 CG2 THR A 78 9.749 -0.324 -5.763 1.00 1.01 C ATOM 1015 HA THR A 78 12.358 -0.238 -4.999 1.00 0.00 H ATOM 1016 HB THR A 78 10.717 0.677 -7.404 1.00 0.00 H ATOM 1017 HG1 THR A 78 11.551 2.397 -6.072 1.00 0.00 H ATOM 1018 HG23 THR A 78 9.776 -1.300 -6.247 1.00 0.00 H ATOM 1019 HG21 THR A 78 9.895 -0.445 -4.690 1.00 0.00 H ATOM 1020 HG22 THR A 78 8.784 0.148 -5.949 1.00 0.00 H ATOM 1021 H THR A 78 13.087 1.591 -7.181 1.00 0.00 H ATOM 1022 N ARG A 79 12.455 -1.499 -8.052 1.00 0.52 N ATOM 1023 CA ARG A 79 12.500 -2.811 -8.759 1.00 0.51 C ATOM 1024 C ARG A 79 13.822 -3.517 -8.450 1.00 0.50 C ATOM 1025 O ARG A 79 13.907 -4.727 -8.478 1.00 0.49 O ATOM 1026 CB ARG A 79 12.382 -2.591 -10.268 1.00 0.57 C ATOM 1027 CG ARG A 79 13.763 -2.277 -10.848 1.00 1.44 C ATOM 1028 CD ARG A 79 13.609 -1.736 -12.271 1.00 1.74 C ATOM 1029 NE ARG A 79 13.680 -2.864 -13.242 1.00 1.77 N ATOM 1030 CZ ARG A 79 12.781 -2.974 -14.182 1.00 2.11 C ATOM 1031 NH1 ARG A 79 11.646 -3.567 -13.933 1.00 2.47 N ATOM 1032 NH2 ARG A 79 13.017 -2.491 -15.371 1.00 2.74 N ATOM 1033 HA ARG A 79 11.669 -3.429 -8.418 1.00 0.00 H ATOM 1034 HB2 ARG A 79 11.987 -3.492 -10.737 1.00 0.00 H ATOM 1035 HB3 ARG A 79 11.708 -1.757 -10.462 1.00 0.00 H ATOM 1036 HG2 ARG A 79 14.257 -1.530 -10.227 1.00 0.00 H ATOM 1037 HG3 ARG A 79 14.364 -3.186 -10.868 1.00 0.00 H ATOM 1038 HD2 ARG A 79 14.410 -1.026 -12.479 1.00 0.00 H ATOM 1039 HD3 ARG A 79 12.646 -1.234 -12.367 1.00 0.00 H ATOM 1040 HE ARG A 79 14.446 -3.564 -13.171 1.00 0.00 H ATOM 1041 HH12 ARG A 79 10.930 -3.655 -14.682 1.00 0.00 H ATOM 1042 HH11 ARG A 79 11.457 -3.952 -12.986 1.00 0.00 H ATOM 1043 HH22 ARG A 79 12.300 -2.579 -16.120 1.00 0.00 H ATOM 1044 HH21 ARG A 79 13.922 -2.018 -15.570 1.00 0.00 H ATOM 1045 H ARG A 79 12.579 -0.614 -8.584 1.00 0.00 H ATOM 1046 N GLU A 80 14.854 -2.773 -8.156 1.00 0.52 N ATOM 1047 CA GLU A 80 16.164 -3.412 -7.846 1.00 0.55 C ATOM 1048 C GLU A 80 16.042 -4.224 -6.554 1.00 0.51 C ATOM 1049 O GLU A 80 16.236 -5.426 -6.542 1.00 0.52 O ATOM 1050 CB GLU A 80 17.231 -2.330 -7.668 1.00 0.62 C ATOM 1051 CG GLU A 80 18.533 -2.971 -7.180 1.00 1.22 C ATOM 1052 CD GLU A 80 18.965 -4.061 -8.162 1.00 1.49 C ATOM 1053 OE1 GLU A 80 19.666 -3.737 -9.106 1.00 2.16 O ATOM 1054 OE2 GLU A 80 18.589 -5.203 -7.952 1.00 1.97 O ATOM 1055 HA GLU A 80 16.449 -4.072 -8.666 1.00 0.00 H ATOM 1056 HB2 GLU A 80 17.406 -1.832 -8.622 1.00 0.00 H ATOM 1057 HB3 GLU A 80 16.889 -1.599 -6.935 1.00 0.00 H ATOM 1058 HG2 GLU A 80 19.311 -2.210 -7.116 1.00 0.00 H ATOM 1059 HG3 GLU A 80 18.375 -3.411 -6.195 1.00 0.00 H ATOM 1060 H GLU A 80 14.762 -1.737 -8.138 1.00 0.00 H ATOM 1061 N ALA A 81 15.720 -3.581 -5.464 1.00 0.50 N ATOM 1062 CA ALA A 81 15.586 -4.325 -4.179 1.00 0.49 C ATOM 1063 C ALA A 81 14.493 -5.386 -4.326 1.00 0.44 C ATOM 1064 O ALA A 81 14.701 -6.553 -4.052 1.00 0.42 O ATOM 1065 CB ALA A 81 15.207 -3.350 -3.062 1.00 0.53 C ATOM 1066 HA ALA A 81 16.532 -4.806 -3.931 1.00 0.00 H ATOM 1067 HB1 ALA A 81 15.984 -2.592 -2.964 1.00 0.00 H ATOM 1068 HB2 ALA A 81 14.259 -2.871 -3.306 1.00 0.00 H ATOM 1069 HB3 ALA A 81 15.109 -3.895 -2.123 1.00 0.00 H ATOM 1070 H ALA A 81 15.558 -2.554 -5.492 1.00 0.00 H ATOM 1071 N ILE A 82 13.330 -4.987 -4.763 1.00 0.43 N ATOM 1072 CA ILE A 82 12.216 -5.962 -4.936 1.00 0.39 C ATOM 1073 C ILE A 82 12.678 -7.126 -5.815 1.00 0.38 C ATOM 1074 O ILE A 82 12.146 -8.214 -5.742 1.00 0.37 O ATOM 1075 CB ILE A 82 11.028 -5.263 -5.599 1.00 0.42 C ATOM 1076 CG1 ILE A 82 10.229 -4.505 -4.536 1.00 0.48 C ATOM 1077 CG2 ILE A 82 10.130 -6.302 -6.269 1.00 0.44 C ATOM 1078 CD1 ILE A 82 9.405 -3.405 -5.205 1.00 0.68 C ATOM 1079 HA ILE A 82 11.918 -6.345 -3.960 1.00 0.00 H ATOM 1080 HB ILE A 82 11.391 -4.563 -6.351 1.00 0.00 H ATOM 1081 HG12 ILE A 82 9.562 -5.196 -4.021 1.00 0.00 H ATOM 1082 HG13 ILE A 82 10.914 -4.059 -3.816 1.00 0.00 H ATOM 1083 HD11 ILE A 82 10.073 -2.714 -5.719 1.00 0.00 H ATOM 1084 HD12 ILE A 82 8.720 -3.853 -5.925 1.00 0.00 H ATOM 1085 HD13 ILE A 82 8.837 -2.866 -4.447 1.00 0.00 H ATOM 1086 HG21 ILE A 82 10.701 -6.841 -7.025 1.00 0.00 H ATOM 1087 HG22 ILE A 82 9.765 -7.003 -5.518 1.00 0.00 H ATOM 1088 HG23 ILE A 82 9.285 -5.800 -6.740 1.00 0.00 H ATOM 1089 H ILE A 82 13.180 -3.984 -4.992 1.00 0.00 H ATOM 1090 N SER A 83 13.662 -6.912 -6.647 1.00 0.40 N ATOM 1091 CA SER A 83 14.146 -8.016 -7.520 1.00 0.42 C ATOM 1092 C SER A 83 14.983 -8.983 -6.682 1.00 0.44 C ATOM 1093 O SER A 83 14.881 -10.185 -6.816 1.00 0.47 O ATOM 1094 CB SER A 83 15.005 -7.439 -8.647 1.00 0.46 C ATOM 1095 OG SER A 83 16.070 -8.336 -8.932 1.00 1.31 O ATOM 1096 HA SER A 83 13.296 -8.544 -7.952 1.00 0.00 H ATOM 1097 HB2 SER A 83 15.412 -6.476 -8.338 1.00 0.00 H ATOM 1098 HB3 SER A 83 14.393 -7.304 -9.539 1.00 0.00 H ATOM 1099 HG SER A 83 16.627 -7.964 -9.661 1.00 0.00 H ATOM 1100 H SER A 83 14.106 -5.973 -6.699 1.00 0.00 H ATOM 1101 N LEU A 84 15.809 -8.464 -5.815 1.00 0.44 N ATOM 1102 CA LEU A 84 16.652 -9.352 -4.963 1.00 0.47 C ATOM 1103 C LEU A 84 15.769 -10.116 -3.975 1.00 0.46 C ATOM 1104 O LEU A 84 16.136 -11.166 -3.494 1.00 0.49 O ATOM 1105 CB LEU A 84 17.669 -8.507 -4.193 1.00 0.50 C ATOM 1106 CG LEU A 84 19.082 -9.016 -4.486 1.00 0.63 C ATOM 1107 CD1 LEU A 84 20.053 -7.835 -4.526 1.00 0.92 C ATOM 1108 CD2 LEU A 84 19.511 -9.989 -3.385 1.00 0.94 C ATOM 1109 HA LEU A 84 17.177 -10.065 -5.599 1.00 0.00 H ATOM 1110 HB2 LEU A 84 17.586 -7.466 -4.504 1.00 0.00 H ATOM 1111 HB3 LEU A 84 17.470 -8.583 -3.124 1.00 0.00 H ATOM 1112 HG LEU A 84 19.091 -9.527 -5.449 1.00 0.00 H ATOM 1113 HD21 LEU A 84 19.501 -9.475 -2.424 1.00 0.00 H ATOM 1114 HD22 LEU A 84 18.819 -10.831 -3.356 1.00 0.00 H ATOM 1115 HD23 LEU A 84 20.518 -10.351 -3.594 1.00 0.00 H ATOM 1116 HD11 LEU A 84 19.747 -7.141 -5.309 1.00 0.00 H ATOM 1117 HD12 LEU A 84 20.043 -7.325 -3.563 1.00 0.00 H ATOM 1118 HD13 LEU A 84 21.059 -8.200 -4.735 1.00 0.00 H ATOM 1119 H LEU A 84 15.879 -7.431 -5.718 1.00 0.00 H ATOM 1120 N VAL A 85 14.609 -9.609 -3.664 1.00 0.43 N ATOM 1121 CA VAL A 85 13.731 -10.335 -2.706 1.00 0.44 C ATOM 1122 C VAL A 85 12.986 -11.449 -3.448 1.00 0.45 C ATOM 1123 O VAL A 85 13.100 -12.612 -3.121 1.00 0.52 O ATOM 1124 CB VAL A 85 12.724 -9.366 -2.084 1.00 0.42 C ATOM 1125 CG1 VAL A 85 12.259 -9.921 -0.737 1.00 0.45 C ATOM 1126 CG2 VAL A 85 13.391 -8.003 -1.870 1.00 0.41 C ATOM 1127 HA VAL A 85 14.341 -10.768 -1.913 1.00 0.00 H ATOM 1128 HB VAL A 85 11.868 -9.250 -2.749 1.00 0.00 H ATOM 1129 HG11 VAL A 85 11.788 -10.892 -0.889 1.00 0.00 H ATOM 1130 HG12 VAL A 85 13.118 -10.032 -0.075 1.00 0.00 H ATOM 1131 HG13 VAL A 85 11.541 -9.233 -0.290 1.00 0.00 H ATOM 1132 HG21 VAL A 85 14.245 -8.119 -1.202 1.00 0.00 H ATOM 1133 HG22 VAL A 85 13.729 -7.611 -2.829 1.00 0.00 H ATOM 1134 HG23 VAL A 85 12.672 -7.314 -1.427 1.00 0.00 H ATOM 1135 H VAL A 85 14.300 -8.707 -4.081 1.00 0.00 H ATOM 1136 N CYS A 86 12.225 -11.105 -4.446 1.00 0.43 N ATOM 1137 CA CYS A 86 11.476 -12.146 -5.207 1.00 0.46 C ATOM 1138 C CYS A 86 12.453 -13.145 -5.844 1.00 0.49 C ATOM 1139 O CYS A 86 12.075 -14.242 -6.207 1.00 0.52 O ATOM 1140 CB CYS A 86 10.655 -11.472 -6.309 1.00 0.47 C ATOM 1141 SG CYS A 86 9.315 -10.512 -5.562 1.00 1.47 S ATOM 1142 HA CYS A 86 10.817 -12.680 -4.523 1.00 0.00 H ATOM 1143 HB2 CYS A 86 10.234 -12.233 -6.966 1.00 0.00 H ATOM 1144 HB3 CYS A 86 11.298 -10.809 -6.888 1.00 0.00 H ATOM 1145 HG CYS A 86 8.576 -9.905 -6.557 1.00 0.00 H ATOM 1146 H CYS A 86 12.139 -10.104 -4.713 1.00 0.00 H ATOM 1147 N GLU A 87 13.701 -12.781 -5.992 1.00 0.51 N ATOM 1148 CA GLU A 87 14.680 -13.721 -6.614 1.00 0.57 C ATOM 1149 C GLU A 87 15.523 -14.408 -5.534 1.00 0.59 C ATOM 1150 O GLU A 87 15.416 -15.599 -5.318 1.00 0.63 O ATOM 1151 CB GLU A 87 15.600 -12.942 -7.556 1.00 0.59 C ATOM 1152 CG GLU A 87 14.793 -12.433 -8.751 1.00 1.04 C ATOM 1153 CD GLU A 87 15.402 -12.975 -10.046 1.00 1.56 C ATOM 1154 OE1 GLU A 87 16.555 -12.674 -10.306 1.00 2.03 O ATOM 1155 OE2 GLU A 87 14.705 -13.682 -10.754 1.00 2.28 O ATOM 1156 HA GLU A 87 14.134 -14.482 -7.171 1.00 0.00 H ATOM 1157 HB2 GLU A 87 16.034 -12.096 -7.023 1.00 0.00 H ATOM 1158 HB3 GLU A 87 16.398 -13.596 -7.908 1.00 0.00 H ATOM 1159 HG2 GLU A 87 13.761 -12.773 -8.664 1.00 0.00 H ATOM 1160 HG3 GLU A 87 14.815 -11.343 -8.767 1.00 0.00 H ATOM 1161 H GLU A 87 14.010 -11.839 -5.677 1.00 0.00 H ATOM 1162 N ALA A 88 16.365 -13.665 -4.862 1.00 0.57 N ATOM 1163 CA ALA A 88 17.226 -14.268 -3.798 1.00 0.61 C ATOM 1164 C ALA A 88 16.372 -15.084 -2.826 1.00 0.60 C ATOM 1165 O ALA A 88 16.712 -16.195 -2.471 1.00 0.70 O ATOM 1166 CB ALA A 88 17.940 -13.154 -3.030 1.00 0.60 C ATOM 1167 HA ALA A 88 17.959 -14.925 -4.266 1.00 0.00 H ATOM 1168 HB1 ALA A 88 18.560 -12.579 -3.718 1.00 0.00 H ATOM 1169 HB2 ALA A 88 17.200 -12.498 -2.572 1.00 0.00 H ATOM 1170 HB3 ALA A 88 18.567 -13.593 -2.255 1.00 0.00 H ATOM 1171 H ALA A 88 16.436 -12.648 -5.069 1.00 0.00 H ATOM 1172 N VAL A 89 15.266 -14.545 -2.394 1.00 0.52 N ATOM 1173 CA VAL A 89 14.395 -15.302 -1.444 1.00 0.53 C ATOM 1174 C VAL A 89 13.046 -15.615 -2.117 1.00 0.51 C ATOM 1175 O VAL A 89 12.143 -14.804 -2.088 1.00 0.84 O ATOM 1176 CB VAL A 89 14.163 -14.481 -0.162 1.00 0.65 C ATOM 1177 CG1 VAL A 89 13.760 -13.041 -0.494 1.00 0.52 C ATOM 1178 CG2 VAL A 89 13.051 -15.137 0.659 1.00 1.08 C ATOM 1179 HA VAL A 89 14.891 -16.235 -1.176 1.00 0.00 H ATOM 1180 HB VAL A 89 15.093 -14.457 0.406 1.00 0.00 H ATOM 1181 HG11 VAL A 89 14.553 -12.567 -1.073 1.00 0.00 H ATOM 1182 HG12 VAL A 89 12.838 -13.048 -1.076 1.00 0.00 H ATOM 1183 HG13 VAL A 89 13.603 -12.486 0.431 1.00 0.00 H ATOM 1184 HG21 VAL A 89 12.134 -15.165 0.070 1.00 0.00 H ATOM 1185 HG22 VAL A 89 13.346 -16.153 0.922 1.00 0.00 H ATOM 1186 HG23 VAL A 89 12.883 -14.559 1.568 1.00 0.00 H ATOM 1187 H VAL A 89 14.991 -13.593 -2.709 1.00 0.00 H ATOM 1188 N PRO A 90 12.945 -16.788 -2.708 1.00 0.61 N ATOM 1189 CA PRO A 90 11.725 -17.233 -3.394 1.00 0.75 C ATOM 1190 C PRO A 90 10.489 -16.925 -2.544 1.00 0.74 C ATOM 1191 O PRO A 90 10.565 -16.806 -1.338 1.00 1.02 O ATOM 1192 CB PRO A 90 11.881 -18.737 -3.580 1.00 1.18 C ATOM 1193 CG PRO A 90 13.418 -18.920 -3.617 1.00 1.52 C ATOM 1194 CD PRO A 90 14.036 -17.791 -2.755 1.00 1.06 C ATOM 1195 HA PRO A 90 11.592 -16.721 -4.347 1.00 0.00 H ATOM 1196 HD3 PRO A 90 14.285 -18.149 -1.756 1.00 0.00 H ATOM 1197 HD2 PRO A 90 14.929 -17.380 -3.226 1.00 0.00 H ATOM 1198 HG3 PRO A 90 13.778 -18.846 -4.643 1.00 0.00 H ATOM 1199 HG2 PRO A 90 13.688 -19.893 -3.207 1.00 0.00 H ATOM 1200 HB2 PRO A 90 11.440 -19.284 -2.747 1.00 0.00 H ATOM 1201 HB3 PRO A 90 11.423 -19.067 -4.512 1.00 0.00 H ATOM 1202 N GLY A 91 9.351 -16.795 -3.169 1.00 0.90 N ATOM 1203 CA GLY A 91 8.108 -16.492 -2.405 1.00 1.13 C ATOM 1204 C GLY A 91 7.128 -15.730 -3.301 1.00 1.18 C ATOM 1205 O GLY A 91 5.928 -15.807 -3.130 1.00 1.79 O ATOM 1206 HA3 GLY A 91 8.355 -15.882 -1.536 1.00 0.00 H ATOM 1207 HA2 GLY A 91 7.649 -17.424 -2.074 1.00 0.00 H ATOM 1208 H GLY A 91 9.311 -16.903 -4.203 1.00 0.00 H ATOM 1209 N ALA A 92 7.630 -14.993 -4.255 1.00 1.18 N ATOM 1210 CA ALA A 92 6.728 -14.227 -5.160 1.00 1.27 C ATOM 1211 C ALA A 92 6.027 -15.188 -6.121 1.00 1.08 C ATOM 1212 O ALA A 92 6.008 -16.385 -5.914 1.00 1.44 O ATOM 1213 CB ALA A 92 7.550 -13.215 -5.961 1.00 1.78 C ATOM 1214 HA ALA A 92 5.981 -13.701 -4.565 1.00 0.00 H ATOM 1215 HB1 ALA A 92 8.047 -12.528 -5.275 1.00 0.00 H ATOM 1216 HB2 ALA A 92 8.297 -13.743 -6.553 1.00 0.00 H ATOM 1217 HB3 ALA A 92 6.889 -12.655 -6.623 1.00 0.00 H ATOM 1218 H ALA A 92 8.661 -14.941 -4.383 1.00 0.00 H ATOM 1219 N LYS A 93 5.450 -14.672 -7.172 1.00 1.09 N ATOM 1220 CA LYS A 93 4.750 -15.554 -8.147 1.00 1.26 C ATOM 1221 C LYS A 93 5.074 -15.096 -9.571 1.00 1.67 C ATOM 1222 O LYS A 93 4.332 -14.349 -10.177 1.00 2.57 O ATOM 1223 CB LYS A 93 3.239 -15.470 -7.916 1.00 1.54 C ATOM 1224 CG LYS A 93 2.768 -16.714 -7.161 1.00 2.05 C ATOM 1225 CD LYS A 93 1.892 -17.568 -8.080 1.00 2.46 C ATOM 1226 CE LYS A 93 2.217 -19.048 -7.866 1.00 2.95 C ATOM 1227 NZ LYS A 93 1.364 -19.590 -6.771 1.00 3.68 N ATOM 1228 HA LYS A 93 5.082 -16.583 -8.011 1.00 0.00 H ATOM 1229 HB2 LYS A 93 3.010 -14.580 -7.329 1.00 0.00 H ATOM 1230 HB3 LYS A 93 2.727 -15.412 -8.877 1.00 0.00 H ATOM 1231 HG2 LYS A 93 3.633 -17.294 -6.841 1.00 0.00 H ATOM 1232 HG3 LYS A 93 2.191 -16.412 -6.287 1.00 0.00 H ATOM 1233 HD2 LYS A 93 0.842 -17.390 -7.850 1.00 0.00 H ATOM 1234 HD3 LYS A 93 2.086 -17.300 -9.119 1.00 0.00 H ATOM 1235 HE2 LYS A 93 3.267 -19.154 -7.595 1.00 0.00 H ATOM 1236 HE3 LYS A 93 2.022 -19.600 -8.786 1.00 0.00 H ATOM 1237 HZ1 LYS A 93 1.551 -19.063 -5.894 1.00 0.00 H ATOM 1238 HZ2 LYS A 93 0.362 -19.488 -7.031 1.00 0.00 H ATOM 1239 HZ3 LYS A 93 1.585 -20.596 -6.626 1.00 0.00 H ATOM 1240 H LYS A 93 5.479 -13.644 -7.329 1.00 0.00 H ATOM 1241 N GLY A 94 6.178 -15.538 -10.109 1.00 1.43 N ATOM 1242 CA GLY A 94 6.548 -15.127 -11.493 1.00 2.00 C ATOM 1243 C GLY A 94 7.834 -14.299 -11.454 1.00 1.57 C ATOM 1244 O GLY A 94 7.947 -13.280 -12.106 1.00 1.54 O ATOM 1245 HA3 GLY A 94 5.744 -14.529 -11.922 1.00 0.00 H ATOM 1246 HA2 GLY A 94 6.706 -16.015 -12.106 1.00 0.00 H ATOM 1247 H GLY A 94 6.799 -16.177 -9.572 1.00 0.00 H ATOM 1248 N ALA A 95 8.804 -14.728 -10.694 1.00 1.56 N ATOM 1249 CA ALA A 95 10.081 -13.965 -10.612 1.00 1.40 C ATOM 1250 C ALA A 95 11.016 -14.645 -9.611 1.00 1.25 C ATOM 1251 O ALA A 95 11.703 -13.996 -8.848 1.00 1.67 O ATOM 1252 CB ALA A 95 9.793 -12.535 -10.151 1.00 1.82 C ATOM 1253 HA ALA A 95 10.554 -13.941 -11.594 1.00 0.00 H ATOM 1254 HB1 ALA A 95 9.126 -12.052 -10.865 1.00 0.00 H ATOM 1255 HB2 ALA A 95 9.320 -12.559 -9.169 1.00 0.00 H ATOM 1256 HB3 ALA A 95 10.728 -11.978 -10.092 1.00 0.00 H ATOM 1257 H ALA A 95 8.686 -15.603 -10.145 1.00 0.00 H ATOM 1258 N THR A 96 11.047 -15.950 -9.607 1.00 1.24 N ATOM 1259 CA THR A 96 11.936 -16.672 -8.654 1.00 1.32 C ATOM 1260 C THR A 96 13.340 -16.785 -9.251 1.00 1.75 C ATOM 1261 O THR A 96 14.329 -16.541 -8.587 1.00 2.42 O ATOM 1262 CB THR A 96 11.376 -18.073 -8.398 1.00 1.42 C ATOM 1263 OG1 THR A 96 10.002 -18.104 -8.757 1.00 1.84 O ATOM 1264 CG2 THR A 96 11.527 -18.421 -6.917 1.00 1.37 C ATOM 1265 HA THR A 96 11.985 -16.122 -7.714 1.00 0.00 H ATOM 1266 HB THR A 96 11.925 -18.800 -8.997 1.00 0.00 H ATOM 1267 HG1 THR A 96 9.639 -19.010 -8.592 1.00 0.00 H ATOM 1268 HG23 THR A 96 12.582 -18.396 -6.645 1.00 0.00 H ATOM 1269 HG21 THR A 96 10.979 -17.695 -6.317 1.00 0.00 H ATOM 1270 HG22 THR A 96 11.127 -19.419 -6.737 1.00 0.00 H ATOM 1271 H THR A 96 10.451 -16.486 -10.269 1.00 0.00 H ATOM 1272 N ARG A 97 13.436 -17.154 -10.498 1.00 1.86 N ATOM 1273 CA ARG A 97 14.776 -17.284 -11.136 1.00 2.36 C ATOM 1274 C ARG A 97 14.604 -17.461 -12.646 1.00 2.11 C ATOM 1275 O ARG A 97 13.918 -18.355 -13.101 1.00 2.29 O ATOM 1276 CB ARG A 97 15.500 -18.501 -10.558 1.00 2.91 C ATOM 1277 CG ARG A 97 16.850 -18.673 -11.258 1.00 3.97 C ATOM 1278 CD ARG A 97 16.688 -19.610 -12.457 1.00 4.75 C ATOM 1279 NE ARG A 97 17.372 -19.021 -13.643 1.00 5.73 N ATOM 1280 CZ ARG A 97 18.675 -18.949 -13.675 1.00 6.46 C ATOM 1281 NH1 ARG A 97 19.284 -17.916 -13.162 1.00 7.12 N ATOM 1282 NH2 ARG A 97 19.368 -19.910 -14.221 1.00 6.80 N ATOM 1283 HA ARG A 97 15.362 -16.387 -10.939 1.00 0.00 H ATOM 1284 HB2 ARG A 97 15.660 -18.355 -9.490 1.00 0.00 H ATOM 1285 HB3 ARG A 97 14.893 -19.393 -10.714 1.00 0.00 H ATOM 1286 HG2 ARG A 97 17.208 -17.702 -11.601 1.00 0.00 H ATOM 1287 HG3 ARG A 97 17.570 -19.098 -10.559 1.00 0.00 H ATOM 1288 HD2 ARG A 97 15.628 -19.741 -12.676 1.00 0.00 H ATOM 1289 HD3 ARG A 97 17.132 -20.578 -12.225 1.00 0.00 H ATOM 1290 HE ARG A 97 16.812 -18.668 -14.445 1.00 0.00 H ATOM 1291 HH12 ARG A 97 20.322 -17.859 -13.188 1.00 0.00 H ATOM 1292 HH11 ARG A 97 18.731 -17.150 -12.727 1.00 0.00 H ATOM 1293 HH22 ARG A 97 20.406 -19.853 -14.247 1.00 0.00 H ATOM 1294 HH21 ARG A 97 18.882 -20.733 -14.631 1.00 0.00 H ATOM 1295 H ARG A 97 12.577 -17.358 -11.047 1.00 0.00 H ATOM 1296 N ARG A 98 15.220 -16.617 -13.426 1.00 2.20 N ATOM 1297 CA ARG A 98 15.090 -16.738 -14.905 1.00 2.90 C ATOM 1298 C ARG A 98 16.137 -15.852 -15.582 1.00 3.22 C ATOM 1299 O ARG A 98 15.886 -15.253 -16.609 1.00 3.89 O ATOM 1300 CB ARG A 98 13.690 -16.291 -15.332 1.00 3.44 C ATOM 1301 CG ARG A 98 13.050 -17.371 -16.207 1.00 4.36 C ATOM 1302 CD ARG A 98 13.267 -17.027 -17.682 1.00 5.06 C ATOM 1303 NE ARG A 98 13.729 -18.241 -18.412 1.00 5.88 N ATOM 1304 CZ ARG A 98 14.906 -18.255 -18.976 1.00 6.35 C ATOM 1305 NH1 ARG A 98 15.235 -17.318 -19.823 1.00 6.71 N ATOM 1306 NH2 ARG A 98 15.754 -19.206 -18.693 1.00 6.71 N ATOM 1307 HA ARG A 98 15.246 -17.776 -15.200 1.00 0.00 H ATOM 1308 HB2 ARG A 98 13.075 -16.129 -14.447 1.00 0.00 H ATOM 1309 HB3 ARG A 98 13.762 -15.362 -15.897 1.00 0.00 H ATOM 1310 HG2 ARG A 98 13.508 -18.336 -15.987 1.00 0.00 H ATOM 1311 HG3 ARG A 98 11.981 -17.422 -15.999 1.00 0.00 H ATOM 1312 HD2 ARG A 98 14.020 -16.244 -17.766 1.00 0.00 H ATOM 1313 HD3 ARG A 98 12.330 -16.676 -18.115 1.00 0.00 H ATOM 1314 HE ARG A 98 13.114 -19.077 -18.472 1.00 0.00 H ATOM 1315 HH12 ARG A 98 16.173 -17.329 -20.272 1.00 0.00 H ATOM 1316 HH11 ARG A 98 14.559 -16.560 -20.049 1.00 0.00 H ATOM 1317 HH22 ARG A 98 16.692 -19.217 -19.142 1.00 0.00 H ATOM 1318 HH21 ARG A 98 15.492 -19.953 -18.018 1.00 0.00 H ATOM 1319 H ARG A 98 15.802 -15.859 -13.015 1.00 0.00 H ATOM 1320 N ARG A 99 17.309 -15.764 -15.016 1.00 3.12 N ATOM 1321 CA ARG A 99 18.368 -14.916 -15.629 1.00 3.55 C ATOM 1322 C ARG A 99 17.843 -13.488 -15.793 1.00 3.04 C ATOM 1323 O ARG A 99 17.328 -13.123 -16.831 1.00 3.56 O ATOM 1324 CB ARG A 99 18.745 -15.481 -17.000 1.00 4.65 C ATOM 1325 CG ARG A 99 19.792 -16.583 -16.828 1.00 5.53 C ATOM 1326 CD ARG A 99 21.110 -16.141 -17.468 1.00 6.48 C ATOM 1327 NE ARG A 99 21.979 -15.514 -16.433 1.00 7.29 N ATOM 1328 CZ ARG A 99 22.895 -14.654 -16.785 1.00 8.15 C ATOM 1329 NH1 ARG A 99 23.709 -14.933 -17.766 1.00 8.94 N ATOM 1330 NH2 ARG A 99 22.998 -13.516 -16.155 1.00 8.37 N ATOM 1331 HA ARG A 99 19.248 -14.910 -14.985 1.00 0.00 H ATOM 1332 HB2 ARG A 99 17.858 -15.894 -17.479 1.00 0.00 H ATOM 1333 HB3 ARG A 99 19.154 -14.684 -17.621 1.00 0.00 H ATOM 1334 HG2 ARG A 99 19.949 -16.772 -15.766 1.00 0.00 H ATOM 1335 HG3 ARG A 99 19.442 -17.495 -17.311 1.00 0.00 H ATOM 1336 HD2 ARG A 99 20.906 -15.418 -18.258 1.00 0.00 H ATOM 1337 HD3 ARG A 99 21.617 -17.008 -17.892 1.00 0.00 H ATOM 1338 HE ARG A 99 21.856 -15.762 -15.430 1.00 0.00 H ATOM 1339 HH12 ARG A 99 24.439 -14.248 -18.047 1.00 0.00 H ATOM 1340 HH11 ARG A 99 23.628 -15.841 -18.267 1.00 0.00 H ATOM 1341 HH22 ARG A 99 23.728 -12.831 -16.436 1.00 0.00 H ATOM 1342 HH21 ARG A 99 22.350 -13.294 -15.372 1.00 0.00 H ATOM 1343 H ARG A 99 17.503 -16.286 -14.138 1.00 0.00 H ATOM 1344 N LYS A 100 17.967 -12.679 -14.777 1.00 2.46 N ATOM 1345 CA LYS A 100 17.472 -11.277 -14.879 1.00 2.53 C ATOM 1346 C LYS A 100 18.541 -10.310 -14.362 1.00 2.52 C ATOM 1347 O LYS A 100 18.324 -9.606 -13.395 1.00 2.62 O ATOM 1348 CB LYS A 100 16.202 -11.125 -14.039 1.00 2.89 C ATOM 1349 CG LYS A 100 15.434 -9.883 -14.495 1.00 3.82 C ATOM 1350 CD LYS A 100 14.504 -10.255 -15.651 1.00 4.50 C ATOM 1351 CE LYS A 100 14.312 -9.042 -16.562 1.00 5.19 C ATOM 1352 NZ LYS A 100 14.136 -9.501 -17.969 1.00 6.18 N ATOM 1353 HA LYS A 100 17.253 -11.048 -15.922 1.00 0.00 H ATOM 1354 HB2 LYS A 100 15.575 -12.007 -14.166 1.00 0.00 H ATOM 1355 HB3 LYS A 100 16.472 -11.020 -12.988 1.00 0.00 H ATOM 1356 HG2 LYS A 100 14.845 -9.495 -13.664 1.00 0.00 H ATOM 1357 HG3 LYS A 100 16.139 -9.121 -14.826 1.00 0.00 H ATOM 1358 HD2 LYS A 100 14.943 -11.073 -16.222 1.00 0.00 H ATOM 1359 HD3 LYS A 100 13.538 -10.568 -15.254 1.00 0.00 H ATOM 1360 HE2 LYS A 100 15.188 -8.396 -16.497 1.00 0.00 H ATOM 1361 HE3 LYS A 100 13.428 -8.487 -16.247 1.00 0.00 H ATOM 1362 HZ1 LYS A 100 14.980 -10.030 -18.268 1.00 0.00 H ATOM 1363 HZ2 LYS A 100 13.300 -10.117 -18.029 1.00 0.00 H ATOM 1364 HZ3 LYS A 100 14.005 -8.675 -18.588 1.00 0.00 H ATOM 1365 H LYS A 100 18.411 -13.012 -13.897 1.00 0.00 H ATOM 1366 N PRO A 101 19.665 -10.304 -15.029 1.00 3.03 N ATOM 1367 CA PRO A 101 20.796 -9.440 -14.677 1.00 3.47 C ATOM 1368 C PRO A 101 20.464 -7.974 -14.992 1.00 3.05 C ATOM 1369 O PRO A 101 20.043 -7.231 -14.127 1.00 3.17 O ATOM 1370 CB PRO A 101 21.975 -9.932 -15.514 1.00 4.26 C ATOM 1371 CG PRO A 101 21.294 -10.665 -16.700 1.00 4.60 C ATOM 1372 CD PRO A 101 19.915 -11.166 -16.203 1.00 3.76 C ATOM 1373 HA PRO A 101 21.027 -9.486 -13.613 1.00 0.00 H ATOM 1374 HD3 PRO A 101 19.147 -11.027 -16.964 1.00 0.00 H ATOM 1375 HD2 PRO A 101 19.957 -12.217 -15.918 1.00 0.00 H ATOM 1376 HG3 PRO A 101 21.906 -11.510 -17.017 1.00 0.00 H ATOM 1377 HG2 PRO A 101 21.162 -9.979 -17.537 1.00 0.00 H ATOM 1378 HB2 PRO A 101 22.579 -9.096 -15.867 1.00 0.00 H ATOM 1379 HB3 PRO A 101 22.602 -10.615 -14.941 1.00 0.00 H ATOM 1380 N CYS A 102 20.644 -7.547 -16.215 1.00 3.12 N ATOM 1381 CA CYS A 102 20.333 -6.132 -16.564 1.00 3.12 C ATOM 1382 C CYS A 102 21.245 -5.192 -15.772 1.00 2.92 C ATOM 1383 O CYS A 102 21.771 -5.547 -14.735 1.00 3.36 O ATOM 1384 CB CYS A 102 18.873 -5.832 -16.220 1.00 4.07 C ATOM 1385 SG CYS A 102 17.935 -7.379 -16.169 1.00 4.82 S ATOM 1386 HA CYS A 102 20.497 -5.980 -17.631 1.00 0.00 H ATOM 1387 HB2 CYS A 102 18.448 -5.174 -16.978 1.00 0.00 H ATOM 1388 HB3 CYS A 102 18.822 -5.343 -15.247 1.00 0.00 H ATOM 1389 HG CYS A 102 18.473 -8.210 -15.208 1.00 0.00 H ATOM 1390 H CYS A 102 21.004 -8.195 -16.944 1.00 0.00 H ATOM 1391 N SER A 103 21.436 -3.994 -16.253 1.00 2.77 N ATOM 1392 CA SER A 103 22.311 -3.028 -15.531 1.00 2.80 C ATOM 1393 C SER A 103 21.672 -2.678 -14.183 1.00 2.65 C ATOM 1394 O SER A 103 20.862 -3.419 -13.663 1.00 3.04 O ATOM 1395 CB SER A 103 22.467 -1.761 -16.374 1.00 3.32 C ATOM 1396 OG SER A 103 23.753 -1.201 -16.146 1.00 3.97 O ATOM 1397 HA SER A 103 23.292 -3.472 -15.362 1.00 0.00 H ATOM 1398 HB2 SER A 103 21.700 -1.039 -16.093 1.00 0.00 H ATOM 1399 HB3 SER A 103 22.360 -2.010 -17.430 1.00 0.00 H ATOM 1400 HG SER A 103 23.856 -0.381 -16.691 1.00 0.00 H ATOM 1401 H SER A 103 20.976 -3.713 -17.143 1.00 0.00 H ATOM 1402 N ARG A 104 22.024 -1.555 -13.611 1.00 2.76 N ATOM 1403 CA ARG A 104 21.423 -1.175 -12.300 1.00 3.12 C ATOM 1404 C ARG A 104 21.611 0.332 -12.040 1.00 2.45 C ATOM 1405 O ARG A 104 22.321 0.742 -11.148 1.00 2.54 O ATOM 1406 CB ARG A 104 22.027 -2.045 -11.166 1.00 4.22 C ATOM 1407 CG ARG A 104 23.474 -1.653 -10.784 1.00 5.09 C ATOM 1408 CD ARG A 104 24.320 -1.339 -12.022 1.00 6.12 C ATOM 1409 NE ARG A 104 24.413 -2.551 -12.884 1.00 6.95 N ATOM 1410 CZ ARG A 104 24.841 -3.678 -12.383 1.00 7.80 C ATOM 1411 NH1 ARG A 104 26.099 -3.812 -12.057 1.00 8.50 N ATOM 1412 NH2 ARG A 104 24.013 -4.671 -12.206 1.00 8.19 N ATOM 1413 HA ARG A 104 20.350 -1.366 -12.324 1.00 0.00 H ATOM 1414 HB2 ARG A 104 21.398 -1.943 -10.282 1.00 0.00 H ATOM 1415 HB3 ARG A 104 22.027 -3.085 -11.493 1.00 0.00 H ATOM 1416 HG2 ARG A 104 23.444 -0.772 -10.143 1.00 0.00 H ATOM 1417 HG3 ARG A 104 23.933 -2.480 -10.242 1.00 0.00 H ATOM 1418 HD2 ARG A 104 25.320 -1.037 -11.711 1.00 0.00 H ATOM 1419 HD3 ARG A 104 23.855 -0.529 -12.584 1.00 0.00 H ATOM 1420 HE ARG A 104 24.137 -2.499 -13.885 1.00 0.00 H ATOM 1421 HH12 ARG A 104 26.440 -4.710 -11.658 1.00 0.00 H ATOM 1422 HH11 ARG A 104 26.759 -3.021 -12.197 1.00 0.00 H ATOM 1423 HH22 ARG A 104 24.355 -5.568 -11.807 1.00 0.00 H ATOM 1424 HH21 ARG A 104 23.011 -4.565 -12.464 1.00 0.00 H ATOM 1425 H ARG A 104 22.719 -0.931 -14.068 1.00 0.00 H ATOM 1426 N PRO A 105 20.946 1.121 -12.845 1.00 2.26 N ATOM 1427 CA PRO A 105 20.995 2.585 -12.750 1.00 2.06 C ATOM 1428 C PRO A 105 20.781 3.024 -11.298 1.00 1.69 C ATOM 1429 O PRO A 105 19.663 3.184 -10.849 1.00 2.12 O ATOM 1430 CB PRO A 105 19.859 3.097 -13.627 1.00 2.68 C ATOM 1431 CG PRO A 105 19.653 1.944 -14.640 1.00 3.17 C ATOM 1432 CD PRO A 105 20.073 0.630 -13.935 1.00 2.87 C ATOM 1433 HA PRO A 105 21.959 2.978 -13.073 1.00 0.00 H ATOM 1434 HD3 PRO A 105 19.207 0.100 -13.539 1.00 0.00 H ATOM 1435 HD2 PRO A 105 20.619 -0.025 -14.614 1.00 0.00 H ATOM 1436 HG3 PRO A 105 20.271 2.108 -15.523 1.00 0.00 H ATOM 1437 HG2 PRO A 105 18.605 1.890 -14.936 1.00 0.00 H ATOM 1438 HB2 PRO A 105 18.957 3.268 -13.040 1.00 0.00 H ATOM 1439 HB3 PRO A 105 20.141 4.019 -14.135 1.00 0.00 H ATOM 1440 N LEU A 106 21.841 3.221 -10.563 1.00 1.60 N ATOM 1441 CA LEU A 106 21.694 3.649 -9.142 1.00 1.40 C ATOM 1442 C LEU A 106 23.072 3.979 -8.566 1.00 1.72 C ATOM 1443 O LEU A 106 23.981 3.174 -8.607 1.00 2.40 O ATOM 1444 CB LEU A 106 21.059 2.517 -8.330 1.00 1.59 C ATOM 1445 CG LEU A 106 19.566 2.798 -8.139 1.00 1.64 C ATOM 1446 CD1 LEU A 106 18.751 1.623 -8.681 1.00 2.17 C ATOM 1447 CD2 LEU A 106 19.267 2.979 -6.648 1.00 1.93 C ATOM 1448 HA LEU A 106 21.057 4.532 -9.092 1.00 0.00 H ATOM 1449 HB2 LEU A 106 21.186 1.574 -8.861 1.00 0.00 H ATOM 1450 HB3 LEU A 106 21.544 2.452 -7.356 1.00 0.00 H ATOM 1451 HG LEU A 106 19.297 3.707 -8.678 1.00 0.00 H ATOM 1452 HD21 LEU A 106 19.538 2.070 -6.111 1.00 0.00 H ATOM 1453 HD22 LEU A 106 19.847 3.817 -6.261 1.00 0.00 H ATOM 1454 HD23 LEU A 106 18.204 3.179 -6.514 1.00 0.00 H ATOM 1455 HD11 LEU A 106 18.964 1.494 -9.742 1.00 0.00 H ATOM 1456 HD12 LEU A 106 19.022 0.715 -8.142 1.00 0.00 H ATOM 1457 HD13 LEU A 106 17.689 1.825 -8.544 1.00 0.00 H ATOM 1458 H LEU A 106 22.788 3.080 -10.968 1.00 0.00 H ATOM 1459 N SER A 107 23.235 5.157 -8.028 1.00 1.69 N ATOM 1460 CA SER A 107 24.556 5.536 -7.450 1.00 2.19 C ATOM 1461 C SER A 107 24.478 5.493 -5.922 1.00 1.65 C ATOM 1462 O SER A 107 25.161 4.722 -5.278 1.00 2.06 O ATOM 1463 CB SER A 107 24.925 6.949 -7.902 1.00 2.92 C ATOM 1464 OG SER A 107 25.839 6.871 -8.988 1.00 3.30 O ATOM 1465 HA SER A 107 25.316 4.835 -7.794 1.00 0.00 H ATOM 1466 HB2 SER A 107 25.387 7.487 -7.075 1.00 0.00 H ATOM 1467 HB3 SER A 107 24.026 7.477 -8.220 1.00 0.00 H ATOM 1468 HG SER A 107 26.079 7.785 -9.282 1.00 0.00 H ATOM 1469 H SER A 107 22.443 5.831 -8.003 1.00 0.00 H ATOM 1470 N SER A 108 23.652 6.316 -5.336 1.00 1.22 N ATOM 1471 CA SER A 108 23.535 6.320 -3.850 1.00 1.10 C ATOM 1472 C SER A 108 22.057 6.349 -3.454 1.00 1.10 C ATOM 1473 O SER A 108 21.559 7.336 -2.949 1.00 1.69 O ATOM 1474 CB SER A 108 24.239 7.555 -3.287 1.00 1.38 C ATOM 1475 OG SER A 108 25.638 7.309 -3.224 1.00 1.93 O ATOM 1476 HA SER A 108 24.001 5.421 -3.446 1.00 0.00 H ATOM 1477 HB2 SER A 108 23.861 7.766 -2.287 1.00 0.00 H ATOM 1478 HB3 SER A 108 24.048 8.411 -3.935 1.00 0.00 H ATOM 1479 HG SER A 108 26.096 8.107 -2.860 1.00 0.00 H ATOM 1480 H SER A 108 23.076 6.968 -5.905 1.00 0.00 H ATOM 1481 N ILE A 109 21.352 5.274 -3.677 1.00 0.81 N ATOM 1482 CA ILE A 109 19.908 5.241 -3.313 1.00 0.76 C ATOM 1483 C ILE A 109 19.478 3.794 -3.060 1.00 0.81 C ATOM 1484 O ILE A 109 18.937 3.138 -3.926 1.00 1.53 O ATOM 1485 CB ILE A 109 19.079 5.826 -4.458 1.00 0.81 C ATOM 1486 CG1 ILE A 109 19.983 6.064 -5.671 1.00 0.79 C ATOM 1487 CG2 ILE A 109 18.462 7.155 -4.017 1.00 1.00 C ATOM 1488 CD1 ILE A 109 19.123 6.418 -6.885 1.00 0.85 C ATOM 1489 HA ILE A 109 19.748 5.831 -2.410 1.00 0.00 H ATOM 1490 HB ILE A 109 18.286 5.128 -4.724 1.00 0.00 H ATOM 1491 HG12 ILE A 109 20.668 6.885 -5.459 1.00 0.00 H ATOM 1492 HG13 ILE A 109 20.555 5.160 -5.881 1.00 0.00 H ATOM 1493 HD11 ILE A 109 18.439 5.596 -7.096 1.00 0.00 H ATOM 1494 HD12 ILE A 109 18.552 7.322 -6.673 1.00 0.00 H ATOM 1495 HD13 ILE A 109 19.767 6.587 -7.748 1.00 0.00 H ATOM 1496 HG21 ILE A 109 17.820 6.987 -3.153 1.00 0.00 H ATOM 1497 HG22 ILE A 109 19.256 7.852 -3.751 1.00 0.00 H ATOM 1498 HG23 ILE A 109 17.872 7.569 -4.835 1.00 0.00 H ATOM 1499 H ILE A 109 21.798 4.440 -4.109 1.00 0.00 H ATOM 1500 N LEU A 110 19.714 3.294 -1.877 1.00 0.79 N ATOM 1501 CA LEU A 110 19.320 1.889 -1.564 1.00 0.77 C ATOM 1502 C LEU A 110 19.850 1.514 -0.177 1.00 0.58 C ATOM 1503 O LEU A 110 20.304 2.356 0.572 1.00 0.55 O ATOM 1504 CB LEU A 110 19.916 0.943 -2.610 1.00 0.96 C ATOM 1505 CG LEU A 110 18.794 0.179 -3.316 1.00 1.13 C ATOM 1506 CD1 LEU A 110 19.156 -0.009 -4.790 1.00 1.48 C ATOM 1507 CD2 LEU A 110 18.617 -1.193 -2.662 1.00 1.51 C ATOM 1508 HA LEU A 110 18.233 1.803 -1.578 1.00 0.00 H ATOM 1509 HB2 LEU A 110 20.478 1.521 -3.343 1.00 0.00 H ATOM 1510 HB3 LEU A 110 20.584 0.235 -2.119 1.00 0.00 H ATOM 1511 HG LEU A 110 17.866 0.744 -3.235 1.00 0.00 H ATOM 1512 HD21 LEU A 110 19.547 -1.756 -2.744 1.00 0.00 H ATOM 1513 HD22 LEU A 110 18.361 -1.063 -1.610 1.00 0.00 H ATOM 1514 HD23 LEU A 110 17.817 -1.734 -3.167 1.00 0.00 H ATOM 1515 HD11 LEU A 110 19.284 0.967 -5.259 1.00 0.00 H ATOM 1516 HD12 LEU A 110 20.085 -0.574 -4.865 1.00 0.00 H ATOM 1517 HD13 LEU A 110 18.356 -0.553 -5.293 1.00 0.00 H ATOM 1518 H LEU A 110 20.178 3.876 -1.151 1.00 0.00 H ATOM 1519 N GLY A 111 19.797 0.257 0.169 1.00 0.59 N ATOM 1520 CA GLY A 111 20.298 -0.172 1.505 1.00 0.57 C ATOM 1521 C GLY A 111 20.585 -1.675 1.481 1.00 0.62 C ATOM 1522 O GLY A 111 21.711 -2.099 1.313 1.00 0.72 O ATOM 1523 HA3 GLY A 111 19.544 0.043 2.263 1.00 0.00 H ATOM 1524 HA2 GLY A 111 21.214 0.370 1.742 1.00 0.00 H ATOM 1525 H GLY A 111 19.404 -0.446 -0.489 1.00 0.00 H ATOM 1526 N ARG A 112 19.573 -2.483 1.649 1.00 0.65 N ATOM 1527 CA ARG A 112 19.786 -3.958 1.636 1.00 0.74 C ATOM 1528 C ARG A 112 18.467 -4.663 1.961 1.00 0.68 C ATOM 1529 O ARG A 112 17.709 -4.222 2.802 1.00 0.74 O ATOM 1530 CB ARG A 112 20.835 -4.331 2.686 1.00 0.84 C ATOM 1531 CG ARG A 112 20.590 -3.524 3.962 1.00 1.19 C ATOM 1532 CD ARG A 112 21.350 -4.165 5.124 1.00 1.57 C ATOM 1533 NE ARG A 112 22.703 -3.551 5.231 1.00 2.15 N ATOM 1534 CZ ARG A 112 23.766 -4.308 5.206 1.00 2.81 C ATOM 1535 NH1 ARG A 112 24.208 -4.847 6.309 1.00 3.29 N ATOM 1536 NH2 ARG A 112 24.387 -4.525 4.079 1.00 3.55 N ATOM 1537 HA ARG A 112 20.133 -4.268 0.650 1.00 0.00 H ATOM 1538 HB2 ARG A 112 20.763 -5.395 2.910 1.00 0.00 H ATOM 1539 HB3 ARG A 112 21.830 -4.109 2.301 1.00 0.00 H ATOM 1540 HG2 ARG A 112 20.940 -2.502 3.819 1.00 0.00 H ATOM 1541 HG3 ARG A 112 19.523 -3.514 4.187 1.00 0.00 H ATOM 1542 HD2 ARG A 112 21.450 -5.236 4.947 1.00 0.00 H ATOM 1543 HD3 ARG A 112 20.802 -4.001 6.052 1.00 0.00 H ATOM 1544 HE ARG A 112 22.801 -2.520 5.326 1.00 0.00 H ATOM 1545 HH12 ARG A 112 25.055 -5.450 6.290 1.00 0.00 H ATOM 1546 HH11 ARG A 112 23.713 -4.673 7.207 1.00 0.00 H ATOM 1547 HH22 ARG A 112 25.234 -5.128 4.060 1.00 0.00 H ATOM 1548 HH21 ARG A 112 24.035 -4.095 3.200 1.00 0.00 H ATOM 1549 H ARG A 112 18.618 -2.097 1.792 1.00 0.00 H ATOM 1550 N SER A 113 18.186 -5.755 1.303 1.00 0.60 N ATOM 1551 CA SER A 113 16.915 -6.481 1.580 1.00 0.55 C ATOM 1552 C SER A 113 17.095 -7.383 2.802 1.00 0.53 C ATOM 1553 O SER A 113 18.006 -8.184 2.869 1.00 0.58 O ATOM 1554 CB SER A 113 16.529 -7.333 0.369 1.00 0.57 C ATOM 1555 OG SER A 113 17.260 -6.896 -0.769 1.00 0.60 O ATOM 1556 HA SER A 113 16.125 -5.756 1.776 1.00 0.00 H ATOM 1557 HB2 SER A 113 15.461 -7.230 0.177 1.00 0.00 H ATOM 1558 HB3 SER A 113 16.761 -8.379 0.571 1.00 0.00 H ATOM 1559 HG SER A 113 17.010 -7.448 -1.552 1.00 0.00 H ATOM 1560 H SER A 113 18.848 -6.117 0.587 1.00 0.00 H ATOM 1561 N ASN A 114 16.230 -7.256 3.769 1.00 0.49 N ATOM 1562 CA ASN A 114 16.338 -8.101 4.992 1.00 0.50 C ATOM 1563 C ASN A 114 15.356 -9.266 4.889 1.00 0.48 C ATOM 1564 O ASN A 114 14.165 -9.107 5.076 1.00 0.47 O ATOM 1565 CB ASN A 114 16.005 -7.260 6.227 1.00 0.52 C ATOM 1566 CG ASN A 114 16.782 -7.793 7.432 1.00 0.69 C ATOM 1567 OD1 ASN A 114 16.947 -8.987 7.584 1.00 1.28 O ATOM 1568 ND2 ASN A 114 17.269 -6.952 8.303 1.00 1.24 N ATOM 1569 HA ASN A 114 17.354 -8.486 5.080 1.00 0.00 H ATOM 1570 HB2 ASN A 114 16.283 -6.222 6.046 1.00 0.00 H ATOM 1571 HB3 ASN A 114 14.936 -7.319 6.429 1.00 0.00 H ATOM 1572 HD22 ASN A 114 17.128 -5.930 8.174 1.00 0.00 H ATOM 1573 HD21 ASN A 114 17.798 -7.304 9.126 1.00 0.00 H ATOM 1574 H ASN A 114 15.460 -6.561 3.687 1.00 0.00 H ATOM 1575 N LEU A 115 15.846 -10.438 4.592 1.00 0.50 N ATOM 1576 CA LEU A 115 14.943 -11.616 4.476 1.00 0.51 C ATOM 1577 C LEU A 115 14.942 -12.383 5.799 1.00 0.55 C ATOM 1578 O LEU A 115 15.178 -13.574 5.836 1.00 0.62 O ATOM 1579 CB LEU A 115 15.436 -12.542 3.358 1.00 0.57 C ATOM 1580 CG LEU A 115 15.623 -11.757 2.054 1.00 0.59 C ATOM 1581 CD1 LEU A 115 14.551 -10.672 1.936 1.00 0.54 C ATOM 1582 CD2 LEU A 115 17.009 -11.108 2.041 1.00 0.63 C ATOM 1583 HA LEU A 115 13.934 -11.274 4.243 1.00 0.00 H ATOM 1584 HB2 LEU A 115 16.389 -12.983 3.651 1.00 0.00 H ATOM 1585 HB3 LEU A 115 14.704 -13.334 3.199 1.00 0.00 H ATOM 1586 HG LEU A 115 15.532 -12.442 1.211 1.00 0.00 H ATOM 1587 HD21 LEU A 115 17.099 -10.430 2.889 1.00 0.00 H ATOM 1588 HD22 LEU A 115 17.772 -11.883 2.111 1.00 0.00 H ATOM 1589 HD23 LEU A 115 17.139 -10.551 1.113 1.00 0.00 H ATOM 1590 HD11 LEU A 115 13.565 -11.136 1.937 1.00 0.00 H ATOM 1591 HD12 LEU A 115 14.633 -9.988 2.781 1.00 0.00 H ATOM 1592 HD13 LEU A 115 14.694 -10.121 1.006 1.00 0.00 H ATOM 1593 H LEU A 115 16.868 -10.550 4.436 1.00 0.00 H ATOM 1594 N LYS A 116 14.677 -11.712 6.886 1.00 0.56 N ATOM 1595 CA LYS A 116 14.662 -12.409 8.203 1.00 0.64 C ATOM 1596 C LYS A 116 13.339 -13.161 8.369 1.00 0.71 C ATOM 1597 O LYS A 116 13.265 -14.157 9.060 1.00 1.19 O ATOM 1598 CB LYS A 116 14.809 -11.381 9.328 1.00 0.71 C ATOM 1599 CG LYS A 116 15.681 -11.966 10.441 1.00 0.80 C ATOM 1600 CD LYS A 116 16.443 -10.837 11.139 1.00 1.43 C ATOM 1601 CE LYS A 116 16.629 -11.183 12.617 1.00 1.69 C ATOM 1602 NZ LYS A 116 16.681 -9.927 13.418 1.00 2.31 N ATOM 1603 HA LYS A 116 15.490 -13.117 8.247 1.00 0.00 H ATOM 1604 HB2 LYS A 116 15.276 -10.477 8.936 1.00 0.00 H ATOM 1605 HB3 LYS A 116 13.825 -11.136 9.728 1.00 0.00 H ATOM 1606 HG2 LYS A 116 15.049 -12.480 11.165 1.00 0.00 H ATOM 1607 HG3 LYS A 116 16.391 -12.673 10.013 1.00 0.00 H ATOM 1608 HD2 LYS A 116 17.419 -10.713 10.669 1.00 0.00 H ATOM 1609 HD3 LYS A 116 15.878 -9.909 11.051 1.00 0.00 H ATOM 1610 HE2 LYS A 116 17.559 -11.736 12.747 1.00 0.00 H ATOM 1611 HE3 LYS A 116 15.793 -11.796 12.955 1.00 0.00 H ATOM 1612 HZ1 LYS A 116 17.479 -9.344 13.095 1.00 0.00 H ATOM 1613 HZ2 LYS A 116 15.793 -9.401 13.293 1.00 0.00 H ATOM 1614 HZ3 LYS A 116 16.807 -10.163 14.423 1.00 0.00 H ATOM 1615 H LYS A 116 14.477 -10.693 6.833 1.00 0.00 H ATOM 1616 N PHE A 117 12.293 -12.695 7.741 1.00 0.72 N ATOM 1617 CA PHE A 117 10.980 -13.389 7.866 1.00 0.76 C ATOM 1618 C PHE A 117 10.292 -13.426 6.499 1.00 0.68 C ATOM 1619 O PHE A 117 9.393 -12.657 6.225 1.00 1.38 O ATOM 1620 CB PHE A 117 10.097 -12.637 8.863 1.00 1.03 C ATOM 1621 CG PHE A 117 10.079 -13.379 10.178 1.00 1.41 C ATOM 1622 CD1 PHE A 117 9.599 -14.693 10.233 1.00 2.00 C ATOM 1623 CD2 PHE A 117 10.541 -12.754 11.342 1.00 2.18 C ATOM 1624 CE1 PHE A 117 9.582 -15.382 11.452 1.00 2.58 C ATOM 1625 CE2 PHE A 117 10.524 -13.442 12.561 1.00 2.77 C ATOM 1626 CZ PHE A 117 10.044 -14.756 12.616 1.00 2.76 C ATOM 1627 HA PHE A 117 11.139 -14.407 8.221 1.00 0.00 H ATOM 1628 HB2 PHE A 117 10.495 -11.634 9.017 1.00 0.00 H ATOM 1629 HB3 PHE A 117 9.083 -12.568 8.470 1.00 0.00 H ATOM 1630 HD2 PHE A 117 10.914 -11.731 11.299 1.00 0.00 H ATOM 1631 HE2 PHE A 117 10.884 -12.955 13.467 1.00 0.00 H ATOM 1632 HZ PHE A 117 10.030 -15.292 13.565 1.00 0.00 H ATOM 1633 HE1 PHE A 117 9.209 -16.405 11.495 1.00 0.00 H ATOM 1634 HD1 PHE A 117 9.238 -15.180 9.327 1.00 0.00 H ATOM 1635 H PHE A 117 12.376 -11.840 7.154 1.00 0.00 H ATOM 1636 N ALA A 118 10.708 -14.316 5.639 1.00 0.66 N ATOM 1637 CA ALA A 118 10.079 -14.403 4.291 1.00 0.46 C ATOM 1638 C ALA A 118 8.843 -15.302 4.359 1.00 0.48 C ATOM 1639 O ALA A 118 8.945 -16.505 4.500 1.00 0.73 O ATOM 1640 CB ALA A 118 11.083 -14.992 3.297 1.00 0.51 C ATOM 1641 HA ALA A 118 9.784 -13.406 3.964 1.00 0.00 H ATOM 1642 HB1 ALA A 118 11.963 -14.350 3.248 1.00 0.00 H ATOM 1643 HB2 ALA A 118 11.377 -15.989 3.627 1.00 0.00 H ATOM 1644 HB3 ALA A 118 10.622 -15.055 2.311 1.00 0.00 H ATOM 1645 H ALA A 118 11.479 -14.965 5.895 1.00 0.00 H ATOM 1646 N GLY A 119 7.675 -14.729 4.259 1.00 0.57 N ATOM 1647 CA GLY A 119 6.433 -15.552 4.317 1.00 0.62 C ATOM 1648 C GLY A 119 5.797 -15.425 5.702 1.00 0.63 C ATOM 1649 O GLY A 119 6.013 -16.245 6.572 1.00 0.73 O ATOM 1650 HA3 GLY A 119 6.680 -16.596 4.125 1.00 0.00 H ATOM 1651 HA2 GLY A 119 5.730 -15.202 3.561 1.00 0.00 H ATOM 1652 H GLY A 119 7.610 -13.698 4.139 1.00 0.00 H ATOM 1653 N MET A 120 5.014 -14.403 5.916 1.00 0.59 N ATOM 1654 CA MET A 120 4.367 -14.225 7.247 1.00 0.61 C ATOM 1655 C MET A 120 2.946 -13.681 7.062 1.00 0.58 C ATOM 1656 O MET A 120 2.720 -12.497 7.210 1.00 0.57 O ATOM 1657 CB MET A 120 5.185 -13.233 8.076 1.00 0.65 C ATOM 1658 CG MET A 120 4.435 -12.901 9.366 1.00 0.67 C ATOM 1659 SD MET A 120 5.616 -12.747 10.729 1.00 1.17 S ATOM 1660 CE MET A 120 5.223 -11.038 11.179 1.00 0.98 C ATOM 1661 HA MET A 120 4.322 -15.186 7.760 1.00 0.00 H ATOM 1662 HB2 MET A 120 6.151 -13.675 8.321 1.00 0.00 H ATOM 1663 HB3 MET A 120 5.340 -12.320 7.501 1.00 0.00 H ATOM 1664 HG2 MET A 120 3.725 -13.697 9.589 1.00 0.00 H ATOM 1665 HG3 MET A 120 3.898 -11.961 9.242 1.00 0.00 H ATOM 1666 HE1 MET A 120 5.411 -10.386 10.326 1.00 0.00 H ATOM 1667 HE2 MET A 120 4.173 -10.971 11.464 1.00 0.00 H ATOM 1668 HE3 MET A 120 5.849 -10.731 12.017 1.00 0.00 H ATOM 1669 H MET A 120 4.841 -13.713 5.158 1.00 0.00 H ATOM 1670 N PRO A 121 2.034 -14.570 6.744 1.00 0.59 N ATOM 1671 CA PRO A 121 0.620 -14.239 6.525 1.00 0.57 C ATOM 1672 C PRO A 121 0.136 -13.223 7.557 1.00 0.52 C ATOM 1673 O PRO A 121 0.212 -13.450 8.744 1.00 0.60 O ATOM 1674 CB PRO A 121 -0.131 -15.552 6.673 1.00 0.64 C ATOM 1675 CG PRO A 121 0.928 -16.599 6.251 1.00 0.69 C ATOM 1676 CD PRO A 121 2.327 -16.008 6.574 1.00 0.64 C ATOM 1677 HA PRO A 121 0.459 -13.789 5.545 1.00 0.00 H ATOM 1678 HD3 PRO A 121 2.735 -16.438 7.489 1.00 0.00 H ATOM 1679 HD2 PRO A 121 3.024 -16.174 5.753 1.00 0.00 H ATOM 1680 HG3 PRO A 121 0.847 -16.801 5.183 1.00 0.00 H ATOM 1681 HG2 PRO A 121 0.778 -17.525 6.807 1.00 0.00 H ATOM 1682 HB2 PRO A 121 -0.450 -15.709 7.703 1.00 0.00 H ATOM 1683 HB3 PRO A 121 -1.000 -15.584 6.016 1.00 0.00 H ATOM 1684 N ILE A 122 -0.359 -12.101 7.105 1.00 0.44 N ATOM 1685 CA ILE A 122 -0.850 -11.059 8.051 1.00 0.41 C ATOM 1686 C ILE A 122 -2.127 -10.431 7.487 1.00 0.40 C ATOM 1687 O ILE A 122 -2.225 -10.162 6.308 1.00 0.54 O ATOM 1688 CB ILE A 122 0.218 -9.973 8.219 1.00 0.41 C ATOM 1689 CG1 ILE A 122 0.704 -9.520 6.841 1.00 0.53 C ATOM 1690 CG2 ILE A 122 1.400 -10.528 9.017 1.00 0.51 C ATOM 1691 CD1 ILE A 122 1.578 -8.274 6.993 1.00 0.57 C ATOM 1692 HA ILE A 122 -1.058 -11.514 9.019 1.00 0.00 H ATOM 1693 HB ILE A 122 -0.212 -9.126 8.753 1.00 0.00 H ATOM 1694 HG12 ILE A 122 1.286 -10.318 6.380 1.00 0.00 H ATOM 1695 HG13 ILE A 122 -0.155 -9.287 6.211 1.00 0.00 H ATOM 1696 HD11 ILE A 122 0.995 -7.477 7.454 1.00 0.00 H ATOM 1697 HD12 ILE A 122 2.436 -8.508 7.623 1.00 0.00 H ATOM 1698 HD13 ILE A 122 1.924 -7.952 6.011 1.00 0.00 H ATOM 1699 HG21 ILE A 122 1.054 -10.850 9.999 1.00 0.00 H ATOM 1700 HG22 ILE A 122 1.829 -11.377 8.485 1.00 0.00 H ATOM 1701 HG23 ILE A 122 2.156 -9.751 9.133 1.00 0.00 H ATOM 1702 H ILE A 122 -0.411 -11.934 6.080 1.00 0.00 H ATOM 1703 N THR A 123 -3.105 -10.193 8.317 1.00 0.39 N ATOM 1704 CA THR A 123 -4.368 -9.580 7.816 1.00 0.40 C ATOM 1705 C THR A 123 -4.158 -8.075 7.650 1.00 0.39 C ATOM 1706 O THR A 123 -3.832 -7.379 8.589 1.00 0.52 O ATOM 1707 CB THR A 123 -5.495 -9.834 8.822 1.00 0.42 C ATOM 1708 OG1 THR A 123 -6.259 -10.956 8.401 1.00 0.67 O ATOM 1709 CG2 THR A 123 -6.398 -8.602 8.902 1.00 0.49 C ATOM 1710 HA THR A 123 -4.638 -10.022 6.857 1.00 0.00 H ATOM 1711 HB THR A 123 -5.067 -10.032 9.805 1.00 0.00 H ATOM 1712 HG1 THR A 123 -6.646 -10.774 7.508 1.00 0.00 H ATOM 1713 HG23 THR A 123 -5.810 -7.743 9.225 1.00 0.00 H ATOM 1714 HG21 THR A 123 -6.826 -8.402 7.920 1.00 0.00 H ATOM 1715 HG22 THR A 123 -7.199 -8.786 9.618 1.00 0.00 H ATOM 1716 H THR A 123 -3.004 -10.430 9.325 1.00 0.00 H ATOM 1717 N LEU A 124 -4.336 -7.565 6.461 1.00 0.34 N ATOM 1718 CA LEU A 124 -4.137 -6.103 6.243 1.00 0.36 C ATOM 1719 C LEU A 124 -5.425 -5.346 6.573 1.00 0.32 C ATOM 1720 O LEU A 124 -6.256 -5.111 5.718 1.00 0.35 O ATOM 1721 CB LEU A 124 -3.759 -5.850 4.783 1.00 0.42 C ATOM 1722 CG LEU A 124 -3.492 -4.359 4.577 1.00 0.47 C ATOM 1723 CD1 LEU A 124 -2.033 -4.152 4.167 1.00 0.60 C ATOM 1724 CD2 LEU A 124 -4.409 -3.825 3.475 1.00 0.60 C ATOM 1725 HA LEU A 124 -3.337 -5.751 6.894 1.00 0.00 H ATOM 1726 HB2 LEU A 124 -2.862 -6.418 4.536 1.00 0.00 H ATOM 1727 HB3 LEU A 124 -4.577 -6.166 4.136 1.00 0.00 H ATOM 1728 HG LEU A 124 -3.688 -3.824 5.506 1.00 0.00 H ATOM 1729 HD21 LEU A 124 -4.211 -4.362 2.547 1.00 0.00 H ATOM 1730 HD22 LEU A 124 -5.449 -3.972 3.767 1.00 0.00 H ATOM 1731 HD23 LEU A 124 -4.218 -2.762 3.329 1.00 0.00 H ATOM 1732 HD11 LEU A 124 -1.379 -4.533 4.951 1.00 0.00 H ATOM 1733 HD12 LEU A 124 -1.839 -4.688 3.238 1.00 0.00 H ATOM 1734 HD13 LEU A 124 -1.845 -3.088 4.021 1.00 0.00 H ATOM 1735 H LEU A 124 -4.616 -8.177 5.668 1.00 0.00 H ATOM 1736 N THR A 125 -5.597 -4.963 7.809 1.00 0.32 N ATOM 1737 CA THR A 125 -6.831 -4.223 8.194 1.00 0.32 C ATOM 1738 C THR A 125 -6.612 -2.716 8.043 1.00 0.35 C ATOM 1739 O THR A 125 -5.673 -2.152 8.577 1.00 0.47 O ATOM 1740 CB THR A 125 -7.203 -4.540 9.645 1.00 0.35 C ATOM 1741 OG1 THR A 125 -7.285 -5.949 9.813 1.00 0.37 O ATOM 1742 CG2 THR A 125 -8.557 -3.904 9.976 1.00 0.39 C ATOM 1743 HA THR A 125 -7.642 -4.536 7.537 1.00 0.00 H ATOM 1744 HB THR A 125 -6.442 -4.138 10.314 1.00 0.00 H ATOM 1745 HG1 THR A 125 -7.526 -6.155 10.751 1.00 0.00 H ATOM 1746 HG23 THR A 125 -8.491 -2.824 9.846 1.00 0.00 H ATOM 1747 HG21 THR A 125 -9.319 -4.306 9.308 1.00 0.00 H ATOM 1748 HG22 THR A 125 -8.821 -4.132 11.009 1.00 0.00 H ATOM 1749 H THR A 125 -4.873 -5.174 8.525 1.00 0.00 H ATOM 1750 N VAL A 126 -7.483 -2.062 7.322 1.00 0.32 N ATOM 1751 CA VAL A 126 -7.343 -0.587 7.131 1.00 0.36 C ATOM 1752 C VAL A 126 -8.560 0.120 7.727 1.00 0.43 C ATOM 1753 O VAL A 126 -9.678 -0.059 7.278 1.00 0.48 O ATOM 1754 CB VAL A 126 -7.253 -0.246 5.639 1.00 0.35 C ATOM 1755 CG1 VAL A 126 -6.490 1.067 5.462 1.00 0.42 C ATOM 1756 CG2 VAL A 126 -6.516 -1.364 4.897 1.00 0.37 C ATOM 1757 HA VAL A 126 -6.432 -0.256 7.630 1.00 0.00 H ATOM 1758 HB VAL A 126 -8.259 -0.144 5.232 1.00 0.00 H ATOM 1759 HG11 VAL A 126 -7.016 1.865 5.987 1.00 0.00 H ATOM 1760 HG12 VAL A 126 -5.486 0.960 5.872 1.00 0.00 H ATOM 1761 HG13 VAL A 126 -6.426 1.309 4.401 1.00 0.00 H ATOM 1762 HG21 VAL A 126 -5.511 -1.468 5.305 1.00 0.00 H ATOM 1763 HG22 VAL A 126 -7.059 -2.301 5.022 1.00 0.00 H ATOM 1764 HG23 VAL A 126 -6.455 -1.116 3.837 1.00 0.00 H ATOM 1765 H VAL A 126 -8.276 -2.569 6.880 1.00 0.00 H ATOM 1766 N SER A 127 -8.349 0.924 8.730 1.00 0.51 N ATOM 1767 CA SER A 127 -9.485 1.652 9.356 1.00 0.60 C ATOM 1768 C SER A 127 -9.277 3.151 9.148 1.00 0.64 C ATOM 1769 O SER A 127 -8.286 3.574 8.587 1.00 1.19 O ATOM 1770 CB SER A 127 -9.532 1.343 10.853 1.00 0.81 C ATOM 1771 OG SER A 127 -10.846 0.936 11.207 1.00 1.21 O ATOM 1772 HA SER A 127 -10.424 1.339 8.900 1.00 0.00 H ATOM 1773 HB2 SER A 127 -9.262 2.235 11.418 1.00 0.00 H ATOM 1774 HB3 SER A 127 -8.828 0.543 11.082 1.00 0.00 H ATOM 1775 HG SER A 127 -11.089 0.126 10.693 1.00 0.00 H ATOM 1776 H SER A 127 -7.384 1.057 9.094 1.00 0.00 H ATOM 1777 N THR A 128 -10.194 3.962 9.592 1.00 0.50 N ATOM 1778 CA THR A 128 -10.029 5.424 9.413 1.00 0.47 C ATOM 1779 C THR A 128 -8.824 5.880 10.230 1.00 0.63 C ATOM 1780 O THR A 128 -8.926 6.143 11.411 1.00 1.32 O ATOM 1781 CB THR A 128 -11.281 6.161 9.899 1.00 0.66 C ATOM 1782 OG1 THR A 128 -11.759 5.544 11.086 1.00 1.22 O ATOM 1783 CG2 THR A 128 -12.365 6.107 8.821 1.00 0.82 C ATOM 1784 HA THR A 128 -9.879 5.648 8.357 1.00 0.00 H ATOM 1785 HB THR A 128 -11.031 7.202 10.103 1.00 0.00 H ATOM 1786 HG1 THR A 128 -11.058 5.586 11.784 1.00 0.00 H ATOM 1787 HG23 THR A 128 -11.995 6.581 7.912 1.00 0.00 H ATOM 1788 HG21 THR A 128 -12.618 5.067 8.613 1.00 0.00 H ATOM 1789 HG22 THR A 128 -13.252 6.634 9.173 1.00 0.00 H ATOM 1790 H THR A 128 -11.038 3.586 10.070 1.00 0.00 H ATOM 1791 N SER A 129 -7.688 5.959 9.598 1.00 1.15 N ATOM 1792 CA SER A 129 -6.439 6.388 10.302 1.00 1.43 C ATOM 1793 C SER A 129 -5.958 5.258 11.210 1.00 0.83 C ATOM 1794 O SER A 129 -5.453 5.486 12.292 1.00 0.88 O ATOM 1795 CB SER A 129 -6.702 7.642 11.144 1.00 2.02 C ATOM 1796 OG SER A 129 -5.808 8.670 10.743 1.00 2.78 O ATOM 1797 HA SER A 129 -5.676 6.618 9.559 1.00 0.00 H ATOM 1798 HB2 SER A 129 -6.545 7.413 12.198 1.00 0.00 H ATOM 1799 HB3 SER A 129 -7.730 7.973 10.994 1.00 0.00 H ATOM 1800 HG SER A 129 -5.975 9.481 11.285 1.00 0.00 H ATOM 1801 H SER A 129 -7.648 5.720 8.587 1.00 0.00 H ATOM 1802 N SER A 130 -6.110 4.037 10.781 1.00 0.65 N ATOM 1803 CA SER A 130 -5.660 2.902 11.627 1.00 0.95 C ATOM 1804 C SER A 130 -5.281 1.709 10.746 1.00 0.78 C ATOM 1805 O SER A 130 -5.969 0.708 10.719 1.00 0.85 O ATOM 1806 CB SER A 130 -6.791 2.497 12.573 1.00 1.59 C ATOM 1807 OG SER A 130 -7.604 3.631 12.845 1.00 1.52 O ATOM 1808 HA SER A 130 -4.788 3.209 12.204 1.00 0.00 H ATOM 1809 HB2 SER A 130 -6.369 2.119 13.504 1.00 0.00 H ATOM 1810 HB3 SER A 130 -7.395 1.719 12.107 1.00 0.00 H ATOM 1811 HG SER A 130 -7.053 4.336 13.268 1.00 0.00 H ATOM 1812 H SER A 130 -6.543 3.858 9.853 1.00 0.00 H ATOM 1813 N LEU A 131 -4.190 1.799 10.032 1.00 0.61 N ATOM 1814 CA LEU A 131 -3.777 0.655 9.171 1.00 0.46 C ATOM 1815 C LEU A 131 -3.124 -0.395 10.068 1.00 0.42 C ATOM 1816 O LEU A 131 -1.923 -0.419 10.244 1.00 0.45 O ATOM 1817 CB LEU A 131 -2.776 1.125 8.108 1.00 0.39 C ATOM 1818 CG LEU A 131 -3.275 0.703 6.723 1.00 0.34 C ATOM 1819 CD1 LEU A 131 -2.580 1.529 5.637 1.00 0.40 C ATOM 1820 CD2 LEU A 131 -2.966 -0.777 6.500 1.00 0.37 C ATOM 1821 HA LEU A 131 -4.645 0.237 8.661 1.00 0.00 H ATOM 1822 HB2 LEU A 131 -2.685 2.210 8.148 1.00 0.00 H ATOM 1823 HB3 LEU A 131 -1.803 0.673 8.298 1.00 0.00 H ATOM 1824 HG LEU A 131 -4.351 0.871 6.669 1.00 0.00 H ATOM 1825 HD21 LEU A 131 -1.889 -0.936 6.563 1.00 0.00 H ATOM 1826 HD22 LEU A 131 -3.467 -1.371 7.264 1.00 0.00 H ATOM 1827 HD23 LEU A 131 -3.321 -1.077 5.514 1.00 0.00 H ATOM 1828 HD11 LEU A 131 -2.800 2.586 5.790 1.00 0.00 H ATOM 1829 HD12 LEU A 131 -1.503 1.369 5.693 1.00 0.00 H ATOM 1830 HD13 LEU A 131 -2.944 1.219 4.658 1.00 0.00 H ATOM 1831 H LEU A 131 -3.613 2.664 10.065 1.00 0.00 H ATOM 1832 N ASN A 132 -3.911 -1.259 10.645 1.00 0.43 N ATOM 1833 CA ASN A 132 -3.344 -2.304 11.540 1.00 0.43 C ATOM 1834 C ASN A 132 -3.201 -3.601 10.760 1.00 0.45 C ATOM 1835 O ASN A 132 -4.138 -4.058 10.149 1.00 0.54 O ATOM 1836 CB ASN A 132 -4.292 -2.535 12.717 1.00 0.53 C ATOM 1837 CG ASN A 132 -5.102 -1.266 12.989 1.00 1.79 C ATOM 1838 OD1 ASN A 132 -4.590 -0.170 12.885 1.00 2.63 O ATOM 1839 ND2 ASN A 132 -6.356 -1.369 13.335 1.00 2.34 N ATOM 1840 HA ASN A 132 -2.371 -1.980 11.910 1.00 0.00 H ATOM 1841 HB2 ASN A 132 -4.971 -3.354 12.479 1.00 0.00 H ATOM 1842 HB3 ASN A 132 -3.712 -2.791 13.604 1.00 0.00 H ATOM 1843 HD22 ASN A 132 -6.795 -2.307 13.424 1.00 0.00 H ATOM 1844 HD21 ASN A 132 -6.916 -0.513 13.521 1.00 0.00 H ATOM 1845 H ASN A 132 -4.937 -1.218 10.480 1.00 0.00 H ATOM 1846 N LEU A 133 -2.047 -4.203 10.773 1.00 0.46 N ATOM 1847 CA LEU A 133 -1.886 -5.474 10.020 1.00 0.53 C ATOM 1848 C LEU A 133 -1.853 -6.638 11.009 1.00 0.59 C ATOM 1849 O LEU A 133 -0.830 -6.954 11.566 1.00 1.22 O ATOM 1850 CB LEU A 133 -0.583 -5.430 9.218 1.00 0.57 C ATOM 1851 CG LEU A 133 -0.846 -4.796 7.847 1.00 0.63 C ATOM 1852 CD1 LEU A 133 -1.813 -3.619 7.997 1.00 1.07 C ATOM 1853 CD2 LEU A 133 0.473 -4.294 7.256 1.00 1.35 C ATOM 1854 HA LEU A 133 -2.721 -5.607 9.332 1.00 0.00 H ATOM 1855 HB2 LEU A 133 0.156 -4.837 9.757 1.00 0.00 H ATOM 1856 HB3 LEU A 133 -0.205 -6.443 9.083 1.00 0.00 H ATOM 1857 HG LEU A 133 -1.285 -5.543 7.185 1.00 0.00 H ATOM 1858 HD21 LEU A 133 0.909 -3.551 7.923 1.00 0.00 H ATOM 1859 HD22 LEU A 133 1.161 -5.132 7.144 1.00 0.00 H ATOM 1860 HD23 LEU A 133 0.285 -3.844 6.281 1.00 0.00 H ATOM 1861 HD11 LEU A 133 -2.754 -3.975 8.417 1.00 0.00 H ATOM 1862 HD12 LEU A 133 -1.376 -2.874 8.662 1.00 0.00 H ATOM 1863 HD13 LEU A 133 -1.995 -3.173 7.019 1.00 0.00 H ATOM 1864 H LEU A 133 -1.248 -3.800 11.303 1.00 0.00 H ATOM 1865 N MET A 134 -2.966 -7.277 11.238 1.00 0.54 N ATOM 1866 CA MET A 134 -2.975 -8.414 12.201 1.00 0.54 C ATOM 1867 C MET A 134 -1.916 -9.442 11.797 1.00 0.52 C ATOM 1868 O MET A 134 -1.518 -9.525 10.652 1.00 0.60 O ATOM 1869 CB MET A 134 -4.354 -9.068 12.217 1.00 0.57 C ATOM 1870 CG MET A 134 -4.854 -9.134 13.660 1.00 0.64 C ATOM 1871 SD MET A 134 -6.482 -9.919 13.701 1.00 0.86 S ATOM 1872 CE MET A 134 -5.918 -11.530 14.295 1.00 0.96 C ATOM 1873 HA MET A 134 -2.747 -8.040 13.199 1.00 0.00 H ATOM 1874 HB2 MET A 134 -5.046 -8.478 11.616 1.00 0.00 H ATOM 1875 HB3 MET A 134 -4.286 -10.075 11.806 1.00 0.00 H ATOM 1876 HG2 MET A 134 -4.927 -8.125 14.066 1.00 0.00 H ATOM 1877 HG3 MET A 134 -4.155 -9.716 14.260 1.00 0.00 H ATOM 1878 HE1 MET A 134 -5.211 -11.952 13.581 1.00 0.00 H ATOM 1879 HE2 MET A 134 -5.431 -11.409 15.262 1.00 0.00 H ATOM 1880 HE3 MET A 134 -6.774 -12.197 14.399 1.00 0.00 H ATOM 1881 H MET A 134 -3.841 -6.995 10.752 1.00 0.00 H ATOM 1882 N ALA A 135 -1.455 -10.221 12.734 1.00 0.68 N ATOM 1883 CA ALA A 135 -0.417 -11.243 12.420 1.00 0.68 C ATOM 1884 C ALA A 135 -1.040 -12.641 12.457 1.00 0.66 C ATOM 1885 O ALA A 135 -1.365 -13.163 13.507 1.00 0.71 O ATOM 1886 CB ALA A 135 0.710 -11.156 13.451 1.00 0.70 C ATOM 1887 HA ALA A 135 -0.015 -11.056 11.424 1.00 0.00 H ATOM 1888 HB1 ALA A 135 1.155 -10.162 13.418 1.00 0.00 H ATOM 1889 HB2 ALA A 135 0.305 -11.341 14.446 1.00 0.00 H ATOM 1890 HB3 ALA A 135 1.469 -11.904 13.221 1.00 0.00 H ATOM 1891 H ALA A 135 -1.813 -10.129 13.706 1.00 0.00 H ATOM 1892 N ALA A 136 -1.204 -13.246 11.312 1.00 0.62 N ATOM 1893 CA ALA A 136 -1.802 -14.611 11.245 1.00 0.63 C ATOM 1894 C ALA A 136 -0.696 -15.674 11.263 1.00 0.68 C ATOM 1895 O ALA A 136 -0.884 -16.778 10.790 1.00 1.25 O ATOM 1896 CB ALA A 136 -2.598 -14.748 9.942 1.00 0.66 C ATOM 1897 HA ALA A 136 -2.456 -14.755 12.105 1.00 0.00 H ATOM 1898 HB1 ALA A 136 -3.390 -13.999 9.921 1.00 0.00 H ATOM 1899 HB2 ALA A 136 -1.931 -14.598 9.093 1.00 0.00 H ATOM 1900 HB3 ALA A 136 -3.037 -15.744 9.889 1.00 0.00 H ATOM 1901 H ALA A 136 -0.914 -12.770 10.434 1.00 0.00 H ATOM 1902 N ASP A 137 0.454 -15.361 11.798 1.00 1.07 N ATOM 1903 CA ASP A 137 1.552 -16.367 11.830 1.00 1.19 C ATOM 1904 C ASP A 137 1.702 -16.926 13.247 1.00 0.99 C ATOM 1905 O ASP A 137 1.407 -18.076 13.505 1.00 1.00 O ATOM 1906 CB ASP A 137 2.863 -15.706 11.400 1.00 1.55 C ATOM 1907 CG ASP A 137 3.648 -16.665 10.504 1.00 2.00 C ATOM 1908 OD1 ASP A 137 3.390 -17.855 10.575 1.00 2.59 O ATOM 1909 OD2 ASP A 137 4.493 -16.193 9.761 1.00 2.31 O ATOM 1910 HA ASP A 137 1.313 -17.181 11.146 1.00 0.00 H ATOM 1911 HB2 ASP A 137 2.645 -14.791 10.850 1.00 0.00 H ATOM 1912 HB3 ASP A 137 3.456 -15.466 12.283 1.00 0.00 H ATOM 1913 H ASP A 137 0.602 -14.413 12.200 1.00 0.00 H ATOM 1914 N CYS A 138 2.160 -16.123 14.169 1.00 1.51 N ATOM 1915 CA CYS A 138 2.328 -16.615 15.566 1.00 1.71 C ATOM 1916 C CYS A 138 1.252 -15.996 16.460 1.00 1.35 C ATOM 1917 O CYS A 138 1.484 -15.710 17.618 1.00 1.76 O ATOM 1918 CB CYS A 138 3.712 -16.215 16.083 1.00 2.62 C ATOM 1919 SG CYS A 138 4.906 -17.511 15.672 1.00 3.69 S ATOM 1920 HA CYS A 138 2.232 -17.701 15.582 1.00 0.00 H ATOM 1921 HB2 CYS A 138 3.673 -16.086 17.165 1.00 0.00 H ATOM 1922 HB3 CYS A 138 4.017 -15.278 15.617 1.00 0.00 H ATOM 1923 HG CYS A 138 6.153 -17.150 16.138 1.00 0.00 H ATOM 1924 H CYS A 138 2.407 -15.142 13.929 1.00 0.00 H ATOM 1925 N LYS A 139 0.077 -15.788 15.931 1.00 1.22 N ATOM 1926 CA LYS A 139 -1.015 -15.188 16.749 1.00 2.02 C ATOM 1927 C LYS A 139 -0.530 -13.874 17.358 1.00 1.40 C ATOM 1928 O LYS A 139 -0.305 -13.771 18.547 1.00 1.46 O ATOM 1929 CB LYS A 139 -1.410 -16.156 17.863 1.00 3.15 C ATOM 1930 CG LYS A 139 -2.329 -17.233 17.286 1.00 4.30 C ATOM 1931 CD LYS A 139 -3.640 -17.270 18.075 1.00 5.20 C ATOM 1932 CE LYS A 139 -4.741 -16.579 17.268 1.00 5.92 C ATOM 1933 NZ LYS A 139 -4.784 -15.132 17.623 1.00 6.90 N ATOM 1934 HA LYS A 139 -1.881 -14.996 16.116 1.00 0.00 H ATOM 1935 HB2 LYS A 139 -0.516 -16.622 18.277 1.00 0.00 H ATOM 1936 HB3 LYS A 139 -1.933 -15.613 18.651 1.00 0.00 H ATOM 1937 HG2 LYS A 139 -2.541 -17.007 16.241 1.00 0.00 H ATOM 1938 HG3 LYS A 139 -1.837 -18.203 17.354 1.00 0.00 H ATOM 1939 HD2 LYS A 139 -3.922 -18.306 18.263 1.00 0.00 H ATOM 1940 HD3 LYS A 139 -3.507 -16.753 19.025 1.00 0.00 H ATOM 1941 HE2 LYS A 139 -5.703 -17.038 17.497 1.00 0.00 H ATOM 1942 HE3 LYS A 139 -4.533 -16.686 16.203 1.00 0.00 H ATOM 1943 HZ1 LYS A 139 -4.983 -15.031 18.639 1.00 0.00 H ATOM 1944 HZ2 LYS A 139 -3.866 -14.695 17.403 1.00 0.00 H ATOM 1945 HZ3 LYS A 139 -5.533 -14.664 17.074 1.00 0.00 H ATOM 1946 H LYS A 139 -0.097 -16.041 14.938 1.00 0.00 H ATOM 1947 N GLN A 140 -0.366 -12.868 16.547 1.00 0.95 N ATOM 1948 CA GLN A 140 0.106 -11.554 17.070 1.00 0.83 C ATOM 1949 C GLN A 140 -0.620 -10.431 16.327 1.00 0.74 C ATOM 1950 O GLN A 140 -1.675 -10.641 15.767 1.00 0.85 O ATOM 1951 CB GLN A 140 1.616 -11.432 16.843 1.00 1.25 C ATOM 1952 CG GLN A 140 2.299 -11.040 18.155 1.00 1.89 C ATOM 1953 CD GLN A 140 3.814 -11.187 18.005 1.00 2.48 C ATOM 1954 OE1 GLN A 140 4.396 -10.679 17.067 1.00 2.81 O ATOM 1955 NE2 GLN A 140 4.484 -11.865 18.897 1.00 3.19 N ATOM 1956 HA GLN A 140 -0.105 -11.481 18.137 1.00 0.00 H ATOM 1957 HB2 GLN A 140 2.010 -12.388 16.499 1.00 0.00 H ATOM 1958 HB3 GLN A 140 1.810 -10.668 16.090 1.00 0.00 H ATOM 1959 HG2 GLN A 140 2.056 -10.005 18.396 1.00 0.00 H ATOM 1960 HG3 GLN A 140 1.948 -11.690 18.956 1.00 0.00 H ATOM 1961 HE22 GLN A 140 3.987 -12.300 19.700 1.00 0.00 H ATOM 1962 HE21 GLN A 140 5.515 -11.970 18.804 1.00 0.00 H ATOM 1963 H GLN A 140 -0.565 -12.982 15.533 1.00 0.00 H ATOM 1964 N ILE A 141 -0.067 -9.245 16.316 1.00 0.73 N ATOM 1965 CA ILE A 141 -0.731 -8.113 15.604 1.00 0.65 C ATOM 1966 C ILE A 141 0.327 -7.078 15.208 1.00 0.65 C ATOM 1967 O ILE A 141 0.795 -6.317 16.029 1.00 0.77 O ATOM 1968 CB ILE A 141 -1.778 -7.460 16.522 1.00 0.68 C ATOM 1969 CG1 ILE A 141 -2.951 -8.432 16.708 1.00 1.02 C ATOM 1970 CG2 ILE A 141 -2.284 -6.149 15.899 1.00 0.81 C ATOM 1971 CD1 ILE A 141 -4.204 -7.672 17.150 1.00 1.05 C ATOM 1972 HA ILE A 141 -1.229 -8.488 14.710 1.00 0.00 H ATOM 1973 HB ILE A 141 -1.326 -7.235 17.488 1.00 0.00 H ATOM 1974 HG12 ILE A 141 -3.152 -8.939 15.764 1.00 0.00 H ATOM 1975 HG13 ILE A 141 -2.691 -9.170 17.467 1.00 0.00 H ATOM 1976 HD11 ILE A 141 -4.006 -7.166 18.095 1.00 0.00 H ATOM 1977 HD12 ILE A 141 -4.468 -6.936 16.391 1.00 0.00 H ATOM 1978 HD13 ILE A 141 -5.027 -8.375 17.278 1.00 0.00 H ATOM 1979 HG21 ILE A 141 -1.447 -5.464 15.767 1.00 0.00 H ATOM 1980 HG22 ILE A 141 -2.738 -6.360 14.931 1.00 0.00 H ATOM 1981 HG23 ILE A 141 -3.025 -5.697 16.559 1.00 0.00 H ATOM 1982 H ILE A 141 0.838 -9.090 16.805 1.00 0.00 H ATOM 1983 N ILE A 142 0.702 -7.042 13.956 1.00 0.68 N ATOM 1984 CA ILE A 142 1.722 -6.054 13.511 1.00 0.68 C ATOM 1985 C ILE A 142 1.141 -4.648 13.638 1.00 0.65 C ATOM 1986 O ILE A 142 0.496 -4.133 12.738 1.00 0.63 O ATOM 1987 CB ILE A 142 2.127 -6.324 12.056 1.00 0.73 C ATOM 1988 CG1 ILE A 142 2.937 -7.629 11.999 1.00 0.77 C ATOM 1989 CG2 ILE A 142 2.959 -5.151 11.521 1.00 0.77 C ATOM 1990 CD1 ILE A 142 4.355 -7.367 11.481 1.00 0.71 C ATOM 1991 HA ILE A 142 2.609 -6.144 14.137 1.00 0.00 H ATOM 1992 HB ILE A 142 1.237 -6.425 11.434 1.00 0.00 H ATOM 1993 HG12 ILE A 142 2.995 -8.058 12.999 1.00 0.00 H ATOM 1994 HG13 ILE A 142 2.437 -8.332 11.332 1.00 0.00 H ATOM 1995 HD11 ILE A 142 4.302 -6.942 10.479 1.00 0.00 H ATOM 1996 HD12 ILE A 142 4.860 -6.668 12.147 1.00 0.00 H ATOM 1997 HD13 ILE A 142 4.908 -8.306 11.450 1.00 0.00 H ATOM 1998 HG21 ILE A 142 2.367 -4.237 11.567 1.00 0.00 H ATOM 1999 HG22 ILE A 142 3.856 -5.036 12.130 1.00 0.00 H ATOM 2000 HG23 ILE A 142 3.243 -5.350 10.488 1.00 0.00 H ATOM 2001 H ILE A 142 0.287 -7.705 13.270 1.00 0.00 H ATOM 2002 N ALA A 143 1.378 -4.033 14.758 1.00 0.69 N ATOM 2003 CA ALA A 143 0.870 -2.654 15.001 1.00 0.70 C ATOM 2004 C ALA A 143 -0.658 -2.624 14.985 1.00 0.64 C ATOM 2005 O ALA A 143 -1.292 -2.998 14.019 1.00 0.85 O ATOM 2006 CB ALA A 143 1.407 -1.719 13.917 1.00 0.72 C ATOM 2007 HA ALA A 143 1.212 -2.326 15.983 1.00 0.00 H ATOM 2008 HB1 ALA A 143 2.497 -1.718 13.947 1.00 0.00 H ATOM 2009 HB2 ALA A 143 1.070 -2.066 12.940 1.00 0.00 H ATOM 2010 HB3 ALA A 143 1.036 -0.709 14.093 1.00 0.00 H ATOM 2011 H ALA A 143 1.932 -4.512 15.497 1.00 0.00 H ATOM 2012 N ASN A 144 -1.251 -2.166 16.052 1.00 0.62 N ATOM 2013 CA ASN A 144 -2.736 -2.091 16.110 1.00 0.64 C ATOM 2014 C ASN A 144 -3.205 -0.722 15.588 1.00 0.67 C ATOM 2015 O ASN A 144 -4.388 -0.454 15.515 1.00 0.97 O ATOM 2016 CB ASN A 144 -3.198 -2.270 17.558 1.00 0.72 C ATOM 2017 CG ASN A 144 -4.642 -2.774 17.577 1.00 1.26 C ATOM 2018 OD1 ASN A 144 -5.453 -2.359 16.773 1.00 2.09 O ATOM 2019 ND2 ASN A 144 -5.000 -3.658 18.467 1.00 1.82 N ATOM 2020 HA ASN A 144 -3.163 -2.880 15.490 1.00 0.00 H ATOM 2021 HB2 ASN A 144 -2.554 -2.994 18.058 1.00 0.00 H ATOM 2022 HB3 ASN A 144 -3.140 -1.314 18.078 1.00 0.00 H ATOM 2023 HD22 ASN A 144 -4.306 -4.013 19.155 1.00 0.00 H ATOM 2024 HD21 ASN A 144 -5.979 -4.007 18.488 1.00 0.00 H ATOM 2025 H ASN A 144 -0.684 -1.852 16.865 1.00 0.00 H ATOM 2026 N HIS A 145 -2.292 0.151 15.226 1.00 0.70 N ATOM 2027 CA HIS A 145 -2.699 1.490 14.716 1.00 0.75 C ATOM 2028 C HIS A 145 -1.566 2.074 13.866 1.00 0.71 C ATOM 2029 O HIS A 145 -1.117 3.180 14.090 1.00 1.01 O ATOM 2030 CB HIS A 145 -2.983 2.417 15.900 1.00 0.91 C ATOM 2031 CG HIS A 145 -2.170 1.977 17.086 1.00 1.52 C ATOM 2032 ND1 HIS A 145 -2.714 1.866 18.356 1.00 2.24 N ATOM 2033 CD2 HIS A 145 -0.851 1.614 17.210 1.00 2.45 C ATOM 2034 CE1 HIS A 145 -1.736 1.452 19.182 1.00 3.02 C ATOM 2035 NE2 HIS A 145 -0.580 1.283 18.534 1.00 3.22 N ATOM 2036 HA HIS A 145 -3.597 1.394 14.106 1.00 0.00 H ATOM 2037 HB2 HIS A 145 -2.715 3.439 15.634 1.00 0.00 H ATOM 2038 HB3 HIS A 145 -4.043 2.374 16.150 1.00 0.00 H ATOM 2039 HD2 HIS A 145 -0.127 1.589 16.395 1.00 0.00 H ATOM 2040 HE1 HIS A 145 -1.870 1.276 20.249 1.00 0.00 H ATOM 2041 H HIS A 145 -1.284 -0.093 15.296 1.00 0.00 H ATOM 2042 N HIS A 146 -1.100 1.339 12.891 1.00 0.74 N ATOM 2043 CA HIS A 146 0.004 1.853 12.028 1.00 0.67 C ATOM 2044 C HIS A 146 -0.532 2.968 11.124 1.00 0.73 C ATOM 2045 O HIS A 146 -0.979 2.723 10.021 1.00 1.31 O ATOM 2046 CB HIS A 146 0.551 0.712 11.160 1.00 0.61 C ATOM 2047 CG HIS A 146 2.010 0.490 11.465 1.00 0.68 C ATOM 2048 ND1 HIS A 146 2.860 1.533 11.800 1.00 0.93 N ATOM 2049 CD2 HIS A 146 2.785 -0.648 11.487 1.00 0.74 C ATOM 2050 CE1 HIS A 146 4.083 1.009 12.007 1.00 1.13 C ATOM 2051 NE2 HIS A 146 4.092 -0.314 11.829 1.00 1.02 N ATOM 2052 HA HIS A 146 0.803 2.246 12.657 1.00 0.00 H ATOM 2053 HB2 HIS A 146 -0.006 -0.201 11.370 1.00 0.00 H ATOM 2054 HB3 HIS A 146 0.437 0.971 10.107 1.00 0.00 H ATOM 2055 HD2 HIS A 146 2.430 -1.655 11.270 1.00 0.00 H ATOM 2056 HE1 HIS A 146 4.959 1.594 12.286 1.00 0.00 H ATOM 2057 H HIS A 146 -1.499 0.395 12.716 1.00 0.00 H ATOM 2058 N MET A 147 -0.490 4.192 11.581 1.00 0.57 N ATOM 2059 CA MET A 147 -0.997 5.319 10.745 1.00 0.58 C ATOM 2060 C MET A 147 -0.577 6.651 11.373 1.00 0.69 C ATOM 2061 O MET A 147 -1.395 7.415 11.845 1.00 1.70 O ATOM 2062 CB MET A 147 -2.526 5.251 10.661 1.00 0.60 C ATOM 2063 CG MET A 147 -2.983 5.658 9.257 1.00 0.96 C ATOM 2064 SD MET A 147 -4.050 4.367 8.570 1.00 1.39 S ATOM 2065 CE MET A 147 -3.278 4.280 6.936 1.00 0.55 C ATOM 2066 HA MET A 147 -0.577 5.242 9.742 1.00 0.00 H ATOM 2067 HB2 MET A 147 -2.856 4.233 10.869 1.00 0.00 H ATOM 2068 HB3 MET A 147 -2.960 5.930 11.395 1.00 0.00 H ATOM 2069 HG2 MET A 147 -2.112 5.789 8.615 1.00 0.00 H ATOM 2070 HG3 MET A 147 -3.536 6.595 9.312 1.00 0.00 H ATOM 2071 HE1 MET A 147 -3.352 5.252 6.448 1.00 0.00 H ATOM 2072 HE2 MET A 147 -2.229 4.006 7.045 1.00 0.00 H ATOM 2073 HE3 MET A 147 -3.790 3.530 6.333 1.00 0.00 H ATOM 2074 H MET A 147 -0.103 4.380 12.528 1.00 0.00 H ATOM 2075 N GLN A 148 0.695 6.935 11.382 1.00 0.65 N ATOM 2076 CA GLN A 148 1.166 8.218 11.979 1.00 0.61 C ATOM 2077 C GLN A 148 2.546 8.572 11.422 1.00 0.52 C ATOM 2078 O GLN A 148 2.823 9.712 11.118 1.00 0.62 O ATOM 2079 CB GLN A 148 1.253 8.072 13.500 1.00 0.69 C ATOM 2080 CG GLN A 148 -0.133 8.276 14.113 1.00 1.03 C ATOM 2081 CD GLN A 148 0.012 8.720 15.570 1.00 1.49 C ATOM 2082 OE1 GLN A 148 0.632 9.726 15.851 1.00 1.95 O ATOM 2083 NE2 GLN A 148 -0.538 8.006 16.514 1.00 1.99 N ATOM 2084 HA GLN A 148 0.462 9.011 11.728 1.00 0.00 H ATOM 2085 HB2 GLN A 148 1.618 7.075 13.749 1.00 0.00 H ATOM 2086 HB3 GLN A 148 1.940 8.819 13.898 1.00 0.00 H ATOM 2087 HG2 GLN A 148 -0.669 9.041 13.552 1.00 0.00 H ATOM 2088 HG3 GLN A 148 -0.690 7.340 14.072 1.00 0.00 H ATOM 2089 HE22 GLN A 148 -1.069 7.145 16.272 1.00 0.00 H ATOM 2090 HE21 GLN A 148 -0.446 8.298 17.508 1.00 0.00 H ATOM 2091 H GLN A 148 1.380 6.268 10.974 1.00 0.00 H ATOM 2092 N SER A 149 3.419 7.612 11.282 1.00 0.61 N ATOM 2093 CA SER A 149 4.771 7.923 10.740 1.00 0.58 C ATOM 2094 C SER A 149 4.853 7.449 9.283 1.00 0.57 C ATOM 2095 O SER A 149 4.575 8.202 8.370 1.00 0.60 O ATOM 2096 CB SER A 149 5.841 7.227 11.584 1.00 0.63 C ATOM 2097 OG SER A 149 6.039 7.956 12.788 1.00 0.98 O ATOM 2098 HA SER A 149 4.943 8.999 10.778 1.00 0.00 H ATOM 2099 HB2 SER A 149 6.776 7.186 11.025 1.00 0.00 H ATOM 2100 HB3 SER A 149 5.516 6.214 11.821 1.00 0.00 H ATOM 2101 HG SER A 149 6.731 7.506 13.335 1.00 0.00 H ATOM 2102 H SER A 149 3.172 6.637 11.547 1.00 0.00 H ATOM 2103 N ILE A 150 5.228 6.211 9.056 1.00 0.56 N ATOM 2104 CA ILE A 150 5.324 5.695 7.659 1.00 0.57 C ATOM 2105 C ILE A 150 6.162 6.668 6.814 1.00 0.61 C ATOM 2106 O ILE A 150 6.995 7.383 7.335 1.00 0.84 O ATOM 2107 CB ILE A 150 3.915 5.540 7.068 1.00 0.54 C ATOM 2108 CG1 ILE A 150 2.905 5.313 8.200 1.00 0.46 C ATOM 2109 CG2 ILE A 150 3.882 4.335 6.118 1.00 0.70 C ATOM 2110 CD1 ILE A 150 1.742 4.457 7.689 1.00 0.47 C ATOM 2111 HA ILE A 150 5.809 4.719 7.657 1.00 0.00 H ATOM 2112 HB ILE A 150 3.656 6.446 6.520 1.00 0.00 H ATOM 2113 HG12 ILE A 150 3.396 4.801 9.027 1.00 0.00 H ATOM 2114 HG13 ILE A 150 2.524 6.274 8.544 1.00 0.00 H ATOM 2115 HD11 ILE A 150 1.251 4.970 6.862 1.00 0.00 H ATOM 2116 HD12 ILE A 150 2.124 3.495 7.346 1.00 0.00 H ATOM 2117 HD13 ILE A 150 1.027 4.298 8.496 1.00 0.00 H ATOM 2118 HG21 ILE A 150 4.598 4.491 5.311 1.00 0.00 H ATOM 2119 HG22 ILE A 150 4.145 3.432 6.669 1.00 0.00 H ATOM 2120 HG23 ILE A 150 2.880 4.230 5.702 1.00 0.00 H ATOM 2121 H ILE A 150 5.459 5.586 9.855 1.00 0.00 H ATOM 2122 N SER A 151 5.961 6.709 5.521 1.00 0.57 N ATOM 2123 CA SER A 151 6.763 7.645 4.681 1.00 0.60 C ATOM 2124 C SER A 151 6.290 7.570 3.229 1.00 0.57 C ATOM 2125 O SER A 151 5.973 8.571 2.618 1.00 0.69 O ATOM 2126 CB SER A 151 8.240 7.259 4.757 1.00 0.66 C ATOM 2127 OG SER A 151 8.358 5.961 5.324 1.00 0.82 O ATOM 2128 HA SER A 151 6.632 8.662 5.050 1.00 0.00 H ATOM 2129 HB2 SER A 151 8.773 7.978 5.379 1.00 0.00 H ATOM 2130 HB3 SER A 151 8.669 7.259 3.755 1.00 0.00 H ATOM 2131 HG SER A 151 7.968 5.963 6.234 1.00 0.00 H ATOM 2132 H SER A 151 5.247 6.093 5.082 1.00 0.00 H ATOM 2133 N PHE A 152 6.239 6.393 2.671 1.00 0.53 N ATOM 2134 CA PHE A 152 5.785 6.261 1.257 1.00 0.51 C ATOM 2135 C PHE A 152 4.942 4.993 1.123 1.00 0.48 C ATOM 2136 O PHE A 152 5.246 3.975 1.708 1.00 0.73 O ATOM 2137 CB PHE A 152 7.008 6.171 0.334 1.00 0.57 C ATOM 2138 CG PHE A 152 6.728 6.876 -0.975 1.00 0.66 C ATOM 2139 CD1 PHE A 152 6.224 8.182 -0.978 1.00 1.30 C ATOM 2140 CD2 PHE A 152 6.978 6.222 -2.188 1.00 1.42 C ATOM 2141 CE1 PHE A 152 5.968 8.833 -2.190 1.00 1.41 C ATOM 2142 CE2 PHE A 152 6.723 6.874 -3.401 1.00 1.56 C ATOM 2143 CZ PHE A 152 6.218 8.179 -3.402 1.00 1.07 C ATOM 2144 HA PHE A 152 5.188 7.129 0.976 1.00 0.00 H ATOM 2145 HB2 PHE A 152 7.862 6.641 0.821 1.00 0.00 H ATOM 2146 HB3 PHE A 152 7.235 5.123 0.138 1.00 0.00 H ATOM 2147 HD2 PHE A 152 7.371 5.205 -2.188 1.00 0.00 H ATOM 2148 HE2 PHE A 152 6.918 6.365 -4.345 1.00 0.00 H ATOM 2149 HZ PHE A 152 6.019 8.686 -4.346 1.00 0.00 H ATOM 2150 HE1 PHE A 152 5.574 9.849 -2.190 1.00 0.00 H ATOM 2151 HD1 PHE A 152 6.031 8.693 -0.035 1.00 0.00 H ATOM 2152 H PHE A 152 6.514 5.548 3.211 1.00 0.00 H ATOM 2153 N ALA A 153 3.883 5.043 0.366 1.00 0.42 N ATOM 2154 CA ALA A 153 3.031 3.832 0.212 1.00 0.38 C ATOM 2155 C ALA A 153 2.496 3.757 -1.219 1.00 0.38 C ATOM 2156 O ALA A 153 2.167 4.758 -1.820 1.00 0.42 O ATOM 2157 CB ALA A 153 1.861 3.914 1.192 1.00 0.35 C ATOM 2158 HA ALA A 153 3.623 2.941 0.420 1.00 0.00 H ATOM 2159 HB1 ALA A 153 2.245 3.965 2.211 1.00 0.00 H ATOM 2160 HB2 ALA A 153 1.272 4.806 0.979 1.00 0.00 H ATOM 2161 HB3 ALA A 153 1.234 3.029 1.083 1.00 0.00 H ATOM 2162 H ALA A 153 3.634 5.924 -0.128 1.00 0.00 H ATOM 2163 N SER A 154 2.407 2.575 -1.766 1.00 0.39 N ATOM 2164 CA SER A 154 1.893 2.429 -3.157 1.00 0.42 C ATOM 2165 C SER A 154 1.828 0.944 -3.523 1.00 0.44 C ATOM 2166 O SER A 154 2.034 0.079 -2.694 1.00 0.48 O ATOM 2167 CB SER A 154 2.829 3.148 -4.130 1.00 0.49 C ATOM 2168 OG SER A 154 4.094 2.499 -4.130 1.00 0.59 O ATOM 2169 HA SER A 154 0.897 2.867 -3.221 1.00 0.00 H ATOM 2170 HB2 SER A 154 2.951 4.185 -3.819 1.00 0.00 H ATOM 2171 HB3 SER A 154 2.404 3.119 -5.133 1.00 0.00 H ATOM 2172 HG SER A 154 4.702 2.963 -4.759 1.00 0.00 H ATOM 2173 H SER A 154 2.696 1.732 -1.229 1.00 0.00 H ATOM 2174 N GLY A 155 1.544 0.642 -4.760 1.00 0.57 N ATOM 2175 CA GLY A 155 1.466 -0.785 -5.180 1.00 0.62 C ATOM 2176 C GLY A 155 0.367 -0.949 -6.231 1.00 0.48 C ATOM 2177 O GLY A 155 -0.637 -1.592 -5.997 1.00 1.08 O ATOM 2178 HA3 GLY A 155 1.237 -1.407 -4.314 1.00 0.00 H ATOM 2179 HA2 GLY A 155 2.422 -1.092 -5.603 1.00 0.00 H ATOM 2180 H GLY A 155 1.372 1.398 -5.453 1.00 0.00 H ATOM 2181 N GLY A 156 0.548 -0.372 -7.387 1.00 0.66 N ATOM 2182 CA GLY A 156 -0.488 -0.495 -8.452 1.00 0.53 C ATOM 2183 C GLY A 156 0.162 -0.979 -9.749 1.00 0.76 C ATOM 2184 O GLY A 156 0.659 -2.084 -9.831 1.00 1.20 O ATOM 2185 HA3 GLY A 156 -0.953 0.476 -8.620 1.00 0.00 H ATOM 2186 HA2 GLY A 156 -1.248 -1.211 -8.138 1.00 0.00 H ATOM 2187 H GLY A 156 1.415 0.174 -7.566 1.00 0.00 H ATOM 2188 N ASP A 157 0.160 -0.159 -10.765 1.00 1.29 N ATOM 2189 CA ASP A 157 0.775 -0.570 -12.059 1.00 1.85 C ATOM 2190 C ASP A 157 2.305 -0.643 -11.924 1.00 1.21 C ATOM 2191 O ASP A 157 2.885 -1.682 -12.171 1.00 1.24 O ATOM 2192 CB ASP A 157 0.393 0.430 -13.154 1.00 2.82 C ATOM 2193 CG ASP A 157 -0.699 -0.173 -14.039 1.00 3.83 C ATOM 2194 OD1 ASP A 157 -0.450 -1.212 -14.628 1.00 4.28 O ATOM 2195 OD2 ASP A 157 -1.766 0.415 -14.113 1.00 4.46 O ATOM 2196 HA ASP A 157 0.402 -1.558 -12.329 1.00 0.00 H ATOM 2197 HB2 ASP A 157 0.024 1.347 -12.696 1.00 0.00 H ATOM 2198 HB3 ASP A 157 1.269 0.656 -13.761 1.00 0.00 H ATOM 2199 H ASP A 157 -0.271 0.783 -10.671 1.00 0.00 H ATOM 2200 N PRO A 158 2.928 0.452 -11.540 1.00 0.92 N ATOM 2201 CA PRO A 158 4.386 0.507 -11.378 1.00 0.80 C ATOM 2202 C PRO A 158 4.802 -0.227 -10.099 1.00 0.95 C ATOM 2203 O PRO A 158 4.017 -0.929 -9.499 1.00 1.16 O ATOM 2204 CB PRO A 158 4.739 1.986 -11.281 1.00 1.20 C ATOM 2205 CG PRO A 158 3.435 2.619 -10.739 1.00 1.41 C ATOM 2206 CD PRO A 158 2.257 1.740 -11.230 1.00 1.24 C ATOM 2207 HA PRO A 158 4.903 0.028 -12.209 1.00 0.00 H ATOM 2208 HD3 PRO A 158 1.505 1.616 -10.450 1.00 0.00 H ATOM 2209 HD2 PRO A 158 1.790 2.166 -12.118 1.00 0.00 H ATOM 2210 HG3 PRO A 158 3.327 3.635 -11.120 1.00 0.00 H ATOM 2211 HG2 PRO A 158 3.456 2.641 -9.649 1.00 0.00 H ATOM 2212 HB2 PRO A 158 5.569 2.147 -10.593 1.00 0.00 H ATOM 2213 HB3 PRO A 158 4.996 2.393 -12.259 1.00 0.00 H ATOM 2214 N ASP A 159 6.036 -0.063 -9.690 1.00 1.09 N ATOM 2215 CA ASP A 159 6.540 -0.736 -8.454 1.00 1.33 C ATOM 2216 C ASP A 159 6.628 -2.249 -8.690 1.00 1.17 C ATOM 2217 O ASP A 159 7.670 -2.769 -9.036 1.00 1.42 O ATOM 2218 CB ASP A 159 5.608 -0.435 -7.273 1.00 1.53 C ATOM 2219 CG ASP A 159 6.329 0.472 -6.275 1.00 2.02 C ATOM 2220 OD1 ASP A 159 6.780 1.529 -6.684 1.00 2.56 O ATOM 2221 OD2 ASP A 159 6.418 0.094 -5.118 1.00 2.42 O ATOM 2222 HA ASP A 159 7.534 -0.355 -8.218 1.00 0.00 H ATOM 2223 HB2 ASP A 159 4.710 0.065 -7.636 1.00 0.00 H ATOM 2224 HB3 ASP A 159 5.330 -1.368 -6.782 1.00 0.00 H ATOM 2225 H ASP A 159 6.677 0.547 -10.236 1.00 0.00 H ATOM 2226 N THR A 160 5.549 -2.960 -8.511 1.00 0.93 N ATOM 2227 CA THR A 160 5.579 -4.433 -8.729 1.00 0.96 C ATOM 2228 C THR A 160 4.549 -4.814 -9.798 1.00 0.94 C ATOM 2229 O THR A 160 4.627 -5.868 -10.397 1.00 1.53 O ATOM 2230 CB THR A 160 5.242 -5.149 -7.420 1.00 1.04 C ATOM 2231 OG1 THR A 160 4.052 -4.597 -6.874 1.00 1.36 O ATOM 2232 CG2 THR A 160 6.392 -4.970 -6.429 1.00 1.21 C ATOM 2233 HA THR A 160 6.574 -4.730 -9.061 1.00 0.00 H ATOM 2234 HB THR A 160 5.095 -6.212 -7.613 1.00 0.00 H ATOM 2235 HG1 THR A 160 3.833 -5.060 -6.027 1.00 0.00 H ATOM 2236 HG23 THR A 160 7.303 -5.394 -6.851 1.00 0.00 H ATOM 2237 HG21 THR A 160 6.541 -3.908 -6.235 1.00 0.00 H ATOM 2238 HG22 THR A 160 6.150 -5.481 -5.497 1.00 0.00 H ATOM 2239 H THR A 160 4.666 -2.497 -8.215 1.00 0.00 H ATOM 2240 N ALA A 161 3.581 -3.968 -10.044 1.00 0.54 N ATOM 2241 CA ALA A 161 2.557 -4.285 -11.066 1.00 0.71 C ATOM 2242 C ALA A 161 1.814 -5.563 -10.669 1.00 0.77 C ATOM 2243 O ALA A 161 1.352 -6.310 -11.509 1.00 1.22 O ATOM 2244 CB ALA A 161 3.232 -4.481 -12.425 1.00 0.96 C ATOM 2245 HA ALA A 161 1.846 -3.462 -11.133 1.00 0.00 H ATOM 2246 HB1 ALA A 161 3.754 -3.566 -12.706 1.00 0.00 H ATOM 2247 HB2 ALA A 161 3.946 -5.302 -12.360 1.00 0.00 H ATOM 2248 HB3 ALA A 161 2.476 -4.714 -13.175 1.00 0.00 H ATOM 2249 H ALA A 161 3.531 -3.071 -9.520 1.00 0.00 H ATOM 2250 N GLU A 162 1.696 -5.821 -9.395 1.00 0.51 N ATOM 2251 CA GLU A 162 0.983 -7.049 -8.946 1.00 0.57 C ATOM 2252 C GLU A 162 0.990 -7.116 -7.416 1.00 0.54 C ATOM 2253 O GLU A 162 -0.028 -7.337 -6.792 1.00 0.66 O ATOM 2254 CB GLU A 162 1.686 -8.283 -9.514 1.00 0.61 C ATOM 2255 CG GLU A 162 0.640 -9.272 -10.033 1.00 0.81 C ATOM 2256 CD GLU A 162 1.285 -10.211 -11.054 1.00 1.08 C ATOM 2257 OE1 GLU A 162 2.060 -11.058 -10.643 1.00 1.47 O ATOM 2258 OE2 GLU A 162 0.993 -10.066 -12.230 1.00 1.81 O ATOM 2259 HA GLU A 162 -0.047 -7.021 -9.302 1.00 0.00 H ATOM 2260 HB2 GLU A 162 2.341 -7.984 -10.332 1.00 0.00 H ATOM 2261 HB3 GLU A 162 2.278 -8.757 -8.731 1.00 0.00 H ATOM 2262 HG2 GLU A 162 0.247 -9.855 -9.200 1.00 0.00 H ATOM 2263 HG3 GLU A 162 -0.174 -8.724 -10.507 1.00 0.00 H ATOM 2264 H GLU A 162 2.100 -5.169 -8.693 1.00 0.00 H ATOM 2265 N TYR A 163 2.129 -6.926 -6.807 1.00 0.45 N ATOM 2266 CA TYR A 163 2.193 -6.979 -5.318 1.00 0.47 C ATOM 2267 C TYR A 163 2.002 -5.573 -4.747 1.00 0.45 C ATOM 2268 O TYR A 163 1.725 -4.632 -5.464 1.00 0.57 O ATOM 2269 CB TYR A 163 3.557 -7.519 -4.878 1.00 0.53 C ATOM 2270 CG TYR A 163 4.063 -8.520 -5.889 1.00 0.49 C ATOM 2271 CD1 TYR A 163 3.222 -9.542 -6.344 1.00 1.21 C ATOM 2272 CD2 TYR A 163 5.375 -8.429 -6.367 1.00 1.27 C ATOM 2273 CE1 TYR A 163 3.693 -10.473 -7.278 1.00 1.21 C ATOM 2274 CE2 TYR A 163 5.847 -9.359 -7.301 1.00 1.28 C ATOM 2275 CZ TYR A 163 5.006 -10.381 -7.756 1.00 0.52 C ATOM 2276 OH TYR A 163 5.471 -11.298 -8.677 1.00 0.58 O ATOM 2277 HA TYR A 163 1.405 -7.636 -4.950 1.00 0.00 H ATOM 2278 HB3 TYR A 163 3.458 -8.004 -3.907 1.00 0.00 H ATOM 2279 HB2 TYR A 163 4.265 -6.694 -4.800 1.00 0.00 H ATOM 2280 HD2 TYR A 163 6.030 -7.633 -6.012 1.00 0.00 H ATOM 2281 HE2 TYR A 163 6.869 -9.287 -7.674 1.00 0.00 H ATOM 2282 HE1 TYR A 163 3.038 -11.269 -7.633 1.00 0.00 H ATOM 2283 HD1 TYR A 163 2.200 -9.613 -5.971 1.00 0.00 H ATOM 2284 HH TYR A 163 4.753 -11.946 -8.888 1.00 0.00 H ATOM 2285 H TYR A 163 2.990 -6.738 -7.359 1.00 0.00 H ATOM 2286 N VAL A 164 2.151 -5.424 -3.459 1.00 0.38 N ATOM 2287 CA VAL A 164 1.982 -4.080 -2.837 1.00 0.37 C ATOM 2288 C VAL A 164 3.258 -3.720 -2.071 1.00 0.38 C ATOM 2289 O VAL A 164 3.847 -4.551 -1.407 1.00 0.49 O ATOM 2290 CB VAL A 164 0.796 -4.107 -1.869 1.00 0.38 C ATOM 2291 CG1 VAL A 164 -0.509 -3.905 -2.645 1.00 0.39 C ATOM 2292 CG2 VAL A 164 0.755 -5.457 -1.151 1.00 0.45 C ATOM 2293 HA VAL A 164 1.795 -3.338 -3.613 1.00 0.00 H ATOM 2294 HB VAL A 164 0.910 -3.307 -1.138 1.00 0.00 H ATOM 2295 HG11 VAL A 164 -0.481 -2.943 -3.156 1.00 0.00 H ATOM 2296 HG12 VAL A 164 -0.622 -4.704 -3.378 1.00 0.00 H ATOM 2297 HG13 VAL A 164 -1.350 -3.925 -1.951 1.00 0.00 H ATOM 2298 HG21 VAL A 164 0.644 -6.255 -1.886 1.00 0.00 H ATOM 2299 HG22 VAL A 164 1.682 -5.600 -0.595 1.00 0.00 H ATOM 2300 HG23 VAL A 164 -0.090 -5.475 -0.462 1.00 0.00 H ATOM 2301 H VAL A 164 2.388 -6.244 -2.866 1.00 0.00 H ATOM 2302 N ALA A 165 3.693 -2.491 -2.153 1.00 0.35 N ATOM 2303 CA ALA A 165 4.932 -2.095 -1.423 1.00 0.37 C ATOM 2304 C ALA A 165 4.710 -0.759 -0.719 1.00 0.35 C ATOM 2305 O ALA A 165 4.238 0.193 -1.309 1.00 0.44 O ATOM 2306 CB ALA A 165 6.093 -1.953 -2.409 1.00 0.43 C ATOM 2307 HA ALA A 165 5.170 -2.863 -0.687 1.00 0.00 H ATOM 2308 HB1 ALA A 165 6.260 -2.906 -2.912 1.00 0.00 H ATOM 2309 HB2 ALA A 165 5.850 -1.189 -3.147 1.00 0.00 H ATOM 2310 HB3 ALA A 165 6.994 -1.664 -1.868 1.00 0.00 H ATOM 2311 H ALA A 165 3.178 -1.792 -2.725 1.00 0.00 H ATOM 2312 N TYR A 166 5.051 -0.676 0.536 1.00 0.33 N ATOM 2313 CA TYR A 166 4.863 0.606 1.270 1.00 0.34 C ATOM 2314 C TYR A 166 5.991 0.781 2.289 1.00 0.38 C ATOM 2315 O TYR A 166 6.110 0.040 3.244 1.00 0.41 O ATOM 2316 CB TYR A 166 3.496 0.615 1.974 1.00 0.35 C ATOM 2317 CG TYR A 166 3.462 -0.416 3.079 1.00 0.37 C ATOM 2318 CD1 TYR A 166 3.549 -1.779 2.775 1.00 1.25 C ATOM 2319 CD2 TYR A 166 3.343 -0.003 4.412 1.00 1.27 C ATOM 2320 CE1 TYR A 166 3.518 -2.728 3.803 1.00 1.28 C ATOM 2321 CE2 TYR A 166 3.312 -0.952 5.440 1.00 1.35 C ATOM 2322 CZ TYR A 166 3.399 -2.315 5.135 1.00 0.63 C ATOM 2323 OH TYR A 166 3.369 -3.252 6.148 1.00 0.79 O ATOM 2324 HA TYR A 166 4.892 1.435 0.563 1.00 0.00 H ATOM 2325 HB3 TYR A 166 2.716 0.388 1.247 1.00 0.00 H ATOM 2326 HB2 TYR A 166 3.318 1.603 2.399 1.00 0.00 H ATOM 2327 HD2 TYR A 166 3.274 1.059 4.649 1.00 0.00 H ATOM 2328 HE2 TYR A 166 3.220 -0.630 6.477 1.00 0.00 H ATOM 2329 HE1 TYR A 166 3.587 -3.790 3.566 1.00 0.00 H ATOM 2330 HD1 TYR A 166 3.641 -2.102 1.738 1.00 0.00 H ATOM 2331 HH TYR A 166 4.128 -3.095 6.764 1.00 0.00 H ATOM 2332 H TYR A 166 5.453 -1.502 1.023 1.00 0.00 H ATOM 2333 N VAL A 167 6.828 1.759 2.095 1.00 0.41 N ATOM 2334 CA VAL A 167 7.939 1.972 3.057 1.00 0.47 C ATOM 2335 C VAL A 167 7.367 2.613 4.323 1.00 0.51 C ATOM 2336 O VAL A 167 6.733 3.653 4.283 1.00 0.53 O ATOM 2337 CB VAL A 167 9.016 2.857 2.415 1.00 0.50 C ATOM 2338 CG1 VAL A 167 9.207 2.428 0.957 1.00 0.44 C ATOM 2339 CG2 VAL A 167 8.593 4.329 2.456 1.00 0.61 C ATOM 2340 HA VAL A 167 8.407 1.024 3.323 1.00 0.00 H ATOM 2341 HB VAL A 167 9.948 2.743 2.969 1.00 0.00 H ATOM 2342 HG11 VAL A 167 9.520 1.384 0.925 1.00 0.00 H ATOM 2343 HG12 VAL A 167 8.266 2.543 0.419 1.00 0.00 H ATOM 2344 HG13 VAL A 167 9.971 3.052 0.493 1.00 0.00 H ATOM 2345 HG21 VAL A 167 7.659 4.453 1.908 1.00 0.00 H ATOM 2346 HG22 VAL A 167 8.452 4.636 3.492 1.00 0.00 H ATOM 2347 HG23 VAL A 167 9.369 4.942 1.996 1.00 0.00 H ATOM 2348 H VAL A 167 6.719 2.386 1.273 1.00 0.00 H ATOM 2349 N ALA A 168 7.570 1.988 5.451 1.00 0.57 N ATOM 2350 CA ALA A 168 7.025 2.549 6.715 1.00 0.66 C ATOM 2351 C ALA A 168 8.150 3.168 7.547 1.00 0.48 C ATOM 2352 O ALA A 168 9.286 3.249 7.120 1.00 0.44 O ATOM 2353 CB ALA A 168 6.358 1.431 7.519 1.00 0.92 C ATOM 2354 HA ALA A 168 6.294 3.321 6.475 1.00 0.00 H ATOM 2355 HB1 ALA A 168 5.548 0.997 6.933 1.00 0.00 H ATOM 2356 HB2 ALA A 168 7.095 0.661 7.749 1.00 0.00 H ATOM 2357 HB3 ALA A 168 5.958 1.841 8.446 1.00 0.00 H ATOM 2358 H ALA A 168 8.111 1.100 5.465 1.00 0.00 H ATOM 2359 N LYS A 169 7.834 3.603 8.737 1.00 0.56 N ATOM 2360 CA LYS A 169 8.864 4.219 9.619 1.00 0.52 C ATOM 2361 C LYS A 169 8.243 4.479 10.992 1.00 0.59 C ATOM 2362 O LYS A 169 7.077 4.804 11.098 1.00 0.59 O ATOM 2363 CB LYS A 169 9.333 5.543 9.013 1.00 0.56 C ATOM 2364 CG LYS A 169 10.662 5.333 8.286 1.00 0.62 C ATOM 2365 CD LYS A 169 11.740 6.206 8.930 1.00 1.02 C ATOM 2366 CE LYS A 169 11.467 7.676 8.609 1.00 1.02 C ATOM 2367 NZ LYS A 169 11.290 8.438 9.877 1.00 1.44 N ATOM 2368 HA LYS A 169 9.717 3.548 9.717 1.00 0.00 H ATOM 2369 HB2 LYS A 169 8.586 5.904 8.306 1.00 0.00 H ATOM 2370 HB3 LYS A 169 9.466 6.279 9.806 1.00 0.00 H ATOM 2371 HG2 LYS A 169 10.953 4.285 8.356 1.00 0.00 H ATOM 2372 HG3 LYS A 169 10.550 5.608 7.237 1.00 0.00 H ATOM 2373 HD2 LYS A 169 11.727 6.062 10.010 1.00 0.00 H ATOM 2374 HD3 LYS A 169 12.718 5.924 8.539 1.00 0.00 H ATOM 2375 HE2 LYS A 169 10.561 7.755 8.008 1.00 0.00 H ATOM 2376 HE3 LYS A 169 12.308 8.088 8.051 1.00 0.00 H ATOM 2377 HZ1 LYS A 169 10.487 8.044 10.408 1.00 0.00 H ATOM 2378 HZ2 LYS A 169 12.155 8.363 10.449 1.00 0.00 H ATOM 2379 HZ3 LYS A 169 11.104 9.437 9.656 1.00 0.00 H ATOM 2380 H LYS A 169 6.853 3.518 9.072 1.00 0.00 H ATOM 2381 N ASP A 170 9.007 4.341 12.044 1.00 0.75 N ATOM 2382 CA ASP A 170 8.447 4.582 13.406 1.00 0.89 C ATOM 2383 C ASP A 170 9.483 4.230 14.487 1.00 1.24 C ATOM 2384 O ASP A 170 9.840 5.079 15.280 1.00 1.77 O ATOM 2385 CB ASP A 170 7.183 3.740 13.608 1.00 1.39 C ATOM 2386 CG ASP A 170 5.986 4.662 13.852 1.00 1.78 C ATOM 2387 OD1 ASP A 170 6.175 5.691 14.480 1.00 2.32 O ATOM 2388 OD2 ASP A 170 4.902 4.324 13.407 1.00 2.36 O ATOM 2389 HA ASP A 170 8.195 5.639 13.494 1.00 0.00 H ATOM 2390 HB2 ASP A 170 7.002 3.138 12.718 1.00 0.00 H ATOM 2391 HB3 ASP A 170 7.317 3.084 14.468 1.00 0.00 H ATOM 2392 H ASP A 170 10.003 4.064 11.932 1.00 0.00 H ATOM 2393 N PRO A 171 9.940 2.994 14.505 1.00 1.63 N ATOM 2394 CA PRO A 171 10.926 2.542 15.495 1.00 2.27 C ATOM 2395 C PRO A 171 12.301 3.150 15.204 1.00 1.78 C ATOM 2396 O PRO A 171 13.094 3.364 16.099 1.00 1.83 O ATOM 2397 CB PRO A 171 10.976 1.023 15.377 1.00 3.10 C ATOM 2398 CG PRO A 171 10.493 0.769 13.930 1.00 3.15 C ATOM 2399 CD PRO A 171 9.532 1.926 13.557 1.00 2.12 C ATOM 2400 HA PRO A 171 10.649 2.854 16.502 1.00 0.00 H ATOM 2401 HD3 PRO A 171 9.674 2.240 12.523 1.00 0.00 H ATOM 2402 HD2 PRO A 171 8.491 1.640 13.708 1.00 0.00 H ATOM 2403 HG3 PRO A 171 9.969 -0.185 13.873 1.00 0.00 H ATOM 2404 HG2 PRO A 171 11.344 0.756 13.249 1.00 0.00 H ATOM 2405 HB2 PRO A 171 11.991 0.652 15.522 1.00 0.00 H ATOM 2406 HB3 PRO A 171 10.311 0.552 16.101 1.00 0.00 H ATOM 2407 N VAL A 172 12.594 3.433 13.965 1.00 1.63 N ATOM 2408 CA VAL A 172 13.919 4.026 13.638 1.00 1.58 C ATOM 2409 C VAL A 172 13.738 5.116 12.584 1.00 1.90 C ATOM 2410 O VAL A 172 12.660 5.316 12.061 1.00 2.71 O ATOM 2411 CB VAL A 172 14.845 2.938 13.092 1.00 1.85 C ATOM 2412 CG1 VAL A 172 15.270 2.008 14.230 1.00 2.15 C ATOM 2413 CG2 VAL A 172 14.107 2.130 12.023 1.00 2.21 C ATOM 2414 HA VAL A 172 14.358 4.457 14.538 1.00 0.00 H ATOM 2415 HB VAL A 172 15.729 3.401 12.653 1.00 0.00 H ATOM 2416 HG11 VAL A 172 15.796 2.584 14.991 1.00 0.00 H ATOM 2417 HG12 VAL A 172 14.386 1.546 14.669 1.00 0.00 H ATOM 2418 HG13 VAL A 172 15.930 1.234 13.838 1.00 0.00 H ATOM 2419 HG21 VAL A 172 13.223 1.669 12.464 1.00 0.00 H ATOM 2420 HG22 VAL A 172 13.806 2.793 11.212 1.00 0.00 H ATOM 2421 HG23 VAL A 172 14.768 1.355 11.635 1.00 0.00 H ATOM 2422 H VAL A 172 11.905 3.245 13.209 1.00 0.00 H ATOM 2423 N ASN A 173 14.786 5.823 12.265 1.00 1.76 N ATOM 2424 CA ASN A 173 14.674 6.897 11.241 1.00 2.41 C ATOM 2425 C ASN A 173 15.145 6.353 9.892 1.00 1.89 C ATOM 2426 O ASN A 173 15.767 7.049 9.114 1.00 2.28 O ATOM 2427 CB ASN A 173 15.548 8.085 11.647 1.00 3.34 C ATOM 2428 CG ASN A 173 15.578 8.200 13.172 1.00 4.16 C ATOM 2429 OD1 ASN A 173 14.556 8.395 13.799 1.00 4.61 O ATOM 2430 ND2 ASN A 173 16.717 8.087 13.800 1.00 4.81 N ATOM 2431 HA ASN A 173 13.637 7.224 11.164 1.00 0.00 H ATOM 2432 HB2 ASN A 173 16.561 7.935 11.274 1.00 0.00 H ATOM 2433 HB3 ASN A 173 15.137 9.001 11.222 1.00 0.00 H ATOM 2434 HD22 ASN A 173 17.592 7.920 13.264 1.00 0.00 H ATOM 2435 HD21 ASN A 173 16.749 8.164 14.837 1.00 0.00 H ATOM 2436 H ASN A 173 15.700 5.637 12.726 1.00 0.00 H ATOM 2437 N GLN A 174 14.855 5.112 9.608 1.00 1.17 N ATOM 2438 CA GLN A 174 15.288 4.525 8.310 1.00 0.84 C ATOM 2439 C GLN A 174 14.073 3.972 7.567 1.00 0.69 C ATOM 2440 O GLN A 174 13.459 3.012 7.989 1.00 0.81 O ATOM 2441 CB GLN A 174 16.283 3.391 8.569 1.00 0.96 C ATOM 2442 CG GLN A 174 17.648 3.981 8.927 1.00 1.50 C ATOM 2443 CD GLN A 174 18.485 2.927 9.653 1.00 1.92 C ATOM 2444 OE1 GLN A 174 18.236 1.744 9.527 1.00 2.28 O ATOM 2445 NE2 GLN A 174 19.475 3.308 10.413 1.00 2.71 N ATOM 2446 HA GLN A 174 15.763 5.297 7.705 1.00 0.00 H ATOM 2447 HB2 GLN A 174 15.925 2.775 9.394 1.00 0.00 H ATOM 2448 HB3 GLN A 174 16.376 2.777 7.673 1.00 0.00 H ATOM 2449 HG2 GLN A 174 18.161 4.289 8.016 1.00 0.00 H ATOM 2450 HG3 GLN A 174 17.511 4.846 9.575 1.00 0.00 H ATOM 2451 HE22 GLN A 174 19.688 4.320 10.521 1.00 0.00 H ATOM 2452 HE21 GLN A 174 20.051 2.599 10.911 1.00 0.00 H ATOM 2453 H GLN A 174 14.322 4.534 10.288 1.00 0.00 H ATOM 2454 N ARG A 175 13.721 4.569 6.462 1.00 0.63 N ATOM 2455 CA ARG A 175 12.545 4.076 5.691 1.00 0.60 C ATOM 2456 C ARG A 175 12.731 2.588 5.382 1.00 0.54 C ATOM 2457 O ARG A 175 13.760 2.171 4.880 1.00 0.65 O ATOM 2458 CB ARG A 175 12.428 4.857 4.380 1.00 0.72 C ATOM 2459 CG ARG A 175 13.805 4.956 3.716 1.00 1.43 C ATOM 2460 CD ARG A 175 14.357 6.376 3.875 1.00 1.70 C ATOM 2461 NE ARG A 175 15.693 6.319 4.533 1.00 2.51 N ATOM 2462 CZ ARG A 175 16.353 7.420 4.771 1.00 3.18 C ATOM 2463 NH1 ARG A 175 15.716 8.493 5.155 1.00 3.65 N ATOM 2464 NH2 ARG A 175 17.649 7.448 4.626 1.00 3.88 N ATOM 2465 HA ARG A 175 11.638 4.218 6.279 1.00 0.00 H ATOM 2466 HB2 ARG A 175 11.739 4.342 3.711 1.00 0.00 H ATOM 2467 HB3 ARG A 175 12.052 5.859 4.587 1.00 0.00 H ATOM 2468 HG2 ARG A 175 14.486 4.248 4.188 1.00 0.00 H ATOM 2469 HG3 ARG A 175 13.714 4.720 2.656 1.00 0.00 H ATOM 2470 HD2 ARG A 175 13.675 6.965 4.488 1.00 0.00 H ATOM 2471 HD3 ARG A 175 14.455 6.840 2.894 1.00 0.00 H ATOM 2472 HE ARG A 175 16.100 5.401 4.803 1.00 0.00 H ATOM 2473 HH12 ARG A 175 16.242 9.370 5.345 1.00 0.00 H ATOM 2474 HH11 ARG A 175 14.683 8.471 5.271 1.00 0.00 H ATOM 2475 HH22 ARG A 175 18.175 8.325 4.816 1.00 0.00 H ATOM 2476 HH21 ARG A 175 18.157 6.593 4.321 1.00 0.00 H ATOM 2477 H ARG A 175 14.261 5.389 6.119 1.00 0.00 H ATOM 2478 N ALA A 176 11.746 1.783 5.678 1.00 0.49 N ATOM 2479 CA ALA A 176 11.868 0.323 5.401 1.00 0.55 C ATOM 2480 C ALA A 176 10.819 -0.089 4.365 1.00 0.72 C ATOM 2481 O ALA A 176 9.650 -0.217 4.670 1.00 0.81 O ATOM 2482 CB ALA A 176 11.641 -0.463 6.695 1.00 0.63 C ATOM 2483 HA ALA A 176 12.865 0.109 5.015 1.00 0.00 H ATOM 2484 HB1 ALA A 176 12.387 -0.169 7.433 1.00 0.00 H ATOM 2485 HB2 ALA A 176 10.644 -0.248 7.079 1.00 0.00 H ATOM 2486 HB3 ALA A 176 11.730 -1.530 6.491 1.00 0.00 H ATOM 2487 H ALA A 176 10.877 2.160 6.107 1.00 0.00 H ATOM 2488 N CYS A 177 11.228 -0.299 3.143 1.00 0.85 N ATOM 2489 CA CYS A 177 10.256 -0.704 2.090 1.00 1.07 C ATOM 2490 C CYS A 177 9.641 -2.057 2.454 1.00 0.44 C ATOM 2491 O CYS A 177 10.318 -3.066 2.500 1.00 0.53 O ATOM 2492 CB CYS A 177 10.980 -0.816 0.746 1.00 1.80 C ATOM 2493 SG CYS A 177 10.589 -2.409 -0.018 1.00 2.73 S ATOM 2494 HA CYS A 177 9.466 0.044 2.017 1.00 0.00 H ATOM 2495 HB2 CYS A 177 12.056 -0.743 0.905 1.00 0.00 H ATOM 2496 HB3 CYS A 177 10.656 -0.008 0.090 1.00 0.00 H ATOM 2497 HG CYS A 177 11.001 -3.430 0.814 1.00 0.00 H ATOM 2498 H CYS A 177 12.234 -0.183 2.905 1.00 0.00 H ATOM 2499 N HIS A 178 8.361 -2.087 2.713 1.00 0.42 N ATOM 2500 CA HIS A 178 7.701 -3.374 3.073 1.00 1.08 C ATOM 2501 C HIS A 178 7.197 -4.059 1.801 1.00 0.82 C ATOM 2502 O HIS A 178 6.442 -3.488 1.038 1.00 0.83 O ATOM 2503 CB HIS A 178 6.515 -3.101 4.000 1.00 1.87 C ATOM 2504 CG HIS A 178 6.962 -3.179 5.434 1.00 2.61 C ATOM 2505 ND1 HIS A 178 6.229 -3.852 6.399 1.00 3.40 N ATOM 2506 CD2 HIS A 178 8.061 -2.674 6.082 1.00 3.09 C ATOM 2507 CE1 HIS A 178 6.890 -3.735 7.565 1.00 4.02 C ATOM 2508 NE2 HIS A 178 8.014 -3.025 7.428 1.00 3.85 N ATOM 2509 HA HIS A 178 8.419 -4.019 3.580 1.00 0.00 H ATOM 2510 HB2 HIS A 178 6.118 -2.106 3.798 1.00 0.00 H ATOM 2511 HB3 HIS A 178 5.737 -3.844 3.822 1.00 0.00 H ATOM 2512 HD2 HIS A 178 8.851 -2.087 5.614 1.00 0.00 H ATOM 2513 HE1 HIS A 178 6.550 -4.167 8.506 1.00 0.00 H ATOM 2514 H HIS A 178 7.802 -1.211 2.668 1.00 0.00 H ATOM 2515 N ILE A 179 7.608 -5.278 1.568 1.00 0.69 N ATOM 2516 CA ILE A 179 7.152 -6.001 0.345 1.00 0.53 C ATOM 2517 C ILE A 179 6.177 -7.109 0.741 1.00 0.55 C ATOM 2518 O ILE A 179 6.518 -8.017 1.471 1.00 0.69 O ATOM 2519 CB ILE A 179 8.355 -6.626 -0.363 1.00 0.54 C ATOM 2520 CG1 ILE A 179 8.950 -5.616 -1.343 1.00 0.51 C ATOM 2521 CG2 ILE A 179 7.906 -7.873 -1.128 1.00 0.79 C ATOM 2522 CD1 ILE A 179 10.293 -5.125 -0.806 1.00 0.54 C ATOM 2523 HA ILE A 179 6.659 -5.296 -0.324 1.00 0.00 H ATOM 2524 HB ILE A 179 9.107 -6.903 0.376 1.00 0.00 H ATOM 2525 HG12 ILE A 179 9.097 -6.092 -2.313 1.00 0.00 H ATOM 2526 HG13 ILE A 179 8.270 -4.771 -1.453 1.00 0.00 H ATOM 2527 HD11 ILE A 179 10.143 -4.650 0.164 1.00 0.00 H ATOM 2528 HD12 ILE A 179 10.971 -5.972 -0.696 1.00 0.00 H ATOM 2529 HD13 ILE A 179 10.720 -4.404 -1.503 1.00 0.00 H ATOM 2530 HG21 ILE A 179 7.481 -8.593 -0.429 1.00 0.00 H ATOM 2531 HG22 ILE A 179 7.154 -7.594 -1.866 1.00 0.00 H ATOM 2532 HG23 ILE A 179 8.764 -8.317 -1.632 1.00 0.00 H ATOM 2533 H ILE A 179 8.254 -5.745 2.236 1.00 0.00 H ATOM 2534 N LEU A 180 4.967 -7.043 0.263 1.00 0.52 N ATOM 2535 CA LEU A 180 3.974 -8.097 0.614 1.00 0.58 C ATOM 2536 C LEU A 180 3.284 -8.593 -0.658 1.00 0.50 C ATOM 2537 O LEU A 180 3.130 -7.865 -1.620 1.00 0.45 O ATOM 2538 CB LEU A 180 2.926 -7.529 1.575 1.00 0.74 C ATOM 2539 CG LEU A 180 3.495 -6.314 2.310 1.00 0.72 C ATOM 2540 CD1 LEU A 180 3.313 -5.063 1.450 1.00 1.25 C ATOM 2541 CD2 LEU A 180 2.752 -6.131 3.636 1.00 1.44 C ATOM 2542 HA LEU A 180 4.490 -8.927 1.097 1.00 0.00 H ATOM 2543 HB2 LEU A 180 2.043 -7.229 1.011 1.00 0.00 H ATOM 2544 HB3 LEU A 180 2.649 -8.294 2.301 1.00 0.00 H ATOM 2545 HG LEU A 180 4.557 -6.470 2.502 1.00 0.00 H ATOM 2546 HD21 LEU A 180 1.692 -5.975 3.438 1.00 0.00 H ATOM 2547 HD22 LEU A 180 2.881 -7.023 4.249 1.00 0.00 H ATOM 2548 HD23 LEU A 180 3.156 -5.266 4.161 1.00 0.00 H ATOM 2549 HD11 LEU A 180 3.839 -5.194 0.504 1.00 0.00 H ATOM 2550 HD12 LEU A 180 2.251 -4.907 1.258 1.00 0.00 H ATOM 2551 HD13 LEU A 180 3.719 -4.199 1.977 1.00 0.00 H ATOM 2552 H LEU A 180 4.695 -6.257 -0.362 1.00 0.00 H ATOM 2553 N GLU A 181 2.868 -9.831 -0.670 1.00 0.56 N ATOM 2554 CA GLU A 181 2.191 -10.382 -1.877 1.00 0.57 C ATOM 2555 C GLU A 181 1.014 -11.262 -1.447 1.00 0.78 C ATOM 2556 O GLU A 181 0.745 -11.426 -0.275 1.00 0.94 O ATOM 2557 CB GLU A 181 3.191 -11.218 -2.675 1.00 0.76 C ATOM 2558 CG GLU A 181 4.503 -11.319 -1.893 1.00 1.43 C ATOM 2559 CD GLU A 181 5.447 -12.289 -2.603 1.00 1.89 C ATOM 2560 OE1 GLU A 181 5.246 -13.485 -2.469 1.00 2.52 O ATOM 2561 OE2 GLU A 181 6.355 -11.820 -3.269 1.00 2.36 O ATOM 2562 HA GLU A 181 1.821 -9.564 -2.496 1.00 0.00 H ATOM 2563 HB2 GLU A 181 2.785 -12.217 -2.836 1.00 0.00 H ATOM 2564 HB3 GLU A 181 3.376 -10.743 -3.638 1.00 0.00 H ATOM 2565 HG2 GLU A 181 4.969 -10.335 -1.836 1.00 0.00 H ATOM 2566 HG3 GLU A 181 4.299 -11.682 -0.886 1.00 0.00 H ATOM 2567 H GLU A 181 3.010 -10.434 0.166 1.00 0.00 H ATOM 2568 N CYS A 182 0.312 -11.828 -2.393 1.00 0.87 N ATOM 2569 CA CYS A 182 -0.853 -12.702 -2.060 1.00 1.17 C ATOM 2570 C CYS A 182 -1.798 -11.997 -1.075 1.00 0.87 C ATOM 2571 O CYS A 182 -2.066 -12.516 -0.011 1.00 0.78 O ATOM 2572 CB CYS A 182 -0.346 -14.001 -1.429 1.00 1.56 C ATOM 2573 SG CYS A 182 -1.542 -15.325 -1.731 1.00 2.49 S ATOM 2574 HA CYS A 182 -1.401 -12.918 -2.977 1.00 0.00 H ATOM 2575 HB2 CYS A 182 -0.223 -13.860 -0.355 1.00 0.00 H ATOM 2576 HB3 CYS A 182 0.613 -14.270 -1.871 1.00 0.00 H ATOM 2577 HG CYS A 182 -1.084 -16.495 -1.162 1.00 0.00 H ATOM 2578 H CYS A 182 0.567 -11.668 -3.388 1.00 0.00 H ATOM 2579 N PRO A 183 -2.280 -10.837 -1.458 1.00 0.78 N ATOM 2580 CA PRO A 183 -3.196 -10.042 -0.628 1.00 0.57 C ATOM 2581 C PRO A 183 -4.622 -10.608 -0.720 1.00 0.43 C ATOM 2582 O PRO A 183 -5.398 -10.511 0.218 1.00 0.36 O ATOM 2583 CB PRO A 183 -3.144 -8.639 -1.214 1.00 0.73 C ATOM 2584 CG PRO A 183 -2.821 -8.907 -2.703 1.00 0.91 C ATOM 2585 CD PRO A 183 -1.961 -10.194 -2.755 1.00 0.99 C ATOM 2586 HA PRO A 183 -2.914 -10.056 0.425 1.00 0.00 H ATOM 2587 HD3 PRO A 183 -2.250 -10.829 -3.593 1.00 0.00 H ATOM 2588 HD2 PRO A 183 -0.899 -9.958 -2.829 1.00 0.00 H ATOM 2589 HG3 PRO A 183 -2.266 -8.068 -3.123 1.00 0.00 H ATOM 2590 HG2 PRO A 183 -3.743 -9.049 -3.267 1.00 0.00 H ATOM 2591 HB2 PRO A 183 -4.102 -8.131 -1.104 1.00 0.00 H ATOM 2592 HB3 PRO A 183 -2.362 -8.044 -0.742 1.00 0.00 H ATOM 2593 N GLU A 184 -4.958 -11.196 -1.848 1.00 0.57 N ATOM 2594 CA GLU A 184 -6.322 -11.787 -2.054 1.00 0.50 C ATOM 2595 C GLU A 184 -7.348 -10.683 -2.340 1.00 0.49 C ATOM 2596 O GLU A 184 -7.978 -10.159 -1.443 1.00 0.77 O ATOM 2597 CB GLU A 184 -6.751 -12.580 -0.814 1.00 0.72 C ATOM 2598 CG GLU A 184 -7.820 -13.603 -1.204 1.00 0.91 C ATOM 2599 CD GLU A 184 -7.825 -14.747 -0.189 1.00 1.56 C ATOM 2600 OE1 GLU A 184 -8.466 -14.598 0.838 1.00 2.28 O ATOM 2601 OE2 GLU A 184 -7.188 -15.752 -0.456 1.00 2.11 O ATOM 2602 HA GLU A 184 -6.277 -12.459 -2.911 1.00 0.00 H ATOM 2603 HB2 GLU A 184 -5.887 -13.098 -0.398 1.00 0.00 H ATOM 2604 HB3 GLU A 184 -7.157 -11.896 -0.068 1.00 0.00 H ATOM 2605 HG2 GLU A 184 -8.798 -13.121 -1.214 1.00 0.00 H ATOM 2606 HG3 GLU A 184 -7.601 -13.998 -2.196 1.00 0.00 H ATOM 2607 H GLU A 184 -4.260 -11.253 -2.617 1.00 0.00 H ATOM 2608 N GLY A 185 -7.524 -10.333 -3.590 1.00 0.49 N ATOM 2609 CA GLY A 185 -8.512 -9.268 -3.946 1.00 0.70 C ATOM 2610 C GLY A 185 -8.067 -7.931 -3.352 1.00 0.69 C ATOM 2611 O GLY A 185 -8.631 -7.452 -2.389 1.00 1.19 O ATOM 2612 HA3 GLY A 185 -9.491 -9.534 -3.547 1.00 0.00 H ATOM 2613 HA2 GLY A 185 -8.575 -9.180 -5.031 1.00 0.00 H ATOM 2614 H GLY A 185 -6.973 -10.799 -4.339 1.00 0.00 H ATOM 2615 N LEU A 186 -7.055 -7.328 -3.914 1.00 0.37 N ATOM 2616 CA LEU A 186 -6.570 -6.032 -3.376 1.00 0.54 C ATOM 2617 C LEU A 186 -6.021 -5.153 -4.515 1.00 0.45 C ATOM 2618 O LEU A 186 -6.770 -4.434 -5.140 1.00 0.42 O ATOM 2619 CB LEU A 186 -5.488 -6.335 -2.342 1.00 0.75 C ATOM 2620 CG LEU A 186 -6.151 -6.496 -0.977 1.00 1.01 C ATOM 2621 CD1 LEU A 186 -6.507 -7.964 -0.747 1.00 1.73 C ATOM 2622 CD2 LEU A 186 -5.196 -6.024 0.123 1.00 1.50 C ATOM 2623 HA LEU A 186 -7.385 -5.480 -2.907 1.00 0.00 H ATOM 2624 HB2 LEU A 186 -4.971 -7.256 -2.610 1.00 0.00 H ATOM 2625 HB3 LEU A 186 -4.772 -5.514 -2.308 1.00 0.00 H ATOM 2626 HG LEU A 186 -7.059 -5.894 -0.949 1.00 0.00 H ATOM 2627 HD21 LEU A 186 -4.285 -6.621 0.092 1.00 0.00 H ATOM 2628 HD22 LEU A 186 -4.950 -4.974 -0.037 1.00 0.00 H ATOM 2629 HD23 LEU A 186 -5.676 -6.142 1.094 1.00 0.00 H ATOM 2630 HD11 LEU A 186 -7.195 -8.296 -1.525 1.00 0.00 H ATOM 2631 HD12 LEU A 186 -5.599 -8.566 -0.782 1.00 0.00 H ATOM 2632 HD13 LEU A 186 -6.980 -8.073 0.229 1.00 0.00 H ATOM 2633 H LEU A 186 -6.588 -7.756 -4.739 1.00 0.00 H ATOM 2634 N ALA A 187 -4.730 -5.213 -4.780 1.00 0.45 N ATOM 2635 CA ALA A 187 -4.098 -4.398 -5.875 1.00 0.41 C ATOM 2636 C ALA A 187 -4.708 -2.984 -5.995 1.00 0.40 C ATOM 2637 O ALA A 187 -4.260 -2.052 -5.352 1.00 0.42 O ATOM 2638 CB ALA A 187 -4.242 -5.146 -7.203 1.00 0.40 C ATOM 2639 HA ALA A 187 -3.046 -4.265 -5.624 1.00 0.00 H ATOM 2640 HB1 ALA A 187 -3.743 -6.113 -7.130 1.00 0.00 H ATOM 2641 HB2 ALA A 187 -5.299 -5.297 -7.421 1.00 0.00 H ATOM 2642 HB3 ALA A 187 -3.785 -4.559 -8.000 1.00 0.00 H ATOM 2643 H ALA A 187 -4.129 -5.845 -4.213 1.00 0.00 H ATOM 2644 N GLN A 188 -5.717 -2.806 -6.813 1.00 0.40 N ATOM 2645 CA GLN A 188 -6.322 -1.451 -6.963 1.00 0.40 C ATOM 2646 C GLN A 188 -7.200 -1.121 -5.756 1.00 0.38 C ATOM 2647 O GLN A 188 -7.087 -0.064 -5.173 1.00 0.37 O ATOM 2648 CB GLN A 188 -7.172 -1.409 -8.232 1.00 0.46 C ATOM 2649 CG GLN A 188 -6.268 -1.556 -9.457 1.00 1.09 C ATOM 2650 CD GLN A 188 -7.098 -1.371 -10.728 1.00 1.60 C ATOM 2651 OE1 GLN A 188 -7.824 -0.405 -10.859 1.00 2.19 O ATOM 2652 NE2 GLN A 188 -7.022 -2.263 -11.678 1.00 2.03 N ATOM 2653 HA GLN A 188 -5.520 -0.716 -7.029 1.00 0.00 H ATOM 2654 HB2 GLN A 188 -7.894 -2.225 -8.213 1.00 0.00 H ATOM 2655 HB3 GLN A 188 -7.702 -0.458 -8.283 1.00 0.00 H ATOM 2656 HG2 GLN A 188 -5.483 -0.801 -9.422 1.00 0.00 H ATOM 2657 HG3 GLN A 188 -5.816 -2.548 -9.459 1.00 0.00 H ATOM 2658 HE22 GLN A 188 -6.401 -3.090 -11.567 1.00 0.00 H ATOM 2659 HE21 GLN A 188 -7.582 -2.147 -12.546 1.00 0.00 H ATOM 2660 H GLN A 188 -6.095 -3.608 -7.356 1.00 0.00 H ATOM 2661 N ASP A 189 -8.078 -2.007 -5.377 1.00 0.40 N ATOM 2662 CA ASP A 189 -8.955 -1.720 -4.209 1.00 0.40 C ATOM 2663 C ASP A 189 -8.090 -1.472 -2.967 1.00 0.35 C ATOM 2664 O ASP A 189 -8.333 -0.553 -2.203 1.00 0.36 O ATOM 2665 CB ASP A 189 -9.888 -2.908 -3.968 1.00 0.44 C ATOM 2666 CG ASP A 189 -11.273 -2.593 -4.537 1.00 0.94 C ATOM 2667 OD1 ASP A 189 -11.365 -2.384 -5.735 1.00 1.58 O ATOM 2668 OD2 ASP A 189 -12.217 -2.566 -3.764 1.00 1.58 O ATOM 2669 HA ASP A 189 -9.553 -0.831 -4.410 1.00 0.00 H ATOM 2670 HB2 ASP A 189 -9.485 -3.793 -4.461 1.00 0.00 H ATOM 2671 HB3 ASP A 189 -9.969 -3.095 -2.897 1.00 0.00 H ATOM 2672 H ASP A 189 -8.165 -2.909 -5.888 1.00 0.00 H ATOM 2673 N VAL A 190 -7.078 -2.274 -2.749 1.00 0.33 N ATOM 2674 CA VAL A 190 -6.220 -2.051 -1.546 1.00 0.30 C ATOM 2675 C VAL A 190 -5.549 -0.686 -1.644 1.00 0.29 C ATOM 2676 O VAL A 190 -5.445 0.029 -0.673 1.00 0.27 O ATOM 2677 CB VAL A 190 -5.151 -3.133 -1.435 1.00 0.29 C ATOM 2678 CG1 VAL A 190 -4.255 -3.106 -2.666 1.00 0.36 C ATOM 2679 CG2 VAL A 190 -4.302 -2.884 -0.188 1.00 0.45 C ATOM 2680 HA VAL A 190 -6.852 -2.092 -0.659 1.00 0.00 H ATOM 2681 HB VAL A 190 -5.635 -4.107 -1.363 1.00 0.00 H ATOM 2682 HG11 VAL A 190 -4.858 -3.286 -3.556 1.00 0.00 H ATOM 2683 HG12 VAL A 190 -3.774 -2.131 -2.742 1.00 0.00 H ATOM 2684 HG13 VAL A 190 -3.495 -3.882 -2.578 1.00 0.00 H ATOM 2685 HG21 VAL A 190 -3.825 -1.907 -0.264 1.00 0.00 H ATOM 2686 HG22 VAL A 190 -4.940 -2.910 0.695 1.00 0.00 H ATOM 2687 HG23 VAL A 190 -3.538 -3.658 -0.110 1.00 0.00 H ATOM 2688 H VAL A 190 -6.874 -3.056 -3.404 1.00 0.00 H ATOM 2689 N ILE A 191 -5.091 -0.310 -2.806 1.00 0.32 N ATOM 2690 CA ILE A 191 -4.435 1.019 -2.935 1.00 0.33 C ATOM 2691 C ILE A 191 -5.430 2.103 -2.504 1.00 0.33 C ATOM 2692 O ILE A 191 -5.070 3.091 -1.890 1.00 0.33 O ATOM 2693 CB ILE A 191 -4.018 1.238 -4.393 1.00 0.37 C ATOM 2694 CG1 ILE A 191 -2.773 0.398 -4.697 1.00 0.45 C ATOM 2695 CG2 ILE A 191 -3.707 2.716 -4.632 1.00 0.39 C ATOM 2696 CD1 ILE A 191 -1.547 1.028 -4.029 1.00 0.54 C ATOM 2697 HA ILE A 191 -3.549 1.066 -2.302 1.00 0.00 H ATOM 2698 HB ILE A 191 -4.835 0.936 -5.048 1.00 0.00 H ATOM 2699 HG12 ILE A 191 -2.915 -0.612 -4.314 1.00 0.00 H ATOM 2700 HG13 ILE A 191 -2.618 0.358 -5.775 1.00 0.00 H ATOM 2701 HD11 ILE A 191 -1.404 2.038 -4.413 1.00 0.00 H ATOM 2702 HD12 ILE A 191 -1.702 1.067 -2.951 1.00 0.00 H ATOM 2703 HD13 ILE A 191 -0.665 0.426 -4.249 1.00 0.00 H ATOM 2704 HG21 ILE A 191 -4.595 3.312 -4.419 1.00 0.00 H ATOM 2705 HG22 ILE A 191 -2.894 3.026 -3.976 1.00 0.00 H ATOM 2706 HG23 ILE A 191 -3.412 2.860 -5.671 1.00 0.00 H ATOM 2707 H ILE A 191 -5.183 -0.933 -3.634 1.00 0.00 H ATOM 2708 N SER A 192 -6.684 1.919 -2.821 1.00 0.37 N ATOM 2709 CA SER A 192 -7.714 2.924 -2.438 1.00 0.40 C ATOM 2710 C SER A 192 -7.894 2.931 -0.918 1.00 0.39 C ATOM 2711 O SER A 192 -8.220 3.941 -0.332 1.00 0.43 O ATOM 2712 CB SER A 192 -9.045 2.569 -3.105 1.00 0.44 C ATOM 2713 OG SER A 192 -10.001 3.580 -2.812 1.00 1.14 O ATOM 2714 HA SER A 192 -7.390 3.912 -2.766 1.00 0.00 H ATOM 2715 HB2 SER A 192 -9.399 1.611 -2.725 1.00 0.00 H ATOM 2716 HB3 SER A 192 -8.905 2.501 -4.184 1.00 0.00 H ATOM 2717 HG SER A 192 -10.126 3.640 -1.832 1.00 0.00 H ATOM 2718 H SER A 192 -6.965 1.065 -3.344 1.00 0.00 H ATOM 2719 N THR A 193 -7.693 1.813 -0.274 1.00 0.38 N ATOM 2720 CA THR A 193 -7.863 1.777 1.216 1.00 0.39 C ATOM 2721 C THR A 193 -6.719 2.525 1.898 1.00 0.35 C ATOM 2722 O THR A 193 -6.936 3.476 2.623 1.00 0.41 O ATOM 2723 CB THR A 193 -7.870 0.336 1.737 1.00 0.41 C ATOM 2724 OG1 THR A 193 -7.722 -0.578 0.664 1.00 0.77 O ATOM 2725 CG2 THR A 193 -9.189 0.077 2.452 1.00 0.69 C ATOM 2726 HA THR A 193 -8.817 2.252 1.446 1.00 0.00 H ATOM 2727 HB THR A 193 -7.037 0.198 2.427 1.00 0.00 H ATOM 2728 HG1 THR A 193 -6.864 -0.406 0.201 1.00 0.00 H ATOM 2729 HG23 THR A 193 -9.299 0.782 3.276 1.00 0.00 H ATOM 2730 HG21 THR A 193 -10.013 0.206 1.750 1.00 0.00 H ATOM 2731 HG22 THR A 193 -9.197 -0.942 2.840 1.00 0.00 H ATOM 2732 H THR A 193 -7.417 0.954 -0.790 1.00 0.00 H ATOM 2733 N ILE A 194 -5.505 2.094 1.681 1.00 0.33 N ATOM 2734 CA ILE A 194 -4.342 2.769 2.319 1.00 0.32 C ATOM 2735 C ILE A 194 -4.410 4.273 2.050 1.00 0.33 C ATOM 2736 O ILE A 194 -4.095 5.071 2.903 1.00 0.36 O ATOM 2737 CB ILE A 194 -3.044 2.189 1.757 1.00 0.32 C ATOM 2738 CG1 ILE A 194 -2.985 0.694 2.079 1.00 0.37 C ATOM 2739 CG2 ILE A 194 -1.849 2.891 2.404 1.00 0.34 C ATOM 2740 CD1 ILE A 194 -2.254 -0.046 0.960 1.00 0.36 C ATOM 2741 HA ILE A 194 -4.368 2.602 3.396 1.00 0.00 H ATOM 2742 HB ILE A 194 -3.012 2.338 0.678 1.00 0.00 H ATOM 2743 HG12 ILE A 194 -2.453 0.546 3.019 1.00 0.00 H ATOM 2744 HG13 ILE A 194 -3.998 0.303 2.171 1.00 0.00 H ATOM 2745 HD11 ILE A 194 -2.787 0.101 0.020 1.00 0.00 H ATOM 2746 HD12 ILE A 194 -1.240 0.345 0.869 1.00 0.00 H ATOM 2747 HD13 ILE A 194 -2.215 -1.110 1.195 1.00 0.00 H ATOM 2748 HG21 ILE A 194 -1.895 3.958 2.187 1.00 0.00 H ATOM 2749 HG22 ILE A 194 -1.879 2.737 3.483 1.00 0.00 H ATOM 2750 HG23 ILE A 194 -0.924 2.476 2.002 1.00 0.00 H ATOM 2751 H ILE A 194 -5.350 1.275 1.059 1.00 0.00 H ATOM 2752 N GLY A 195 -4.828 4.672 0.877 1.00 0.34 N ATOM 2753 CA GLY A 195 -4.917 6.134 0.587 1.00 0.37 C ATOM 2754 C GLY A 195 -6.021 6.741 1.457 1.00 0.37 C ATOM 2755 O GLY A 195 -5.894 7.834 1.982 1.00 0.39 O ATOM 2756 HA3 GLY A 195 -5.154 6.286 -0.466 1.00 0.00 H ATOM 2757 HA2 GLY A 195 -3.965 6.612 0.816 1.00 0.00 H ATOM 2758 H GLY A 195 -5.096 3.977 0.152 1.00 0.00 H ATOM 2759 N GLN A 196 -7.105 6.033 1.616 1.00 0.37 N ATOM 2760 CA GLN A 196 -8.221 6.551 2.450 1.00 0.38 C ATOM 2761 C GLN A 196 -7.708 6.805 3.866 1.00 0.37 C ATOM 2762 O GLN A 196 -7.555 7.934 4.278 1.00 0.43 O ATOM 2763 CB GLN A 196 -9.352 5.522 2.491 1.00 0.41 C ATOM 2764 CG GLN A 196 -10.049 5.477 1.130 1.00 0.91 C ATOM 2765 CD GLN A 196 -11.224 6.457 1.125 1.00 1.05 C ATOM 2766 OE1 GLN A 196 -11.866 6.659 2.137 1.00 1.61 O ATOM 2767 NE2 GLN A 196 -11.534 7.077 0.020 1.00 1.67 N ATOM 2768 HA GLN A 196 -8.598 7.480 2.023 1.00 0.00 H ATOM 2769 HB2 GLN A 196 -8.941 4.539 2.722 1.00 0.00 H ATOM 2770 HB3 GLN A 196 -10.072 5.803 3.259 1.00 0.00 H ATOM 2771 HG2 GLN A 196 -9.341 5.755 0.350 1.00 0.00 H ATOM 2772 HG3 GLN A 196 -10.416 4.468 0.943 1.00 0.00 H ATOM 2773 HE22 GLN A 196 -10.984 6.904 -0.845 1.00 0.00 H ATOM 2774 HE21 GLN A 196 -12.331 7.745 0.004 1.00 0.00 H ATOM 2775 H GLN A 196 -7.189 5.103 1.158 1.00 0.00 H ATOM 2776 N ALA A 197 -7.439 5.763 4.614 1.00 0.31 N ATOM 2777 CA ALA A 197 -6.933 5.951 6.006 1.00 0.30 C ATOM 2778 C ALA A 197 -5.721 6.899 6.010 1.00 0.31 C ATOM 2779 O ALA A 197 -5.427 7.538 7.001 1.00 0.33 O ATOM 2780 CB ALA A 197 -6.525 4.593 6.581 1.00 0.29 C ATOM 2781 HA ALA A 197 -7.722 6.389 6.617 1.00 0.00 H ATOM 2782 HB1 ALA A 197 -7.390 3.930 6.592 1.00 0.00 H ATOM 2783 HB2 ALA A 197 -5.740 4.158 5.962 1.00 0.00 H ATOM 2784 HB3 ALA A 197 -6.155 4.727 7.598 1.00 0.00 H ATOM 2785 H ALA A 197 -7.578 4.804 4.237 1.00 0.00 H ATOM 2786 N PHE A 198 -5.019 6.996 4.911 1.00 0.33 N ATOM 2787 CA PHE A 198 -3.830 7.900 4.844 1.00 0.35 C ATOM 2788 C PHE A 198 -4.259 9.348 5.101 1.00 0.38 C ATOM 2789 O PHE A 198 -3.652 10.054 5.881 1.00 0.40 O ATOM 2790 CB PHE A 198 -3.213 7.817 3.443 1.00 0.35 C ATOM 2791 CG PHE A 198 -1.892 7.083 3.481 1.00 0.34 C ATOM 2792 CD1 PHE A 198 -1.788 5.843 4.123 1.00 1.31 C ATOM 2793 CD2 PHE A 198 -0.772 7.640 2.853 1.00 1.21 C ATOM 2794 CE1 PHE A 198 -0.564 5.162 4.138 1.00 1.33 C ATOM 2795 CE2 PHE A 198 0.452 6.959 2.865 1.00 1.21 C ATOM 2796 CZ PHE A 198 0.555 5.720 3.508 1.00 0.42 C ATOM 2797 HA PHE A 198 -3.106 7.592 5.598 1.00 0.00 H ATOM 2798 HB2 PHE A 198 -3.898 7.287 2.781 1.00 0.00 H ATOM 2799 HB3 PHE A 198 -3.051 8.826 3.063 1.00 0.00 H ATOM 2800 HD2 PHE A 198 -0.852 8.606 2.354 1.00 0.00 H ATOM 2801 HE2 PHE A 198 1.323 7.393 2.374 1.00 0.00 H ATOM 2802 HZ PHE A 198 1.507 5.189 3.518 1.00 0.00 H ATOM 2803 HE1 PHE A 198 -0.483 4.198 4.640 1.00 0.00 H ATOM 2804 HD1 PHE A 198 -2.660 5.407 4.611 1.00 0.00 H ATOM 2805 H PHE A 198 -5.290 6.439 4.076 1.00 0.00 H ATOM 2806 N GLU A 199 -5.293 9.801 4.441 1.00 0.45 N ATOM 2807 CA GLU A 199 -5.744 11.213 4.642 1.00 0.50 C ATOM 2808 C GLU A 199 -6.799 11.309 5.754 1.00 0.48 C ATOM 2809 O GLU A 199 -7.679 12.145 5.705 1.00 0.57 O ATOM 2810 CB GLU A 199 -6.341 11.738 3.335 1.00 0.65 C ATOM 2811 CG GLU A 199 -5.577 12.987 2.890 1.00 1.23 C ATOM 2812 CD GLU A 199 -6.028 13.390 1.485 1.00 1.70 C ATOM 2813 OE1 GLU A 199 -7.020 12.849 1.025 1.00 2.40 O ATOM 2814 OE2 GLU A 199 -5.374 14.233 0.893 1.00 2.12 O ATOM 2815 HA GLU A 199 -4.882 11.811 4.936 1.00 0.00 H ATOM 2816 HB2 GLU A 199 -6.262 10.970 2.565 1.00 0.00 H ATOM 2817 HB3 GLU A 199 -7.390 11.990 3.490 1.00 0.00 H ATOM 2818 HG2 GLU A 199 -5.779 13.803 3.584 1.00 0.00 H ATOM 2819 HG3 GLU A 199 -4.508 12.775 2.881 1.00 0.00 H ATOM 2820 H GLU A 199 -5.801 9.181 3.778 1.00 0.00 H ATOM 2821 N LEU A 200 -6.726 10.474 6.755 1.00 0.56 N ATOM 2822 CA LEU A 200 -7.731 10.543 7.851 1.00 0.64 C ATOM 2823 C LEU A 200 -7.288 11.559 8.906 1.00 0.77 C ATOM 2824 O LEU A 200 -7.920 12.578 9.101 1.00 1.12 O ATOM 2825 CB LEU A 200 -7.850 9.171 8.501 1.00 0.85 C ATOM 2826 CG LEU A 200 -9.122 8.478 8.019 1.00 1.07 C ATOM 2827 CD1 LEU A 200 -10.336 9.110 8.700 1.00 1.60 C ATOM 2828 CD2 LEU A 200 -9.260 8.624 6.502 1.00 1.04 C ATOM 2829 HA LEU A 200 -8.692 10.850 7.439 1.00 0.00 H ATOM 2830 HB2 LEU A 200 -6.984 8.566 8.232 1.00 0.00 H ATOM 2831 HB3 LEU A 200 -7.889 9.286 9.584 1.00 0.00 H ATOM 2832 HG LEU A 200 -9.066 7.419 8.272 1.00 0.00 H ATOM 2833 HD21 LEU A 200 -9.309 9.682 6.243 1.00 0.00 H ATOM 2834 HD22 LEU A 200 -8.398 8.169 6.015 1.00 0.00 H ATOM 2835 HD23 LEU A 200 -10.171 8.125 6.172 1.00 0.00 H ATOM 2836 HD11 LEU A 200 -10.246 8.995 9.780 1.00 0.00 H ATOM 2837 HD12 LEU A 200 -10.381 10.170 8.449 1.00 0.00 H ATOM 2838 HD13 LEU A 200 -11.243 8.614 8.355 1.00 0.00 H ATOM 2839 H LEU A 200 -5.968 9.763 6.787 1.00 0.00 H ATOM 2840 N ARG A 201 -6.209 11.291 9.593 1.00 0.72 N ATOM 2841 CA ARG A 201 -5.739 12.245 10.636 1.00 0.93 C ATOM 2842 C ARG A 201 -4.283 12.644 10.366 1.00 0.69 C ATOM 2843 O ARG A 201 -4.024 13.640 9.719 1.00 0.89 O ATOM 2844 CB ARG A 201 -5.854 11.591 12.016 1.00 1.36 C ATOM 2845 CG ARG A 201 -7.309 11.637 12.485 1.00 1.92 C ATOM 2846 CD ARG A 201 -7.351 11.958 13.980 1.00 2.24 C ATOM 2847 NE ARG A 201 -8.755 11.865 14.470 1.00 2.90 N ATOM 2848 CZ ARG A 201 -9.071 12.345 15.641 1.00 3.49 C ATOM 2849 NH1 ARG A 201 -9.067 13.635 15.839 1.00 4.30 N ATOM 2850 NH2 ARG A 201 -9.389 11.536 16.614 1.00 3.74 N ATOM 2851 HA ARG A 201 -6.359 13.141 10.608 1.00 0.00 H ATOM 2852 HB2 ARG A 201 -5.525 10.554 11.955 1.00 0.00 H ATOM 2853 HB3 ARG A 201 -5.226 12.129 12.726 1.00 0.00 H ATOM 2854 HG2 ARG A 201 -7.845 12.408 11.932 1.00 0.00 H ATOM 2855 HG3 ARG A 201 -7.780 10.670 12.307 1.00 0.00 H ATOM 2856 HD2 ARG A 201 -6.974 12.967 14.146 1.00 0.00 H ATOM 2857 HD3 ARG A 201 -6.729 11.246 14.522 1.00 0.00 H ATOM 2858 HE ARG A 201 -9.483 11.417 13.878 1.00 0.00 H ATOM 2859 HH12 ARG A 201 -9.319 14.019 16.772 1.00 0.00 H ATOM 2860 HH11 ARG A 201 -8.812 14.279 15.063 1.00 0.00 H ATOM 2861 HH22 ARG A 201 -9.641 11.919 17.547 1.00 0.00 H ATOM 2862 HH21 ARG A 201 -9.391 10.508 16.456 1.00 0.00 H ATOM 2863 H ARG A 201 -5.680 10.414 9.412 1.00 0.00 H ATOM 2864 N PHE A 202 -3.327 11.884 10.851 1.00 0.54 N ATOM 2865 CA PHE A 202 -1.898 12.244 10.610 1.00 0.57 C ATOM 2866 C PHE A 202 -1.663 13.690 11.060 1.00 0.76 C ATOM 2867 O PHE A 202 -0.855 14.399 10.492 1.00 0.96 O ATOM 2868 CB PHE A 202 -1.591 12.114 9.117 1.00 0.59 C ATOM 2869 CG PHE A 202 -0.142 11.737 8.903 1.00 0.55 C ATOM 2870 CD1 PHE A 202 0.856 12.186 9.782 1.00 1.38 C ATOM 2871 CD2 PHE A 202 0.207 10.939 7.808 1.00 1.28 C ATOM 2872 CE1 PHE A 202 2.192 11.837 9.563 1.00 1.40 C ATOM 2873 CE2 PHE A 202 1.546 10.588 7.593 1.00 1.33 C ATOM 2874 CZ PHE A 202 2.537 11.037 8.469 1.00 0.70 C ATOM 2875 HA PHE A 202 -1.246 11.576 11.173 1.00 0.00 H ATOM 2876 HB2 PHE A 202 -2.230 11.343 8.685 1.00 0.00 H ATOM 2877 HB3 PHE A 202 -1.790 13.066 8.626 1.00 0.00 H ATOM 2878 HD2 PHE A 202 -0.564 10.590 7.121 1.00 0.00 H ATOM 2879 HE2 PHE A 202 1.815 9.964 6.741 1.00 0.00 H ATOM 2880 HZ PHE A 202 3.579 10.764 8.300 1.00 0.00 H ATOM 2881 HE1 PHE A 202 2.966 12.189 10.246 1.00 0.00 H ATOM 2882 HD1 PHE A 202 0.589 12.808 10.637 1.00 0.00 H ATOM 2883 H PHE A 202 -3.565 11.034 11.401 1.00 0.00 H ATOM 2884 N LYS A 203 -2.367 14.127 12.074 1.00 1.26 N ATOM 2885 CA LYS A 203 -2.196 15.525 12.570 1.00 1.61 C ATOM 2886 C LYS A 203 -2.242 16.496 11.389 1.00 1.33 C ATOM 2887 O LYS A 203 -1.293 17.203 11.128 1.00 1.82 O ATOM 2888 CB LYS A 203 -0.846 15.654 13.280 1.00 2.16 C ATOM 2889 CG LYS A 203 -0.941 15.036 14.677 1.00 2.79 C ATOM 2890 CD LYS A 203 0.404 15.184 15.393 1.00 3.36 C ATOM 2891 CE LYS A 203 0.222 16.027 16.656 1.00 4.19 C ATOM 2892 NZ LYS A 203 0.075 15.130 17.836 1.00 4.77 N ATOM 2893 HA LYS A 203 -2.999 15.762 13.268 1.00 0.00 H ATOM 2894 HB2 LYS A 203 -0.081 15.133 12.704 1.00 0.00 H ATOM 2895 HB3 LYS A 203 -0.580 16.708 13.366 1.00 0.00 H ATOM 2896 HG2 LYS A 203 -1.716 15.547 15.249 1.00 0.00 H ATOM 2897 HG3 LYS A 203 -1.193 13.979 14.591 1.00 0.00 H ATOM 2898 HD2 LYS A 203 0.781 14.198 15.665 1.00 0.00 H ATOM 2899 HD3 LYS A 203 1.117 15.673 14.729 1.00 0.00 H ATOM 2900 HE2 LYS A 203 -0.671 16.644 16.555 1.00 0.00 H ATOM 2901 HE3 LYS A 203 1.092 16.669 16.793 1.00 0.00 H ATOM 2902 HZ1 LYS A 203 -0.756 14.519 17.704 1.00 0.00 H ATOM 2903 HZ2 LYS A 203 0.927 14.542 17.931 1.00 0.00 H ATOM 2904 HZ3 LYS A 203 -0.049 15.705 18.694 1.00 0.00 H ATOM 2905 H LYS A 203 -3.051 13.495 12.538 1.00 0.00 H ATOM 2906 N GLN A 204 -3.336 16.525 10.674 1.00 1.57 N ATOM 2907 CA GLN A 204 -3.457 17.437 9.503 1.00 1.68 C ATOM 2908 C GLN A 204 -3.209 18.875 9.943 1.00 1.41 C ATOM 2909 O GLN A 204 -4.110 19.579 10.354 1.00 1.75 O ATOM 2910 CB GLN A 204 -4.861 17.320 8.908 1.00 2.45 C ATOM 2911 CG GLN A 204 -4.913 18.060 7.571 1.00 3.39 C ATOM 2912 CD GLN A 204 -5.360 17.095 6.471 1.00 4.31 C ATOM 2913 OE1 GLN A 204 -6.310 17.362 5.762 1.00 4.59 O ATOM 2914 NE2 GLN A 204 -4.710 15.977 6.297 1.00 5.09 N ATOM 2915 HA GLN A 204 -2.718 17.158 8.751 1.00 0.00 H ATOM 2916 HB2 GLN A 204 -5.103 16.269 8.751 1.00 0.00 H ATOM 2917 HB3 GLN A 204 -5.584 17.759 9.595 1.00 0.00 H ATOM 2918 HG2 GLN A 204 -5.621 18.886 7.640 1.00 0.00 H ATOM 2919 HG3 GLN A 204 -3.924 18.450 7.333 1.00 0.00 H ATOM 2920 HE22 GLN A 204 -3.897 15.748 6.904 1.00 0.00 H ATOM 2921 HE21 GLN A 204 -5.005 15.315 5.552 1.00 0.00 H ATOM 2922 H GLN A 204 -4.131 15.904 10.926 1.00 0.00 H ATOM 2923 N TYR A 205 -1.990 19.310 9.858 1.00 1.14 N ATOM 2924 CA TYR A 205 -1.663 20.705 10.269 1.00 1.40 C ATOM 2925 C TYR A 205 -2.099 21.679 9.171 1.00 1.52 C ATOM 2926 O TYR A 205 -2.426 22.818 9.437 1.00 1.67 O ATOM 2927 CB TYR A 205 -0.155 20.836 10.503 1.00 1.73 C ATOM 2928 CG TYR A 205 0.593 20.370 9.276 1.00 1.34 C ATOM 2929 CD1 TYR A 205 0.719 21.218 8.169 1.00 1.92 C ATOM 2930 CD2 TYR A 205 1.160 19.091 9.247 1.00 1.60 C ATOM 2931 CE1 TYR A 205 1.412 20.786 7.033 1.00 2.27 C ATOM 2932 CE2 TYR A 205 1.853 18.659 8.110 1.00 2.03 C ATOM 2933 CZ TYR A 205 1.979 19.506 7.003 1.00 2.20 C ATOM 2934 OH TYR A 205 2.662 19.080 5.882 1.00 2.98 O ATOM 2935 HA TYR A 205 -2.191 20.941 11.193 1.00 0.00 H ATOM 2936 HB3 TYR A 205 0.134 20.224 11.358 1.00 0.00 H ATOM 2937 HB2 TYR A 205 0.092 21.879 10.704 1.00 0.00 H ATOM 2938 HD2 TYR A 205 1.062 18.431 10.109 1.00 0.00 H ATOM 2939 HE2 TYR A 205 2.295 17.663 8.087 1.00 0.00 H ATOM 2940 HE1 TYR A 205 1.511 21.446 6.171 1.00 0.00 H ATOM 2941 HD1 TYR A 205 0.277 22.214 8.192 1.00 0.00 H ATOM 2942 HH TYR A 205 2.223 18.272 5.517 1.00 0.00 H ATOM 2943 H TYR A 205 -1.239 18.684 9.502 1.00 0.00 H ATOM 2944 N LEU A 206 -2.108 21.238 7.940 1.00 1.56 N ATOM 2945 CA LEU A 206 -2.522 22.133 6.821 1.00 1.80 C ATOM 2946 C LEU A 206 -1.608 23.360 6.772 1.00 2.05 C ATOM 2947 O LEU A 206 -1.728 24.273 7.564 1.00 2.53 O ATOM 2948 CB LEU A 206 -3.969 22.582 7.030 1.00 1.76 C ATOM 2949 CG LEU A 206 -4.869 21.352 7.160 1.00 1.73 C ATOM 2950 CD1 LEU A 206 -6.210 21.762 7.771 1.00 1.78 C ATOM 2951 CD2 LEU A 206 -5.104 20.746 5.774 1.00 2.06 C ATOM 2952 HA LEU A 206 -2.443 21.588 5.880 1.00 0.00 H ATOM 2953 HB2 LEU A 206 -4.037 23.180 7.939 1.00 0.00 H ATOM 2954 HB3 LEU A 206 -4.291 23.180 6.178 1.00 0.00 H ATOM 2955 HG LEU A 206 -4.388 20.615 7.804 1.00 0.00 H ATOM 2956 HD21 LEU A 206 -5.586 21.484 5.133 1.00 0.00 H ATOM 2957 HD22 LEU A 206 -4.148 20.454 5.340 1.00 0.00 H ATOM 2958 HD23 LEU A 206 -5.745 19.869 5.866 1.00 0.00 H ATOM 2959 HD11 LEU A 206 -6.041 22.195 8.757 1.00 0.00 H ATOM 2960 HD12 LEU A 206 -6.691 22.498 7.127 1.00 0.00 H ATOM 2961 HD13 LEU A 206 -6.850 20.884 7.863 1.00 0.00 H ATOM 2962 H LEU A 206 -1.825 20.257 7.740 1.00 0.00 H ATOM 2963 N ARG A 207 -0.694 23.387 5.842 1.00 1.95 N ATOM 2964 CA ARG A 207 0.228 24.553 5.736 1.00 2.21 C ATOM 2965 C ARG A 207 -0.569 25.802 5.356 1.00 2.48 C ATOM 2966 O ARG A 207 -1.682 25.648 4.882 1.00 2.92 O ATOM 2967 CB ARG A 207 1.282 24.273 4.662 1.00 2.50 C ATOM 2968 CG ARG A 207 2.670 24.621 5.204 1.00 2.76 C ATOM 2969 CD ARG A 207 3.736 23.894 4.383 1.00 3.27 C ATOM 2970 NE ARG A 207 5.053 24.004 5.070 1.00 3.68 N ATOM 2971 CZ ARG A 207 6.073 24.525 4.445 1.00 4.35 C ATOM 2972 NH1 ARG A 207 6.232 24.313 3.167 1.00 4.90 N ATOM 2973 NH2 ARG A 207 6.935 25.256 5.097 1.00 4.84 N ATOM 2974 HA ARG A 207 0.720 24.715 6.695 1.00 0.00 H ATOM 2975 OXT ARG A 207 -0.052 26.891 5.546 1.00 2.78 O ATOM 2976 HB2 ARG A 207 1.252 23.218 4.390 1.00 0.00 H ATOM 2977 HB3 ARG A 207 1.073 24.880 3.781 1.00 0.00 H ATOM 2978 HG2 ARG A 207 2.828 25.697 5.134 1.00 0.00 H ATOM 2979 HG3 ARG A 207 2.741 24.312 6.247 1.00 0.00 H ATOM 2980 HD2 ARG A 207 3.803 24.346 3.393 1.00 0.00 H ATOM 2981 HD3 ARG A 207 3.464 22.843 4.284 1.00 0.00 H ATOM 2982 HE ARG A 207 5.160 23.666 6.048 1.00 0.00 H ATOM 2983 HH12 ARG A 207 7.045 24.728 2.668 1.00 0.00 H ATOM 2984 HH11 ARG A 207 5.546 23.729 2.647 1.00 0.00 H ATOM 2985 HH22 ARG A 207 7.748 25.671 4.598 1.00 0.00 H ATOM 2986 HH21 ARG A 207 6.809 25.424 6.116 1.00 0.00 H ATOM 2987 H ARG A 207 -0.609 22.594 5.174 1.00 0.00 H TER 2988 ARG A 207 HETATM 2989 N HIS A 1 -1.396 5.952 -8.268 1.00 0.24 N HETATM 2990 CA HIS A 1 -1.609 4.899 -7.235 1.00 0.08 C HETATM 2991 C HIS A 1 -0.489 4.969 -6.194 1.00 0.23 C HETATM 2992 O HIS A 1 -0.121 3.978 -5.596 1.00 -0.39 O HETATM 2993 N HIS A 1 0.056 6.134 -5.972 1.00 -0.26 N HETATM 2994 CA HIS A 1 1.151 6.264 -4.969 1.00 0.13 C HETATM 2995 C HIS A 1 0.585 6.842 -3.671 1.00 0.20 C HETATM 2996 O HIS A 1 0.566 8.039 -3.467 1.00 -0.39 O HETATM 2997 N HIS A 1 0.124 5.997 -2.790 1.00 -0.26 N HETATM 2998 CA HIS A 1 -0.441 6.490 -1.502 1.00 0.13 C HETATM 2999 C HIS A 1 0.603 7.342 -0.779 1.00 0.20 C HETATM 3000 O HIS A 1 1.678 6.880 -0.446 1.00 -0.39 O HETATM 3001 N HIS A 1 0.292 8.585 -0.532 1.00 -0.26 N HETATM 3002 CA HIS A 1 1.259 9.473 0.171 1.00 0.13 C HETATM 3003 C HIS A 1 0.505 10.324 1.193 1.00 0.20 C HETATM 3004 O HIS A 1 -0.648 10.659 1.005 1.00 -0.39 O HETATM 3005 N HIS A 1 1.141 10.670 2.277 1.00 -0.26 N HETATM 3006 CA HIS A 1 0.453 11.492 3.311 1.00 0.15 C HETATM 3007 C HIS A 1 0.895 12.957 3.196 1.00 0.21 C HETATM 3008 O HIS A 1 1.951 13.244 2.667 1.00 -0.39 O HETATM 3009 N HIS A 1 0.067 13.840 3.700 1.00 -0.25 N HETATM 3010 CA HIS A 1 0.327 15.286 3.679 1.00 0.13 C HETATM 3011 C HIS A 1 1.375 15.675 4.734 1.00 0.20 C HETATM 3012 O HIS A 1 1.832 16.801 4.770 1.00 -0.39 O HETATM 3013 N HIS A 1 1.762 14.769 5.595 1.00 -0.26 N HETATM 3014 CA HIS A 1 2.774 15.117 6.630 1.00 0.13 C HETATM 3015 C HIS A 1 4.170 14.780 6.108 1.00 0.20 C HETATM 3016 O HIS A 1 5.090 15.566 6.212 1.00 -0.39 O HETATM 3017 N HIS A 1 4.332 13.615 5.546 1.00 -0.26 N HETATM 3018 CA HIS A 1 5.666 13.224 5.016 1.00 0.14 C HETATM 3019 C HIS A 1 5.841 13.797 3.608 1.00 0.21 C HETATM 3020 O HIS A 1 6.790 14.502 3.330 1.00 -0.39 O HETATM 3021 N HIS A 1 4.934 13.505 2.717 1.00 -0.26 N HETATM 3022 CA HIS A 1 5.054 14.040 1.331 1.00 0.14 C HETATM 3023 C HIS A 1 4.119 15.239 1.168 1.00 0.21 C HETATM 3024 O HIS A 1 2.912 15.111 1.234 1.00 -0.39 O HETATM 3025 N HIS A 1 4.665 16.405 0.956 1.00 -0.26 N HETATM 3026 CA HIS A 1 3.807 17.612 0.789 1.00 0.15 C HETATM 3027 C HIS A 1 3.758 18.003 -0.689 1.00 0.21 C HETATM 3028 O HIS A 1 4.776 18.196 -1.323 1.00 -0.39 O HETATM 3029 N HIS A 1 2.583 18.122 -1.243 1.00 -0.26 N HETATM 3030 CA HIS A 1 2.472 18.501 -2.680 1.00 0.14 C HETATM 3031 C HIS A 1 1.392 19.572 -2.845 1.00 0.20 C HETATM 3032 O HIS A 1 0.277 19.288 -3.234 1.00 -0.39 O HETATM 3033 N HIS A 1 1.713 20.803 -2.553 1.00 -0.27 N HETATM 3034 CA HIS A 1 0.704 21.890 -2.694 1.00 0.09 C HETATM 3035 C HIS A 1 1.383 23.247 -2.495 1.00 0.06 C HETATM 3036 O HIS A 1 2.562 23.346 -2.789 1.00 -0.57 O HETATM 3037 OXT HIS A 1 0.711 24.164 -2.051 1.00 -0.57 O HETATM 3038 CB HIS A 1 -0.391 21.709 -1.641 1.00 -0.03 C HETATM 3039 H88 HIS A 1 -1.136 22.512 -1.745 1.00 0.03 H HETATM 3040 H89 HIS A 1 0.056 21.751 -0.637 1.00 0.03 H HETATM 3041 H90 HIS A 1 -0.880 20.734 -1.784 1.00 0.03 H HETATM 3042 H87 HIS A 1 0.257 21.847 -3.698 1.00 0.07 H HETATM 3043 H86 HIS A 1 2.637 21.017 -2.235 1.00 0.19 H HETATM 3044 CB HIS A 1 2.099 17.267 -3.504 1.00 0.04 C HETATM 3045 CG HIS A 1 3.332 16.767 -4.259 1.00 0.04 C HETATM 3046 OD1 HIS A 1 4.422 16.904 -3.729 1.00 -0.57 O HETATM 3047 OD2 HIS A 1 3.165 16.255 -5.354 1.00 -0.57 O HETATM 3048 H84 HIS A 1 1.310 17.531 -4.224 1.00 0.05 H HETATM 3049 H85 HIS A 1 1.733 16.475 -2.834 1.00 0.05 H HETATM 3050 H83 HIS A 1 3.437 18.897 -3.030 1.00 0.08 H HETATM 3051 H82 HIS A 1 1.757 17.959 -0.704 1.00 0.19 H HETATM 3052 CB HIS A 1 4.389 18.768 1.603 1.00 0.08 C HETATM 3053 OG HIS A 1 3.704 19.968 1.267 1.00 -0.39 O HETATM 3054 H81 HIS A 1 4.064 20.688 1.771 1.00 0.21 H HETATM 3055 H79 HIS A 1 5.459 18.878 1.373 1.00 0.06 H HETATM 3056 H80 HIS A 1 4.264 18.562 2.676 1.00 0.06 H HETATM 3057 H78 HIS A 1 2.789 17.390 1.143 1.00 0.08 H HETATM 3058 H77 HIS A 1 5.660 16.489 0.905 1.00 0.19 H HETATM 3059 CB HIS A 1 4.670 12.952 0.326 1.00 0.02 C HETATM 3060 CG HIS A 1 5.873 12.089 0.034 1.00 -0.04 C HETATM 3061 CD1 HIS A 1 6.421 11.291 1.044 1.00 -0.06 C HETATM 3062 CE1 HIS A 1 7.535 10.488 0.776 1.00 -0.07 C HETATM 3063 CZ HIS A 1 8.101 10.483 -0.503 1.00 -0.07 C HETATM 3064 CE2 HIS A 1 7.554 11.281 -1.515 1.00 -0.07 C HETATM 3065 CD2 HIS A 1 6.440 12.085 -1.246 1.00 -0.06 C HETATM 3066 H73 HIS A 1 6.017 12.704 -2.029 1.00 0.06 H HETATM 3067 H75 HIS A 1 7.993 11.276 -2.506 1.00 0.06 H HETATM 3068 H76 HIS A 1 8.964 9.861 -0.711 1.00 0.06 H HETATM 3069 H74 HIS A 1 7.959 9.870 1.559 1.00 0.06 H HETATM 3070 H72 HIS A 1 5.982 11.295 2.035 1.00 0.06 H HETATM 3071 H70 HIS A 1 4.320 13.421 -0.606 1.00 0.05 H HETATM 3072 H71 HIS A 1 3.867 12.330 0.748 1.00 0.05 H HETATM 3073 H69 HIS A 1 6.092 14.357 1.149 1.00 0.08 H HETATM 3074 H68 HIS A 1 4.159 12.923 2.964 1.00 0.19 H HETATM 3075 CB HIS A 1 5.762 11.697 4.973 1.00 0.02 C HETATM 3076 CG HIS A 1 7.122 11.258 5.463 1.00 -0.05 C HETATM 3077 CD1 HIS A 1 7.230 10.478 6.621 1.00 -0.07 C HETATM 3078 CE1 HIS A 1 8.490 10.066 7.072 1.00 -0.03 C HETATM 3079 CZ HIS A 1 9.640 10.432 6.364 1.00 0.12 C HETATM 3080 CE2 HIS A 1 9.532 11.212 5.207 1.00 -0.03 C HETATM 3081 CD2 HIS A 1 8.273 11.624 4.756 1.00 -0.07 C HETATM 3082 H64 HIS A 1 8.189 12.227 3.859 1.00 0.05 H HETATM 3083 H66 HIS A 1 10.424 11.497 4.660 1.00 0.05 H HETATM 3084 OH HIS A 1 10.900 10.021 6.815 1.00 -0.20 O HETATM 3085 P HIS A 1 11.824 11.088 7.479 1.00 0.28 P HETATM 3086 O1P HIS A 1 12.379 11.915 6.292 1.00 -0.61 O HETATM 3087 O2P HIS A 1 12.982 10.268 8.104 1.00 -0.61 O HETATM 3088 O3P HIS A 1 10.869 11.864 8.503 1.00 -0.27 O HETATM 3089 H67 HIS A 1 11.367 12.538 8.950 1.00 0.26 H HETATM 3090 H65 HIS A 1 8.574 9.464 7.969 1.00 0.05 H HETATM 3091 H63 HIS A 1 6.338 10.193 7.168 1.00 0.05 H HETATM 3092 H61 HIS A 1 5.617 11.351 3.939 1.00 0.05 H HETATM 3093 H62 HIS A 1 4.984 11.263 5.618 1.00 0.05 H HETATM 3094 H60 HIS A 1 6.454 13.622 5.673 1.00 0.08 H HETATM 3095 H59 HIS A 1 3.560 12.984 5.471 1.00 0.19 H HETATM 3096 CB HIS A 1 2.497 14.314 7.903 1.00 0.00 C HETATM 3097 CG HIS A 1 2.012 15.255 9.008 1.00 0.04 C HETATM 3098 CD HIS A 1 3.214 15.951 9.649 1.00 0.17 C HETATM 3099 OE1 HIS A 1 4.069 16.471 8.959 1.00 -0.40 O HETATM 3100 NE2 HIS A 1 3.318 15.983 10.949 1.00 -0.30 N HETATM 3101 H57 HIS A 1 4.100 16.436 11.377 1.00 0.18 H HETATM 3102 H58 HIS A 1 2.615 15.555 11.518 1.00 0.18 H HETATM 3103 H55 HIS A 1 1.473 14.676 9.772 1.00 0.05 H HETATM 3104 H56 HIS A 1 1.338 16.010 8.577 1.00 0.05 H HETATM 3105 H53 HIS A 1 3.421 13.813 8.228 1.00 0.03 H HETATM 3106 H54 HIS A 1 1.723 13.559 7.699 1.00 0.03 H HETATM 3107 H52 HIS A 1 2.716 16.192 6.854 1.00 0.08 H HETATM 3108 H51 HIS A 1 1.379 13.846 5.558 1.00 0.19 H HETATM 3109 CB HIS A 1 -1.007 15.946 4.005 1.00 -0.01 C HETATM 3110 CG HIS A 1 -1.741 14.859 4.827 1.00 -0.03 C HETATM 3111 CD HIS A 1 -1.219 13.484 4.341 1.00 0.04 C HETATM 3112 H49 HIS A 1 -1.066 12.796 5.185 1.00 0.05 H HETATM 3113 H50 HIS A 1 -1.911 13.029 3.618 1.00 0.05 H HETATM 3114 H47 HIS A 1 -2.826 14.930 4.661 1.00 0.03 H HETATM 3115 H48 HIS A 1 -1.525 14.987 5.898 1.00 0.03 H HETATM 3116 H45 HIS A 1 -1.562 16.190 3.087 1.00 0.03 H HETATM 3117 H46 HIS A 1 -0.861 16.860 4.599 1.00 0.03 H HETATM 3118 H44 HIS A 1 0.677 15.596 2.683 1.00 0.08 H HETATM 3119 CB HIS A 1 0.817 10.956 4.696 1.00 0.08 C HETATM 3120 CG HIS A 1 0.095 9.628 4.934 1.00 0.18 C HETATM 3121 OD1 HIS A 1 -1.117 9.564 4.886 1.00 -0.40 O HETATM 3122 ND2 HIS A 1 0.794 8.556 5.193 1.00 -0.30 N HETATM 3123 H42 HIS A 1 0.332 7.683 5.350 1.00 0.18 H HETATM 3124 H43 HIS A 1 1.792 8.608 5.234 1.00 0.18 H HETATM 3125 H40 HIS A 1 0.510 11.683 5.463 1.00 0.06 H HETATM 3126 H41 HIS A 1 1.904 10.798 4.754 1.00 0.06 H HETATM 3127 H39 HIS A 1 -0.635 11.427 3.166 1.00 0.08 H HETATM 3128 H38 HIS A 1 2.089 10.384 2.414 1.00 0.19 H HETATM 3129 CB HIS A 1 1.953 10.376 -0.847 1.00 -0.00 C HETATM 3130 CG HIS A 1 2.820 9.519 -1.770 1.00 0.00 C HETATM 3131 CD HIS A 1 3.263 10.351 -2.975 1.00 0.04 C HETATM 3132 OE1 HIS A 1 3.935 11.348 -2.767 1.00 -0.57 O HETATM 3133 OE2 HIS A 1 2.924 9.976 -4.085 1.00 -0.57 O HETATM 3134 H36 HIS A 1 2.239 8.652 -2.117 1.00 0.04 H HETATM 3135 H37 HIS A 1 3.707 9.170 -1.220 1.00 0.04 H HETATM 3136 H34 HIS A 1 2.586 11.106 -0.321 1.00 0.03 H HETATM 3137 H35 HIS A 1 1.197 10.909 -1.442 1.00 0.03 H HETATM 3138 H33 HIS A 1 2.012 8.861 0.689 1.00 0.08 H HETATM 3139 H32 HIS A 1 -0.598 8.942 -0.816 1.00 0.19 H HETATM 3140 CB HIS A 1 -0.821 5.296 -0.623 1.00 -0.00 C HETATM 3141 CG1 HIS A 1 -1.663 4.305 -1.427 1.00 -0.05 C HETATM 3142 CD1 HIS A 1 -2.593 5.065 -2.375 1.00 -0.06 C HETATM 3143 H29 HIS A 1 -3.196 4.347 -2.951 1.00 0.02 H HETATM 3144 H30 HIS A 1 -1.993 5.676 -3.065 1.00 0.02 H HETATM 3145 H31 HIS A 1 -3.259 5.718 -1.791 1.00 0.02 H HETATM 3146 H24 HIS A 1 -2.264 3.693 -0.738 1.00 0.03 H HETATM 3147 H25 HIS A 1 -0.999 3.652 -2.013 1.00 0.03 H HETATM 3148 CG2 HIS A 1 -1.628 5.773 0.583 1.00 -0.06 C HETATM 3149 H26 HIS A 1 -1.028 6.487 1.167 1.00 0.02 H HETATM 3150 H27 HIS A 1 -1.888 4.911 1.214 1.00 0.02 H HETATM 3151 H28 HIS A 1 -2.549 6.265 0.237 1.00 0.02 H HETATM 3152 H23 HIS A 1 0.095 4.797 -0.274 1.00 0.03 H HETATM 3153 H22 HIS A 1 -1.336 7.098 -1.702 1.00 0.08 H HETATM 3154 H21 HIS A 1 0.150 5.016 -2.980 1.00 0.19 H HETATM 3155 CB HIS A 1 2.237 7.192 -5.517 1.00 -0.00 C HETATM 3156 CG1 HIS A 1 2.764 6.631 -6.840 1.00 -0.05 C HETATM 3157 CD1 HIS A 1 3.067 7.782 -7.800 1.00 -0.06 C HETATM 3158 H18 HIS A 1 3.446 7.377 -8.750 1.00 0.02 H HETATM 3159 H19 HIS A 1 3.826 8.441 -7.354 1.00 0.02 H HETATM 3160 H20 HIS A 1 2.147 8.356 -7.987 1.00 0.02 H HETATM 3161 H13 HIS A 1 2.005 5.972 -7.287 1.00 0.03 H HETATM 3162 H14 HIS A 1 3.684 6.058 -6.654 1.00 0.03 H HETATM 3163 CG2 HIS A 1 3.388 7.283 -4.512 1.00 -0.06 C HETATM 3164 H15 HIS A 1 3.012 7.686 -3.560 1.00 0.02 H HETATM 3165 H16 HIS A 1 4.169 7.948 -4.909 1.00 0.02 H HETATM 3166 H17 HIS A 1 3.809 6.281 -4.345 1.00 0.02 H HETATM 3167 H12 HIS A 1 1.815 8.194 -5.684 1.00 0.03 H HETATM 3168 H11 HIS A 1 1.584 5.273 -4.769 1.00 0.08 H HETATM 3169 H10 HIS A 1 -0.261 6.939 -6.474 1.00 0.19 H HETATM 3170 CB HIS A 1 -1.600 3.522 -7.902 1.00 0.06 C HETATM 3171 CG HIS A 1 -2.942 3.260 -8.529 1.00 0.06 C HETATM 3172 ND1 HIS A 1 -4.130 3.571 -7.887 1.00 -0.26 N HETATM 3173 CE1 HIS A 1 -5.138 3.218 -8.706 1.00 0.09 C HETATM 3174 NE2 HIS A 1 -4.687 2.693 -9.849 1.00 -0.34 N HETATM 3175 CD2 HIS A 1 -3.300 2.719 -9.739 1.00 -0.03 C HETATM 3176 H8 HIS A 1 -2.604 2.364 -10.498 1.00 0.03 H HETATM 3177 H9 HIS A 1 -6.193 3.345 -8.466 1.00 0.11 H HETATM 3178 H7 HIS A 1 -4.224 3.995 -6.953 1.00 0.24 H HETATM 3179 H5 HIS A 1 -1.391 2.750 -7.147 1.00 0.05 H HETATM 3180 H6 HIS A 1 -0.821 3.496 -8.678 1.00 0.05 H HETATM 3181 H4 HIS A 1 -2.579 5.061 -6.741 1.00 0.11 H HETATM 3182 H1 HIS A 1 -2.134 5.905 -8.953 1.00 0.20 H HETATM 3183 H2 HIS A 1 -0.508 5.804 -8.721 1.00 0.20 H HETATM 3184 H3 HIS A 1 -1.402 6.859 -7.829 1.00 0.20 H CONECT 1 2 7 8 9 CONECT 7 1 CONECT 8 1 CONECT 9 1 CONECT 2989 2990 3182 3183 3184 CONECT 2990 2989 2991 3170 3181 CONECT 2991 2990 2992 2993 CONECT 2992 2991 CONECT 2993 2991 2994 3169 CONECT 2994 2993 2995 3155 3168 CONECT 2995 2994 2996 2997 CONECT 2996 2995 CONECT 2997 2995 2998 3154 CONECT 2998 2997 2999 3140 3153 CONECT 2999 2998 3000 3001 CONECT 3000 2999 CONECT 3001 2999 3002 3139 CONECT 3002 3001 3003 3129 3138 CONECT 3003 3002 3004 3005 CONECT 3004 3003 CONECT 3005 3003 3006 3128 CONECT 3006 3005 3007 3119 3127 CONECT 3007 3006 3008 3009 CONECT 3008 3007 CONECT 3009 3007 3010 3111 CONECT 3010 3009 3011 3109 3118 CONECT 3011 3010 3012 3013 CONECT 3012 3011 CONECT 3013 3011 3014 3108 CONECT 3014 3013 3015 3096 3107 CONECT 3015 3014 3016 3017 CONECT 3016 3015 CONECT 3017 3015 3018 3095 CONECT 3018 3017 3019 3075 3094 CONECT 3019 3018 3020 3021 CONECT 3020 3019 CONECT 3021 3019 3022 3074 CONECT 3022 3021 3023 3059 3073 CONECT 3023 3022 3024 3025 CONECT 3024 3023 CONECT 3025 3023 3026 3058 CONECT 3026 3025 3027 3052 3057 CONECT 3027 3026 3028 3029 CONECT 3028 3027 CONECT 3029 3027 3030 3051 CONECT 3030 3029 3031 3044 3050 CONECT 3031 3030 3032 3033 CONECT 3032 3031 CONECT 3033 3031 3034 3043 CONECT 3034 3033 3035 3038 3042 CONECT 3035 3034 3036 3037 CONECT 3036 3035 CONECT 3037 3035 CONECT 3038 3034 3039 3040 3041 CONECT 3039 3038 CONECT 3040 3038 CONECT 3041 3038 CONECT 3042 3034 CONECT 3043 3033 CONECT 3044 3030 3045 3048 3049 CONECT 3045 3044 3046 3047 CONECT 3046 3045 CONECT 3047 3045 CONECT 3048 3044 CONECT 3049 3044 CONECT 3050 3030 CONECT 3051 3029 CONECT 3052 3026 3053 3055 3056 CONECT 3053 3052 3054 CONECT 3054 3053 CONECT 3055 3052 CONECT 3056 3052 CONECT 3057 3026 CONECT 3058 3025 CONECT 3059 3022 3060 3071 3072 CONECT 3060 3059 3061 3065 CONECT 3061 3060 3062 3070 CONECT 3062 3061 3063 3069 CONECT 3063 3062 3064 3068 CONECT 3064 3063 3065 3067 CONECT 3065 3060 3064 3066 CONECT 3066 3065 CONECT 3067 3064 CONECT 3068 3063 CONECT 3069 3062 CONECT 3070 3061 CONECT 3071 3059 CONECT 3072 3059 CONECT 3073 3022 CONECT 3074 3021 CONECT 3075 3018 3076 3092 3093 CONECT 3076 3075 3077 3081 CONECT 3077 3076 3078 3091 CONECT 3078 3077 3079 3090 CONECT 3079 3078 3080 3084 CONECT 3080 3079 3081 3083 CONECT 3081 3076 3080 3082 CONECT 3082 3081 CONECT 3083 3080 CONECT 3084 3079 3085 CONECT 3085 3084 3086 3087 3088 CONECT 3086 3085 CONECT 3087 3085 CONECT 3088 3085 3089 CONECT 3089 3088 CONECT 3090 3078 CONECT 3091 3077 CONECT 3092 3075 CONECT 3093 3075 CONECT 3094 3018 CONECT 3095 3017 CONECT 3096 3014 3097 3105 3106 CONECT 3097 3096 3098 3103 3104 CONECT 3098 3097 3099 3100 CONECT 3099 3098 CONECT 3100 3098 3101 3102 CONECT 3101 3100 CONECT 3102 3100 CONECT 3103 3097 CONECT 3104 3097 CONECT 3105 3096 CONECT 3106 3096 CONECT 3107 3014 CONECT 3108 3013 CONECT 3109 3010 3110 3116 3117 CONECT 3110 3109 3111 3114 3115 CONECT 3111 3009 3110 3112 3113 CONECT 3112 3111 CONECT 3113 3111 CONECT 3114 3110 CONECT 3115 3110 CONECT 3116 3109 CONECT 3117 3109 CONECT 3118 3010 CONECT 3119 3006 3120 3125 3126 CONECT 3120 3119 3121 3122 CONECT 3121 3120 CONECT 3122 3120 3123 3124 CONECT 3123 3122 CONECT 3124 3122 CONECT 3125 3119 CONECT 3126 3119 CONECT 3127 3006 CONECT 3128 3005 CONECT 3129 3002 3130 3136 3137 CONECT 3130 3129 3131 3134 3135 CONECT 3131 3130 3132 3133 CONECT 3132 3131 CONECT 3133 3131 CONECT 3134 3130 CONECT 3135 3130 CONECT 3136 3129 CONECT 3137 3129 CONECT 3138 3002 CONECT 3139 3001 CONECT 3140 2998 3141 3148 3152 CONECT 3141 3140 3142 3146 3147 CONECT 3142 3141 3143 3144 3145 CONECT 3143 3142 CONECT 3144 3142 CONECT 3145 3142 CONECT 3146 3141 CONECT 3147 3141 CONECT 3148 3140 3149 3150 3151 CONECT 3149 3148 CONECT 3150 3148 CONECT 3151 3148 CONECT 3152 3140 CONECT 3153 2998 CONECT 3154 2997 CONECT 3155 2994 3156 3163 3167 CONECT 3156 3155 3157 3161 3162 CONECT 3157 3156 3158 3159 3160 CONECT 3158 3157 CONECT 3159 3157 CONECT 3160 3157 CONECT 3161 3156 CONECT 3162 3156 CONECT 3163 3155 3164 3165 3166 CONECT 3164 3163 CONECT 3165 3163 CONECT 3166 3163 CONECT 3167 3155 CONECT 3168 2994 CONECT 3169 2993 CONECT 3170 2990 3171 3179 3180 CONECT 3171 3170 3172 3175 CONECT 3172 3171 3173 3178 CONECT 3173 3172 3174 3177 CONECT 3174 3173 3175 CONECT 3175 3171 3174 3176 CONECT 3176 3175 CONECT 3177 3173 CONECT 3178 3172 CONECT 3179 3170 CONECT 3180 3170 CONECT 3181 2990 CONECT 3182 2989 CONECT 3183 2989 CONECT 3184 2989 MASTER 0 0 0 0 0 0 0 0 3183 1 200 15 END
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PDB Code
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12-mer
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1xb7
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12-mer
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RCSB PDB
PDBbind
12-mer
2w85
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3ds0
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PDBbind
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12-mer
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RCSB PDB
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12-mer
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12-mer
3iwy
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3ueo
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PDBbind
12-mer
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PDBbind
12-mer
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12-mer
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PDBbind
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RCSB PDB
PDBbind
12-mer
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PDBbind
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PDBbind
12-mer
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RCSB PDB
PDBbind
12-mer
5ggp
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PDBbind
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5gr9
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PDBbind
12-mer
5huw
RCSB PDB
PDBbind
12-mer
5huy
RCSB PDB
PDBbind
12-mer
5hyq
RCSB PDB
PDBbind
12-mer
5i2i
RCSB PDB
PDBbind
12-mer
5icy
RCSB PDB
PDBbind
12-mer
5icz
RCSB PDB
PDBbind
12-mer
5id1
RCSB PDB
PDBbind
12-mer
5ih2
RCSB PDB
PDBbind
12-mer
5iop
RCSB PDB
PDBbind
12-mer
5ir1
RCSB PDB
PDBbind
12-mer
5itf
RCSB PDB
PDBbind
12-mer
5iv2
RCSB PDB
PDBbind
12-mer
5ivn
RCSB PDB
PDBbind
12-mer
5ivz
RCSB PDB
PDBbind
12-mer
5ixq
RCSB PDB
PDBbind
12-mer
5iyv
RCSB PDB
PDBbind
12-mer
5lgr
RCSB PDB
PDBbind
12-mer
5moc
RCSB PDB
PDBbind
12-mer
5n7x
RCSB PDB
PDBbind
12-mer
5n8j
RCSB PDB
PDBbind
12-mer
5t1k
RCSB PDB
PDBbind
12-mer
5t1l
RCSB PDB
PDBbind
12-mer
5t1m
RCSB PDB
PDBbind
12-mer
5tbn
RCSB PDB
PDBbind
12-mer
5th2
RCSB PDB
PDBbind
12-mer
5v1d
RCSB PDB
PDBbind
12-mer
5w4s
RCSB PDB
PDBbind
12-mer
5w5s
RCSB PDB
PDBbind
12-mer
5w5u
RCSB PDB
PDBbind
12-mer
5w6i
RCSB PDB
PDBbind
12-mer
5w6r
RCSB PDB
PDBbind
12-mer
5w6t
RCSB PDB
PDBbind
12-mer
5w6u
RCSB PDB
PDBbind
12-mer
5wle
RCSB PDB
PDBbind
12-mer
5wxf
RCSB PDB
PDBbind
12-mer
5wxo
RCSB PDB
PDBbind
12-mer
5xup
RCSB PDB
PDBbind
12-mer
5xwr
RCSB PDB
PDBbind
12-mer
5xxk
RCSB PDB
PDBbind
12-mer
5y1u
RCSB PDB
PDBbind
12-mer
5y59
RCSB PDB
PDBbind
12-mer
6bgg
RCSB PDB
PDBbind
12-mer
6e83
RCSB PDB
PDBbind
12-mer
6f7t
RCSB PDB
PDBbind
12-mer
6f8g
RCSB PDB
PDBbind
12-mer
6rr0
RCSB PDB
PDBbind
12-mer
6qtr
RCSB PDB
PDBbind
12-mer
6qto
RCSB PDB
PDBbind
12-mer
6pit
RCSB PDB
PDBbind
12-mer
6peu
RCSB PDB
PDBbind
12-mer
6o3x
RCSB PDB
PDBbind
12-mer
6nk0
RCSB PDB
PDBbind
12-mer
6mm5
RCSB PDB
PDBbind
12-mer
6k5t
RCSB PDB
PDBbind
12-mer
6k5r
RCSB PDB
PDBbind
12-mer
6iam
RCSB PDB
PDBbind
12-mer
6hy2
RCSB PDB
PDBbind
12-mer
6byk
RCSB PDB
PDBbind
12-mer
6bw4
RCSB PDB
PDBbind
12-mer
6bw3
RCSB PDB
PDBbind
12-mer
6a8g
RCSB PDB
PDBbind
12-mer
5zop
RCSB PDB
PDBbind
12-mer
Entry Information
PDB ID
1shc
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
shc
Ligand Name
12-mer
EC.Number
E.C.-.-.-.-
Resolution
NMR
Affinity (Kd/Ki/IC50)
Kd=53nM
Release Year
1997
Protein/NA Sequence
Check fasta file
Primary Reference
Nature v378 pp. 584-92, 1995
Ligand Properties
Formula
C
6
5
H
9
5
N
1
6
O
2
4
P
Molecular Weight
1515.520
Exact Mass
1514.640
No. of atoms
201
No. of bonds
204
Polar Surface Area
669.45
LOGP Value
-2.98 (
Computed with XLOGP3
)
-1.16 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 16
No. of Hydrogen Bond Acceptors: 24
No. of Rotatable Bonds: 55
No. of Nitrogen and Oxygen Atoms: 40
No. of Rings: 4
Canonical SMILES
OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@H](Cc1cnc[nH]1)[NH3+])CCC(=O)O)CC(=O)N)CCC(=O)N)Cc1ccc(cc1)OP(O)(O)O)Cc1ccccc1
InChI String
InChI=1S/C65H95N16O24P/c1-6-32(3)52(80-63(98)53(33(4)7-2)79-54(89)39(66)26-37-29-69-31-70-37)62(97)73-41(20-22-50(85)86)56(91)77-45(27-49(68)84)64(99)81-23-11-14-47(81)61(96)72-40(19-21-48(67)83)55(90)74-43(25-36-15-17-38(18-16-36)105-106(102,103)104)58(93)75-42(24-35-12-9-8-10-13-35)59(94)78-46(30-82)60(95)76-44(28-51(87)88)57(92)71-34(5)65(100)101/h8-10,12-13,15-18,29,31-34,39-47,52-53,82,102-104,106H,6-7,11,14,19-28,30,66H2,1-5H3,(H2,67,83)(H2,68,84)(H,69,70)(H,71,92)(H,72,96)(H,73,97)(H,74,90)(H,75,93)(H,76,95)(H,77,91)(H,78,94)(H,79,89)(H,80,98)(H,85,86)(H,87,88)(H,100,101)/p+1/t32-,33-,34-,39-,40-,41-,42-,43-,44-,45-,46-,47-,52-,53-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P29353
P04629
Entrez Gene ID
NCBI Entrez Gene ID:
6464
4914
ASD
Information of known allosteric effects of PDB entries
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