Browse entries in the PDBbind-CN Database
HEADER 3U90_COMPLEX COMPND 3U90_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 154 SER GLN ILE ARG GLN ASN TYR SER THR GLU VAL GLU ALA SEQRES 2 A 154 ALA VAL ASN ARG LEU VAL ASN LEU TYR LEU ARG ALA SER SEQRES 3 A 154 TYR THR TYR LEU SER LEU GLY PHE TYR PHE ASP ARG ASP SEQRES 4 A 154 ASP VAL ALA LEU GLU GLY VAL CYS HIS PHE PHE ARG GLU SEQRES 5 A 154 LEU ALA GLU GLU LYS ARG GLU GLY ALA GLU ARG LEU LEU SEQRES 6 A 154 LYS MET GLN ASN GLN ARG GLY GLY ARG ALA LEU PHE GLN SEQRES 7 A 154 ASP LEU GLN LYS PRO SER GLN ASP GLU TRP GLY THR THR SEQRES 8 A 154 LEU ASP ALA MET LYS ALA ALA ILE VAL LEU GLU LYS SER SEQRES 9 A 154 LEU ASN GLN ALA LEU LEU ASP LEU HIS ALA LEU GLY SER SEQRES 10 A 154 ALA GLN ALA ASP PRO HIS LEU CYS ASP PHE LEU GLU SER SEQRES 11 A 154 HIS PHE LEU ASP GLU GLU VAL LYS LEU ILE LYS LYS MET SEQRES 12 A 154 GLY ASP HIS LEU THR ASN ILE GLN ARG LEU VAL SEQRES 1 A 14 GLN ALA GLY LEU GLY GLU TYR LEU PHE GLU ARG LEU THR SEQRES 2 A 14 LEU HET CD A 1 1 HET CD A 2 1 HET CD A 3 1 HET CD A 4 1 HET CD A 5 1 HET CD A 6 1 HET CD A 7 1 HET CD A 8 1 HET CD A 9 1 HET CD A 10 1 HET SDS A 349 42 ATOM 1 N SER A 2 52.692 18.601 22.868 1.00 31.68 N ATOM 2 CA SER A 2 51.768 18.121 21.838 1.00 28.11 C ATOM 3 C SER A 2 51.576 19.178 20.764 1.00 29.69 C ATOM 4 O SER A 2 51.431 20.363 21.076 1.00 31.68 O ATOM 5 CB SER A 2 50.409 17.769 22.446 1.00 28.77 C ATOM 6 OG SER A 2 49.409 17.725 21.438 1.00 26.95 O ATOM 7 HA SER A 2 52.201 17.225 21.393 1.00 0.00 H ATOM 8 HB2 SER A 2 50.140 18.523 23.185 1.00 0.00 H ATOM 9 HB3 SER A 2 50.474 16.795 22.930 1.00 0.00 H ATOM 10 HG SER A 2 48.538 17.496 21.849 1.00 0.00 H ATOM 11 HN3 SER A 2 52.305 19.462 23.305 1.00 0.00 H ATOM 12 HN2 SER A 2 53.613 18.814 22.434 1.00 0.00 H ATOM 13 HN1 SER A 2 52.812 17.866 23.594 1.00 0.00 H ATOM 14 N GLN A 3 51.569 18.748 19.504 1.00 27.02 N ATOM 15 CA GLN A 3 51.413 19.657 18.367 1.00 24.55 C ATOM 16 C GLN A 3 50.084 20.418 18.380 1.00 25.50 C ATOM 17 O GLN A 3 49.944 21.443 17.712 1.00 26.54 O ATOM 18 CB GLN A 3 51.519 18.872 17.064 1.00 25.03 C ATOM 19 CG GLN A 3 50.415 17.835 16.915 1.00 25.91 C ATOM 20 CD GLN A 3 50.618 16.925 15.725 1.00 29.57 C ATOM 21 OE1 GLN A 3 51.330 17.276 14.775 1.00 27.02 O ATOM 22 NE2 GLN A 3 50.004 15.731 15.774 1.00 20.60 N ATOM 23 HA GLN A 3 52.212 20.395 18.447 1.00 0.00 H ATOM 24 HB2 GLN A 3 51.458 19.570 16.229 1.00 0.00 H ATOM 25 HB3 GLN A 3 52.482 18.363 17.040 1.00 0.00 H ATOM 26 HG2 GLN A 3 50.386 17.225 17.818 1.00 0.00 H ATOM 27 HG3 GLN A 3 49.464 18.354 16.798 1.00 0.00 H ATOM 28 HE22 GLN A 3 49.416 15.482 16.595 1.00 0.00 H ATOM 29 HE21 GLN A 3 50.117 15.056 14.991 1.00 0.00 H ATOM 30 H GLN A 3 51.678 17.730 19.321 1.00 0.00 H ATOM 31 N ILE A 4 49.101 19.915 19.115 1.00 20.75 N ATOM 32 CA ILE A 4 47.777 20.526 19.085 1.00 20.93 C ATOM 33 C ILE A 4 47.463 21.315 20.355 1.00 20.13 C ATOM 34 O ILE A 4 46.510 22.089 20.393 1.00 20.14 O ATOM 35 CB ILE A 4 46.669 19.466 18.935 1.00 20.65 C ATOM 36 CG1 ILE A 4 46.567 18.627 20.216 1.00 17.94 C ATOM 37 CG2 ILE A 4 46.898 18.617 17.697 1.00 18.81 C ATOM 38 CD1 ILE A 4 45.379 17.684 20.224 1.00 19.22 C ATOM 39 HA ILE A 4 47.796 21.198 18.227 1.00 0.00 H ATOM 40 HB ILE A 4 45.710 19.965 18.796 1.00 0.00 H ATOM 41 HG12 ILE A 4 47.478 18.037 20.317 1.00 0.00 H ATOM 42 HG13 ILE A 4 46.478 19.303 21.066 1.00 0.00 H ATOM 43 HD11 ILE A 4 44.458 18.261 20.135 1.00 0.00 H ATOM 44 HD12 ILE A 4 45.459 16.993 19.385 1.00 0.00 H ATOM 45 HD13 ILE A 4 45.369 17.123 21.158 1.00 0.00 H ATOM 46 HG21 ILE A 4 46.895 19.256 16.814 1.00 0.00 H ATOM 47 HG22 ILE A 4 47.860 18.111 17.778 1.00 0.00 H ATOM 48 HG23 ILE A 4 46.103 17.876 17.614 1.00 0.00 H ATOM 49 H ILE A 4 49.275 19.083 19.714 1.00 0.00 H ATOM 50 N ARG A 5 48.257 21.102 21.397 1.00 20.44 N ATOM 51 CA ARG A 5 47.971 21.688 22.697 1.00 18.90 C ATOM 52 C ARG A 5 48.029 23.210 22.639 1.00 19.95 C ATOM 53 O ARG A 5 49.014 23.779 22.171 1.00 20.13 O ATOM 54 CB ARG A 5 48.967 21.167 23.732 1.00 20.82 C ATOM 55 CG ARG A 5 48.607 21.535 25.162 1.00 21.00 C ATOM 56 CD ARG A 5 49.650 21.008 26.133 1.00 23.71 C ATOM 57 NE ARG A 5 49.208 21.146 27.518 1.00 22.41 N ATOM 58 CZ ARG A 5 49.313 20.183 28.421 1.00 20.05 C ATOM 59 NH1 ARG A 5 49.861 19.025 28.076 1.00 19.38 N ATOM 60 NH2 ARG A 5 48.886 20.380 29.664 1.00 19.99 N ATOM 61 HA ARG A 5 46.961 21.398 22.987 1.00 0.00 H ATOM 62 HB2 ARG A 5 49.007 20.080 23.655 1.00 0.00 H ATOM 63 HB3 ARG A 5 49.949 21.583 23.506 1.00 0.00 H ATOM 64 HG2 ARG A 5 48.553 22.620 25.249 1.00 0.00 H ATOM 65 HG3 ARG A 5 47.637 21.103 25.409 1.00 0.00 H ATOM 66 HD2 ARG A 5 50.575 21.568 25.998 1.00 0.00 H ATOM 67 HD3 ARG A 5 49.831 19.954 25.922 1.00 0.00 H ATOM 68 HE ARG A 5 48.787 22.051 27.811 1.00 0.00 H ATOM 69 HH12 ARG A 5 49.949 18.262 28.777 1.00 0.00 H ATOM 70 HH11 ARG A 5 50.203 18.880 27.105 1.00 0.00 H ATOM 71 HH22 ARG A 5 48.971 19.621 30.369 1.00 0.00 H ATOM 72 HH21 ARG A 5 48.467 21.294 29.931 1.00 0.00 H ATOM 73 H ARG A 5 49.100 20.504 21.282 1.00 0.00 H ATOM 74 N GLN A 6 46.975 23.867 23.121 1.00 18.90 N ATOM 75 CA GLN A 6 46.914 25.324 23.098 1.00 19.94 C ATOM 76 C GLN A 6 46.043 25.827 24.236 1.00 19.39 C ATOM 77 O GLN A 6 44.869 25.466 24.330 1.00 17.85 O ATOM 78 CB GLN A 6 46.366 25.810 21.749 1.00 19.65 C ATOM 79 CG GLN A 6 46.448 27.325 21.521 1.00 19.58 C ATOM 80 CD GLN A 6 46.000 27.726 20.113 1.00 20.03 C ATOM 81 OE1 GLN A 6 45.361 26.946 19.397 1.00 20.73 O ATOM 82 NE2 GLN A 6 46.346 28.938 19.711 1.00 21.90 N ATOM 83 HA GLN A 6 47.921 25.722 23.227 1.00 0.00 H ATOM 84 HB2 GLN A 6 46.931 25.318 20.958 1.00 0.00 H ATOM 85 HB3 GLN A 6 45.319 25.515 21.683 1.00 0.00 H ATOM 86 HG2 GLN A 6 45.808 27.824 22.248 1.00 0.00 H ATOM 87 HG3 GLN A 6 47.480 27.646 21.666 1.00 0.00 H ATOM 88 HE22 GLN A 6 46.884 29.563 20.345 1.00 0.00 H ATOM 89 HE21 GLN A 6 46.080 29.266 18.761 1.00 0.00 H ATOM 90 H GLN A 6 46.180 23.330 23.522 1.00 0.00 H ATOM 91 N ASN A 7 46.624 26.643 25.113 1.00 19.34 N ATOM 92 CA ASN A 7 45.891 27.172 26.263 1.00 18.66 C ATOM 93 C ASN A 7 45.397 26.105 27.247 1.00 19.60 C ATOM 94 O ASN A 7 44.391 26.301 27.930 1.00 18.29 O ATOM 95 CB ASN A 7 44.701 28.016 25.814 1.00 19.36 C ATOM 96 CG ASN A 7 44.184 28.909 26.929 1.00 20.83 C ATOM 97 OD1 ASN A 7 44.969 29.517 27.640 1.00 22.62 O ATOM 98 ND2 ASN A 7 42.868 28.961 27.106 1.00 21.07 N ATOM 99 HA ASN A 7 46.619 27.784 26.795 1.00 0.00 H ATOM 100 HB2 ASN A 7 45.009 28.641 24.976 1.00 0.00 H ATOM 101 HB3 ASN A 7 43.898 27.351 25.494 1.00 0.00 H ATOM 102 HD22 ASN A 7 42.237 28.426 26.476 1.00 0.00 H ATOM 103 HD21 ASN A 7 42.469 29.537 27.875 1.00 0.00 H ATOM 104 H ASN A 7 47.620 26.910 24.978 1.00 0.00 H ATOM 105 N TYR A 8 46.104 24.982 27.318 1.00 19.53 N ATOM 106 CA TYR A 8 45.720 23.880 28.198 1.00 18.36 C ATOM 107 C TYR A 8 46.788 23.712 29.280 1.00 19.61 C ATOM 108 O TYR A 8 47.867 23.196 29.013 1.00 19.56 O ATOM 109 CB TYR A 8 45.575 22.587 27.387 1.00 19.06 C ATOM 110 CG TYR A 8 44.804 21.477 28.090 1.00 19.07 C ATOM 111 CD1 TYR A 8 43.511 21.695 28.568 1.00 17.53 C ATOM 112 CD2 TYR A 8 45.360 20.208 28.251 1.00 18.94 C ATOM 113 CE1 TYR A 8 42.797 20.684 29.205 1.00 18.32 C ATOM 114 CE2 TYR A 8 44.646 19.181 28.893 1.00 16.72 C ATOM 115 CZ TYR A 8 43.369 19.428 29.361 1.00 18.92 C ATOM 116 OH TYR A 8 42.657 18.431 30.001 1.00 18.85 O ATOM 117 HA TYR A 8 44.761 24.101 28.667 1.00 0.00 H ATOM 118 HB3 TYR A 8 46.574 22.215 27.159 1.00 0.00 H ATOM 119 HB2 TYR A 8 45.057 22.825 26.458 1.00 0.00 H ATOM 120 HD2 TYR A 8 46.363 20.010 27.873 1.00 0.00 H ATOM 121 HE2 TYR A 8 45.096 18.197 29.021 1.00 0.00 H ATOM 122 HE1 TYR A 8 41.792 20.877 29.580 1.00 0.00 H ATOM 123 HD1 TYR A 8 43.052 22.675 28.440 1.00 0.00 H ATOM 124 HH TYR A 8 42.541 17.664 29.386 1.00 0.00 H ATOM 125 H TYR A 8 46.956 24.884 26.730 1.00 0.00 H ATOM 126 N SER A 9 46.499 24.164 30.493 1.00 19.17 N ATOM 127 CA SER A 9 47.507 24.151 31.551 1.00 21.23 C ATOM 128 C SER A 9 47.806 22.740 32.052 1.00 21.74 C ATOM 129 O SER A 9 46.975 21.833 31.949 1.00 18.33 O ATOM 130 CB SER A 9 47.083 25.051 32.715 1.00 19.05 C ATOM 131 OG SER A 9 45.917 24.543 33.345 1.00 21.95 O ATOM 132 HA SER A 9 48.427 24.542 31.116 1.00 0.00 H ATOM 133 HB2 SER A 9 46.878 26.052 32.337 1.00 0.00 H ATOM 134 HB3 SER A 9 47.892 25.098 33.444 1.00 0.00 H ATOM 135 HG SER A 9 45.179 24.502 32.687 1.00 0.00 H ATOM 136 H SER A 9 45.547 24.531 30.693 1.00 0.00 H ATOM 137 N THR A 10 49.001 22.558 32.604 1.00 21.63 N ATOM 138 CA THR A 10 49.356 21.286 33.209 1.00 21.43 C ATOM 139 C THR A 10 48.456 21.032 34.422 1.00 21.62 C ATOM 140 O THR A 10 48.128 19.888 34.734 1.00 20.51 O ATOM 141 CB THR A 10 50.839 21.263 33.633 1.00 25.74 C ATOM 142 OG1 THR A 10 51.085 22.336 34.543 1.00 27.51 O ATOM 143 CG2 THR A 10 51.737 21.443 32.423 1.00 26.07 C ATOM 144 HA THR A 10 49.209 20.497 32.471 1.00 0.00 H ATOM 145 HB THR A 10 51.053 20.304 34.105 1.00 0.00 H ATOM 146 HG1 THR A 10 50.509 22.229 35.341 1.00 0.00 H ATOM 147 HG23 THR A 10 51.561 20.631 31.718 1.00 0.00 H ATOM 148 HG21 THR A 10 51.513 22.396 31.944 1.00 0.00 H ATOM 149 HG22 THR A 10 52.780 21.431 32.741 1.00 0.00 H ATOM 150 H THR A 10 49.691 23.336 32.603 1.00 0.00 H ATOM 151 N GLU A 11 48.039 22.108 35.087 1.00 20.69 N ATOM 152 CA GLU A 11 47.189 21.998 36.267 1.00 20.57 C ATOM 153 C GLU A 11 45.834 21.387 35.917 1.00 19.49 C ATOM 154 O GLU A 11 45.357 20.484 36.604 1.00 17.58 O ATOM 155 CB GLU A 11 46.986 23.362 36.932 1.00 24.36 C ATOM 156 CG GLU A 11 48.228 23.906 37.638 1.00 25.64 C ATOM 157 CD GLU A 11 49.136 24.687 36.702 1.00 29.30 C ATOM 158 OE1 GLU A 11 50.156 25.220 37.188 1.00 30.06 O ATOM 159 OE2 GLU A 11 48.830 24.770 35.485 1.00 24.09 O ATOM 160 HA GLU A 11 47.698 21.339 36.970 1.00 0.00 H ATOM 161 HB2 GLU A 11 46.689 24.076 36.164 1.00 0.00 H ATOM 162 HB3 GLU A 11 46.188 23.268 37.668 1.00 0.00 H ATOM 163 HG2 GLU A 11 47.910 24.564 38.447 1.00 0.00 H ATOM 164 HG3 GLU A 11 48.790 23.069 38.052 1.00 0.00 H ATOM 165 H GLU A 11 48.327 23.051 34.756 1.00 0.00 H ATOM 166 N VAL A 12 45.210 21.898 34.862 1.00 17.59 N ATOM 167 CA VAL A 12 43.948 21.341 34.390 1.00 17.36 C ATOM 168 C VAL A 12 44.126 19.900 33.902 1.00 18.73 C ATOM 169 O VAL A 12 43.336 19.017 34.247 1.00 17.45 O ATOM 170 CB VAL A 12 43.322 22.205 33.292 1.00 18.31 C ATOM 171 CG1 VAL A 12 42.240 21.416 32.548 1.00 17.01 C ATOM 172 CG2 VAL A 12 42.741 23.503 33.910 1.00 16.87 C ATOM 173 HA VAL A 12 43.265 21.334 35.239 1.00 0.00 H ATOM 174 HB VAL A 12 44.091 22.482 32.571 1.00 0.00 H ATOM 175 HG11 VAL A 12 42.685 20.530 32.095 1.00 0.00 H ATOM 176 HG12 VAL A 12 41.464 21.115 33.251 1.00 0.00 H ATOM 177 HG13 VAL A 12 41.804 22.044 31.771 1.00 0.00 H ATOM 178 HG21 VAL A 12 41.978 23.244 34.644 1.00 0.00 H ATOM 179 HG22 VAL A 12 43.541 24.062 34.396 1.00 0.00 H ATOM 180 HG23 VAL A 12 42.298 24.112 33.122 1.00 0.00 H ATOM 181 H VAL A 12 45.629 22.709 34.364 1.00 0.00 H ATOM 182 N GLU A 13 45.156 19.666 33.094 1.00 18.54 N ATOM 183 CA GLU A 13 45.458 18.311 32.633 1.00 19.33 C ATOM 184 C GLU A 13 45.476 17.324 33.791 1.00 19.24 C ATOM 185 O GLU A 13 44.856 16.257 33.725 1.00 17.87 O ATOM 186 CB GLU A 13 46.808 18.268 31.916 1.00 19.99 C ATOM 187 CG GLU A 13 47.180 16.895 31.366 1.00 19.70 C ATOM 188 CD GLU A 13 48.533 16.909 30.680 1.00 21.94 C ATOM 189 OE1 GLU A 13 48.934 15.880 30.095 1.00 22.29 O ATOM 190 OE2 GLU A 13 49.202 17.963 30.736 1.00 25.71 O ATOM 191 HA GLU A 13 44.669 18.025 31.937 1.00 0.00 H ATOM 192 HB2 GLU A 13 46.777 18.973 31.085 1.00 0.00 H ATOM 193 HB3 GLU A 13 47.580 18.575 32.622 1.00 0.00 H ATOM 194 HG2 GLU A 13 47.209 16.181 32.189 1.00 0.00 H ATOM 195 HG3 GLU A 13 46.422 16.586 30.646 1.00 0.00 H ATOM 196 H GLU A 13 45.755 20.458 32.785 1.00 0.00 H ATOM 197 N ALA A 14 46.201 17.672 34.853 1.00 18.46 N ATOM 198 CA ALA A 14 46.323 16.785 36.012 1.00 21.26 C ATOM 199 C ALA A 14 44.994 16.619 36.749 1.00 20.72 C ATOM 200 O ALA A 14 44.650 15.517 37.172 1.00 18.54 O ATOM 201 CB ALA A 14 47.409 17.284 36.971 1.00 20.64 C ATOM 202 HA ALA A 14 46.614 15.805 35.635 1.00 0.00 H ATOM 203 HB1 ALA A 14 48.366 17.314 36.450 1.00 0.00 H ATOM 204 HB2 ALA A 14 47.152 18.284 37.320 1.00 0.00 H ATOM 205 HB3 ALA A 14 47.479 16.607 37.823 1.00 0.00 H ATOM 206 H ALA A 14 46.689 18.590 34.859 1.00 0.00 H ATOM 207 N ALA A 15 44.249 17.713 36.895 1.00 17.19 N ATOM 208 CA ALA A 15 42.970 17.662 37.590 1.00 19.28 C ATOM 209 C ALA A 15 41.956 16.830 36.807 1.00 18.22 C ATOM 210 O ALA A 15 41.087 16.175 37.392 1.00 16.77 O ATOM 211 CB ALA A 15 42.434 19.065 37.823 1.00 18.44 C ATOM 212 HA ALA A 15 43.130 17.184 38.557 1.00 0.00 H ATOM 213 HB1 ALA A 15 43.144 19.628 38.428 1.00 0.00 H ATOM 214 HB2 ALA A 15 42.297 19.564 36.864 1.00 0.00 H ATOM 215 HB3 ALA A 15 41.478 19.006 38.343 1.00 0.00 H ATOM 216 H ALA A 15 44.585 18.617 36.507 1.00 0.00 H ATOM 217 N VAL A 16 42.052 16.879 35.484 1.00 15.18 N ATOM 218 CA VAL A 16 41.183 16.065 34.639 1.00 16.80 C ATOM 219 C VAL A 16 41.491 14.581 34.869 1.00 14.90 C ATOM 220 O VAL A 16 40.579 13.770 34.985 1.00 16.55 O ATOM 221 CB VAL A 16 41.295 16.449 33.152 1.00 16.59 C ATOM 222 CG1 VAL A 16 40.751 15.345 32.257 1.00 16.94 C ATOM 223 CG2 VAL A 16 40.556 17.783 32.868 1.00 16.96 C ATOM 224 HA VAL A 16 40.148 16.257 34.921 1.00 0.00 H ATOM 225 HB VAL A 16 42.353 16.583 32.925 1.00 0.00 H ATOM 226 HG11 VAL A 16 41.319 14.430 32.425 1.00 0.00 H ATOM 227 HG12 VAL A 16 39.701 15.171 32.494 1.00 0.00 H ATOM 228 HG13 VAL A 16 40.844 15.646 31.214 1.00 0.00 H ATOM 229 HG21 VAL A 16 39.502 17.675 33.124 1.00 0.00 H ATOM 230 HG22 VAL A 16 40.998 18.577 33.470 1.00 0.00 H ATOM 231 HG23 VAL A 16 40.651 18.031 31.811 1.00 0.00 H ATOM 232 H VAL A 16 42.756 17.506 35.043 1.00 0.00 H ATOM 233 N ASN A 17 42.772 14.228 34.968 1.00 15.33 N ATOM 234 CA ASN A 17 43.122 12.842 35.280 1.00 16.92 C ATOM 235 C ASN A 17 42.580 12.411 36.643 1.00 15.29 C ATOM 236 O ASN A 17 42.102 11.293 36.806 1.00 15.99 O ATOM 237 CB ASN A 17 44.629 12.596 35.189 1.00 17.32 C ATOM 238 CG ASN A 17 45.110 12.505 33.760 1.00 18.44 C ATOM 239 OD1 ASN A 17 44.367 12.076 32.867 1.00 18.27 O ATOM 240 ND2 ASN A 17 46.344 12.930 33.523 1.00 18.51 N ATOM 241 HA ASN A 17 42.642 12.224 34.521 1.00 0.00 H ATOM 242 HB2 ASN A 17 45.149 13.417 35.683 1.00 0.00 H ATOM 243 HB3 ASN A 17 44.863 11.661 35.698 1.00 0.00 H ATOM 244 HD22 ASN A 17 46.932 13.282 34.305 1.00 0.00 H ATOM 245 HD21 ASN A 17 46.724 12.911 32.555 1.00 0.00 H ATOM 246 H ASN A 17 43.521 14.935 34.824 1.00 0.00 H ATOM 247 N ARG A 18 42.646 13.296 37.627 1.00 18.11 N ATOM 248 CA ARG A 18 42.121 12.942 38.945 1.00 16.61 C ATOM 249 C ARG A 18 40.607 12.752 38.877 1.00 18.42 C ATOM 250 O ARG A 18 40.047 11.866 39.539 1.00 16.38 O ATOM 251 CB ARG A 18 42.493 13.995 39.999 1.00 19.10 C ATOM 252 CG ARG A 18 43.974 13.976 40.388 1.00 24.15 C ATOM 253 CD ARG A 18 44.263 14.868 41.593 1.00 25.80 C ATOM 254 NE ARG A 18 44.063 16.281 41.279 1.00 26.59 N ATOM 255 CZ ARG A 18 45.001 17.059 40.748 1.00 24.88 C ATOM 256 NH1 ARG A 18 46.199 16.560 40.460 1.00 27.09 N ATOM 257 NH2 ARG A 18 44.742 18.328 40.503 1.00 26.30 N ATOM 258 HA ARG A 18 42.578 12.000 39.249 1.00 0.00 H ATOM 259 HB2 ARG A 18 42.254 14.981 39.601 1.00 0.00 H ATOM 260 HB3 ARG A 18 41.899 13.812 40.894 1.00 0.00 H ATOM 261 HG2 ARG A 18 44.261 12.953 40.631 1.00 0.00 H ATOM 262 HG3 ARG A 18 44.565 14.326 39.541 1.00 0.00 H ATOM 263 HD2 ARG A 18 45.297 14.718 41.904 1.00 0.00 H ATOM 264 HD3 ARG A 18 43.595 14.589 42.408 1.00 0.00 H ATOM 265 HE ARG A 18 43.134 16.702 41.483 1.00 0.00 H ATOM 266 HH12 ARG A 18 46.931 17.171 40.045 1.00 0.00 H ATOM 267 HH11 ARG A 18 46.404 15.558 40.650 1.00 0.00 H ATOM 268 HH22 ARG A 18 45.475 18.938 40.088 1.00 0.00 H ATOM 269 HH21 ARG A 18 43.805 18.720 40.725 1.00 0.00 H ATOM 270 H ARG A 18 43.067 14.233 37.464 1.00 0.00 H ATOM 271 N LEU A 19 39.949 13.588 38.079 1.00 15.94 N ATOM 272 CA LEU A 19 38.493 13.520 37.936 1.00 17.01 C ATOM 273 C LEU A 19 38.050 12.230 37.240 1.00 17.55 C ATOM 274 O LEU A 19 37.014 11.663 37.573 1.00 17.40 O ATOM 275 CB LEU A 19 37.958 14.742 37.176 1.00 15.26 C ATOM 276 CG LEU A 19 36.427 14.899 37.206 1.00 17.77 C ATOM 277 CD1 LEU A 19 35.931 15.048 38.643 1.00 18.93 C ATOM 278 CD2 LEU A 19 35.982 16.094 36.387 1.00 17.59 C ATOM 279 HA LEU A 19 38.072 13.520 38.942 1.00 0.00 H ATOM 280 HB2 LEU A 19 38.400 15.636 37.616 1.00 0.00 H ATOM 281 HB3 LEU A 19 38.271 14.658 36.135 1.00 0.00 H ATOM 282 HG LEU A 19 35.995 13.999 36.769 1.00 0.00 H ATOM 283 HD21 LEU A 19 36.433 16.999 36.793 1.00 0.00 H ATOM 284 HD22 LEU A 19 36.298 15.962 35.352 1.00 0.00 H ATOM 285 HD23 LEU A 19 34.896 16.177 36.429 1.00 0.00 H ATOM 286 HD11 LEU A 19 36.207 14.162 39.215 1.00 0.00 H ATOM 287 HD12 LEU A 19 36.386 15.930 39.094 1.00 0.00 H ATOM 288 HD13 LEU A 19 34.847 15.158 38.642 1.00 0.00 H ATOM 289 H LEU A 19 40.480 14.305 37.545 1.00 0.00 H ATOM 290 N VAL A 20 38.835 11.767 36.272 1.00 14.79 N ATOM 291 CA VAL A 20 38.587 10.468 35.668 1.00 15.06 C ATOM 292 C VAL A 20 38.630 9.364 36.743 1.00 16.21 C ATOM 293 O VAL A 20 37.769 8.483 36.778 1.00 15.19 O ATOM 294 CB VAL A 20 39.628 10.161 34.571 1.00 15.35 C ATOM 295 CG1 VAL A 20 39.590 8.683 34.199 1.00 16.11 C ATOM 296 CG2 VAL A 20 39.410 11.067 33.341 1.00 14.82 C ATOM 297 HA VAL A 20 37.597 10.493 35.212 1.00 0.00 H ATOM 298 HB VAL A 20 40.622 10.378 34.961 1.00 0.00 H ATOM 299 HG11 VAL A 20 39.815 8.082 35.080 1.00 0.00 H ATOM 300 HG12 VAL A 20 38.597 8.429 33.828 1.00 0.00 H ATOM 301 HG13 VAL A 20 40.331 8.486 33.424 1.00 0.00 H ATOM 302 HG21 VAL A 20 38.412 10.896 32.937 1.00 0.00 H ATOM 303 HG22 VAL A 20 39.509 12.111 33.638 1.00 0.00 H ATOM 304 HG23 VAL A 20 40.156 10.832 32.581 1.00 0.00 H ATOM 305 H VAL A 20 39.637 12.342 35.943 1.00 0.00 H ATOM 306 N ASN A 21 39.626 9.417 37.623 1.00 14.90 N ATOM 307 CA ASN A 21 39.715 8.437 38.701 1.00 15.30 C ATOM 308 C ASN A 21 38.482 8.506 39.600 1.00 17.93 C ATOM 309 O ASN A 21 37.938 7.478 39.987 1.00 16.57 O ATOM 310 CB ASN A 21 40.993 8.627 39.527 1.00 17.61 C ATOM 311 CG ASN A 21 41.270 7.451 40.465 1.00 18.04 C ATOM 312 OD1 ASN A 21 40.847 7.451 41.626 1.00 19.39 O ATOM 313 ND2 ASN A 21 42.000 6.453 39.967 1.00 15.56 N ATOM 314 HA ASN A 21 39.756 7.448 38.244 1.00 0.00 H ATOM 315 HB2 ASN A 21 41.836 8.736 38.845 1.00 0.00 H ATOM 316 HB3 ASN A 21 40.891 9.533 40.124 1.00 0.00 H ATOM 317 HD22 ASN A 21 42.335 6.495 38.983 1.00 0.00 H ATOM 318 HD21 ASN A 21 42.234 5.633 40.562 1.00 0.00 H ATOM 319 H ASN A 21 40.347 10.162 37.542 1.00 0.00 H ATOM 320 N LEU A 22 38.050 9.723 39.925 1.00 16.43 N ATOM 321 CA LEU A 22 36.850 9.914 40.739 1.00 20.04 C ATOM 322 C LEU A 22 35.599 9.325 40.087 1.00 16.90 C ATOM 323 O LEU A 22 34.776 8.700 40.769 1.00 17.07 O ATOM 324 CB LEU A 22 36.626 11.407 41.023 1.00 19.37 C ATOM 325 CG LEU A 22 37.490 12.068 42.101 1.00 25.44 C ATOM 326 CD1 LEU A 22 37.231 13.576 42.135 1.00 29.01 C ATOM 327 CD2 LEU A 22 37.201 11.455 43.474 1.00 28.66 C ATOM 328 HA LEU A 22 37.018 9.380 41.674 1.00 0.00 H ATOM 329 HB2 LEU A 22 36.801 11.945 40.091 1.00 0.00 H ATOM 330 HB3 LEU A 22 35.585 11.528 41.321 1.00 0.00 H ATOM 331 HG LEU A 22 38.538 11.894 41.857 1.00 0.00 H ATOM 332 HD21 LEU A 22 36.150 11.603 43.723 1.00 0.00 H ATOM 333 HD22 LEU A 22 37.423 10.388 43.448 1.00 0.00 H ATOM 334 HD23 LEU A 22 37.825 11.939 44.225 1.00 0.00 H ATOM 335 HD11 LEU A 22 37.478 14.008 41.165 1.00 0.00 H ATOM 336 HD12 LEU A 22 36.180 13.758 42.358 1.00 0.00 H ATOM 337 HD13 LEU A 22 37.852 14.033 42.906 1.00 0.00 H ATOM 338 H LEU A 22 38.577 10.556 39.593 1.00 0.00 H ATOM 339 N TYR A 23 35.440 9.547 38.779 1.00 16.15 N ATOM 340 CA TYR A 23 34.276 9.031 38.053 1.00 15.97 C ATOM 341 C TYR A 23 34.280 7.505 37.929 1.00 18.43 C ATOM 342 O TYR A 23 33.241 6.860 38.073 1.00 16.17 O ATOM 343 CB TYR A 23 34.130 9.706 36.678 1.00 16.32 C ATOM 344 CG TYR A 23 33.234 10.923 36.744 1.00 17.18 C ATOM 345 CD1 TYR A 23 31.920 10.867 36.280 1.00 18.37 C ATOM 346 CD2 TYR A 23 33.681 12.108 37.317 1.00 18.78 C ATOM 347 CE1 TYR A 23 31.077 11.968 36.366 1.00 20.20 C ATOM 348 CE2 TYR A 23 32.849 13.218 37.400 1.00 19.15 C ATOM 349 CZ TYR A 23 31.549 13.133 36.930 1.00 22.80 C ATOM 350 OH TYR A 23 30.723 14.223 37.015 1.00 23.78 O ATOM 351 HA TYR A 23 33.401 9.288 38.650 1.00 0.00 H ATOM 352 HB3 TYR A 23 33.702 8.990 35.976 1.00 0.00 H ATOM 353 HB2 TYR A 23 35.116 10.012 36.328 1.00 0.00 H ATOM 354 HD2 TYR A 23 34.697 12.167 37.706 1.00 0.00 H ATOM 355 HE2 TYR A 23 33.217 14.149 37.832 1.00 0.00 H ATOM 356 HE1 TYR A 23 30.055 11.911 35.992 1.00 0.00 H ATOM 357 HD1 TYR A 23 31.547 9.941 35.841 1.00 0.00 H ATOM 358 HH TYR A 23 29.837 13.994 36.637 1.00 0.00 H ATOM 359 H TYR A 23 36.157 10.098 38.265 1.00 0.00 H ATOM 360 N LEU A 24 35.444 6.923 37.656 1.00 15.44 N ATOM 361 CA LEU A 24 35.538 5.465 37.629 1.00 17.84 C ATOM 362 C LEU A 24 35.299 4.873 39.019 1.00 16.00 C ATOM 363 O LEU A 24 34.659 3.838 39.143 1.00 18.72 O ATOM 364 CB LEU A 24 36.884 5.008 37.058 1.00 15.55 C ATOM 365 CG LEU A 24 37.109 5.343 35.573 1.00 19.59 C ATOM 366 CD1 LEU A 24 38.523 4.970 35.153 1.00 19.33 C ATOM 367 CD2 LEU A 24 36.072 4.644 34.686 1.00 20.24 C ATOM 368 HA LEU A 24 34.754 5.093 36.969 1.00 0.00 H ATOM 369 HB2 LEU A 24 37.676 5.484 37.636 1.00 0.00 H ATOM 370 HB3 LEU A 24 36.951 3.926 37.175 1.00 0.00 H ATOM 371 HG LEU A 24 36.984 6.418 35.444 1.00 0.00 H ATOM 372 HD21 LEU A 24 36.152 3.565 34.817 1.00 0.00 H ATOM 373 HD22 LEU A 24 35.072 4.972 34.970 1.00 0.00 H ATOM 374 HD23 LEU A 24 36.257 4.900 33.643 1.00 0.00 H ATOM 375 HD11 LEU A 24 39.239 5.529 35.756 1.00 0.00 H ATOM 376 HD12 LEU A 24 38.675 3.901 35.303 1.00 0.00 H ATOM 377 HD13 LEU A 24 38.664 5.214 34.100 1.00 0.00 H ATOM 378 H LEU A 24 36.285 7.504 37.462 1.00 0.00 H ATOM 379 N ARG A 25 35.798 5.531 40.068 1.00 15.24 N ATOM 380 CA ARG A 25 35.529 5.076 41.434 1.00 17.14 C ATOM 381 C ARG A 25 34.025 5.074 41.690 1.00 17.63 C ATOM 382 O ARG A 25 33.482 4.137 42.284 1.00 17.49 O ATOM 383 CB ARG A 25 36.198 5.995 42.463 1.00 19.18 C ATOM 384 CG ARG A 25 37.670 5.698 42.745 1.00 22.13 C ATOM 385 CD ARG A 25 38.276 6.771 43.668 1.00 24.80 C ATOM 386 NE ARG A 25 37.547 6.888 44.930 1.00 24.89 N ATOM 387 CZ ARG A 25 37.688 7.892 45.793 1.00 30.15 C ATOM 388 NH1 ARG A 25 38.546 8.881 45.546 1.00 24.35 N ATOM 389 NH2 ARG A 25 36.972 7.903 46.913 1.00 31.54 N ATOM 390 HA ARG A 25 35.934 4.069 41.538 1.00 0.00 H ATOM 391 HB2 ARG A 25 36.125 7.019 42.098 1.00 0.00 H ATOM 392 HB3 ARG A 25 35.650 5.905 43.401 1.00 0.00 H ATOM 393 HG2 ARG A 25 37.753 4.724 43.227 1.00 0.00 H ATOM 394 HG3 ARG A 25 38.219 5.684 41.803 1.00 0.00 H ATOM 395 HD2 ARG A 25 38.248 7.732 43.155 1.00 0.00 H ATOM 396 HD3 ARG A 25 39.311 6.506 43.883 1.00 0.00 H ATOM 397 HE ARG A 25 36.871 6.135 45.170 1.00 0.00 H ATOM 398 HH12 ARG A 25 38.650 9.661 46.226 1.00 0.00 H ATOM 399 HH11 ARG A 25 39.112 8.873 44.674 1.00 0.00 H ATOM 400 HH22 ARG A 25 37.078 8.685 47.590 1.00 0.00 H ATOM 401 HH21 ARG A 25 36.306 7.130 47.112 1.00 0.00 H ATOM 402 H ARG A 25 36.384 6.376 39.914 1.00 0.00 H ATOM 403 N ALA A 26 33.362 6.147 41.254 1.00 14.86 N ATOM 404 CA ALA A 26 31.916 6.280 41.411 1.00 15.84 C ATOM 405 C ALA A 26 31.195 5.177 40.637 1.00 15.34 C ATOM 406 O ALA A 26 30.253 4.566 41.138 1.00 14.81 O ATOM 407 CB ALA A 26 31.458 7.653 40.932 1.00 17.91 C ATOM 408 HA ALA A 26 31.668 6.180 42.468 1.00 0.00 H ATOM 409 HB1 ALA A 26 31.954 8.425 41.520 1.00 0.00 H ATOM 410 HB2 ALA A 26 31.716 7.774 39.880 1.00 0.00 H ATOM 411 HB3 ALA A 26 30.378 7.738 41.055 1.00 0.00 H ATOM 412 H ALA A 26 33.891 6.912 40.788 1.00 0.00 H ATOM 413 N SER A 27 31.641 4.919 39.416 1.00 16.89 N ATOM 414 CA SER A 27 31.049 3.838 38.631 1.00 15.81 C ATOM 415 C SER A 27 31.177 2.502 39.366 1.00 17.82 C ATOM 416 O SER A 27 30.236 1.698 39.388 1.00 14.62 O ATOM 417 CB SER A 27 31.706 3.758 37.255 1.00 17.59 C ATOM 418 OG SER A 27 31.087 2.764 36.464 1.00 19.42 O ATOM 419 HA SER A 27 29.989 4.052 38.497 1.00 0.00 H ATOM 420 HB2 SER A 27 32.762 3.514 37.376 1.00 0.00 H ATOM 421 HB3 SER A 27 31.612 4.723 36.756 1.00 0.00 H ATOM 422 HG SER A 27 30.129 2.984 36.350 1.00 0.00 H ATOM 423 H SER A 27 32.414 5.487 39.015 1.00 0.00 H ATOM 424 N TYR A 28 32.342 2.275 39.970 1.00 14.91 N ATOM 425 CA TYR A 28 32.608 1.042 40.727 1.00 15.72 C ATOM 426 C TYR A 28 31.675 0.964 41.932 1.00 15.25 C ATOM 427 O TYR A 28 31.134 -0.088 42.249 1.00 14.62 O ATOM 428 CB TYR A 28 34.069 1.047 41.216 1.00 14.03 C ATOM 429 CG TYR A 28 34.695 -0.313 41.520 1.00 14.21 C ATOM 430 CD1 TYR A 28 34.068 -1.510 41.171 1.00 15.80 C ATOM 431 CD2 TYR A 28 35.922 -0.388 42.166 1.00 14.84 C ATOM 432 CE1 TYR A 28 34.681 -2.763 41.457 1.00 15.85 C ATOM 433 CE2 TYR A 28 36.527 -1.612 42.453 1.00 14.26 C ATOM 434 CZ TYR A 28 35.907 -2.793 42.102 1.00 15.60 C ATOM 435 OH TYR A 28 36.543 -3.990 42.406 1.00 14.22 O ATOM 436 HA TYR A 28 32.438 0.181 40.081 1.00 0.00 H ATOM 437 HB3 TYR A 28 34.110 1.641 42.129 1.00 0.00 H ATOM 438 HB2 TYR A 28 34.674 1.525 40.445 1.00 0.00 H ATOM 439 HD2 TYR A 28 36.426 0.534 42.457 1.00 0.00 H ATOM 440 HE2 TYR A 28 37.493 -1.635 42.957 1.00 0.00 H ATOM 441 HE1 TYR A 28 34.189 -3.692 41.170 1.00 0.00 H ATOM 442 HD1 TYR A 28 33.098 -1.485 40.674 1.00 0.00 H ATOM 443 HH TYR A 28 35.985 -4.747 42.097 1.00 0.00 H ATOM 444 H TYR A 28 33.090 2.995 39.904 1.00 0.00 H ATOM 445 N THR A 29 31.503 2.086 42.623 1.00 14.19 N ATOM 446 CA THR A 29 30.612 2.125 43.775 1.00 15.30 C ATOM 447 C THR A 29 29.173 1.755 43.368 1.00 14.42 C ATOM 448 O THR A 29 28.505 0.971 44.043 1.00 14.22 O ATOM 449 CB THR A 29 30.672 3.506 44.461 1.00 17.12 C ATOM 450 OG1 THR A 29 31.990 3.697 45.010 1.00 15.80 O ATOM 451 CG2 THR A 29 29.631 3.615 45.586 1.00 16.32 C ATOM 452 HA THR A 29 30.948 1.381 44.498 1.00 0.00 H ATOM 453 HB THR A 29 30.452 4.273 43.719 1.00 0.00 H ATOM 454 HG1 THR A 29 32.037 4.581 45.452 1.00 0.00 H ATOM 455 HG23 THR A 29 28.633 3.471 45.171 1.00 0.00 H ATOM 456 HG21 THR A 29 29.828 2.850 46.337 1.00 0.00 H ATOM 457 HG22 THR A 29 29.696 4.602 46.045 1.00 0.00 H ATOM 458 H THR A 29 32.011 2.947 42.338 1.00 0.00 H ATOM 459 N TYR A 30 28.707 2.299 42.249 1.00 16.18 N ATOM 460 CA TYR A 30 27.352 1.991 41.786 1.00 14.81 C ATOM 461 C TYR A 30 27.203 0.550 41.314 1.00 15.10 C ATOM 462 O TYR A 30 26.126 -0.024 41.424 1.00 14.85 O ATOM 463 CB TYR A 30 26.917 2.955 40.683 1.00 14.62 C ATOM 464 CG TYR A 30 26.560 4.325 41.208 1.00 16.40 C ATOM 465 CD1 TYR A 30 25.696 4.463 42.285 1.00 15.37 C ATOM 466 CD2 TYR A 30 27.106 5.478 40.648 1.00 17.45 C ATOM 467 CE1 TYR A 30 25.362 5.711 42.787 1.00 16.85 C ATOM 468 CE2 TYR A 30 26.777 6.743 41.147 1.00 17.36 C ATOM 469 CZ TYR A 30 25.902 6.846 42.217 1.00 18.32 C ATOM 470 OH TYR A 30 25.556 8.082 42.735 1.00 19.48 O ATOM 471 HA TYR A 30 26.698 2.117 42.649 1.00 0.00 H ATOM 472 HB3 TYR A 30 26.045 2.537 40.179 1.00 0.00 H ATOM 473 HB2 TYR A 30 27.734 3.058 39.968 1.00 0.00 H ATOM 474 HD2 TYR A 30 27.798 5.393 39.810 1.00 0.00 H ATOM 475 HE2 TYR A 30 27.205 7.639 40.698 1.00 0.00 H ATOM 476 HE1 TYR A 30 24.675 5.796 43.629 1.00 0.00 H ATOM 477 HD1 TYR A 30 25.271 3.571 42.746 1.00 0.00 H ATOM 478 HH TYR A 30 25.124 8.625 42.029 1.00 0.00 H ATOM 479 H TYR A 30 29.307 2.947 41.699 1.00 0.00 H ATOM 480 N LEU A 31 28.268 -0.022 40.755 1.00 14.43 N ATOM 481 CA LEU A 31 28.235 -1.434 40.358 1.00 15.00 C ATOM 482 C LEU A 31 27.990 -2.271 41.615 1.00 17.23 C ATOM 483 O LEU A 31 27.180 -3.206 41.616 1.00 16.91 O ATOM 484 CB LEU A 31 29.563 -1.850 39.714 1.00 17.22 C ATOM 485 CG LEU A 31 29.645 -3.312 39.255 1.00 21.13 C ATOM 486 CD1 LEU A 31 28.673 -3.539 38.098 1.00 19.77 C ATOM 487 CD2 LEU A 31 31.073 -3.696 38.840 1.00 21.28 C ATOM 488 HA LEU A 31 27.442 -1.591 39.626 1.00 0.00 H ATOM 489 HB2 LEU A 31 29.728 -1.215 38.844 1.00 0.00 H ATOM 490 HB3 LEU A 31 30.357 -1.681 40.442 1.00 0.00 H ATOM 491 HG LEU A 31 29.368 -3.950 40.094 1.00 0.00 H ATOM 492 HD21 LEU A 31 31.395 -3.058 38.017 1.00 0.00 H ATOM 493 HD22 LEU A 31 31.745 -3.563 39.688 1.00 0.00 H ATOM 494 HD23 LEU A 31 31.090 -4.738 38.522 1.00 0.00 H ATOM 495 HD11 LEU A 31 27.658 -3.318 38.429 1.00 0.00 H ATOM 496 HD12 LEU A 31 28.937 -2.882 37.269 1.00 0.00 H ATOM 497 HD13 LEU A 31 28.733 -4.578 37.773 1.00 0.00 H ATOM 498 H LEU A 31 29.131 0.537 40.599 1.00 0.00 H ATOM 499 N SER A 32 28.697 -1.922 42.687 1.00 15.98 N ATOM 500 CA SER A 32 28.557 -2.636 43.960 1.00 15.65 C ATOM 501 C SER A 32 27.156 -2.465 44.534 1.00 16.16 C ATOM 502 O SER A 32 26.534 -3.428 45.006 1.00 15.68 O ATOM 503 CB SER A 32 29.586 -2.139 44.974 1.00 15.35 C ATOM 504 OG SER A 32 29.418 -2.798 46.217 1.00 15.74 O ATOM 505 HA SER A 32 28.729 -3.694 43.763 1.00 0.00 H ATOM 506 HB2 SER A 32 29.460 -1.066 45.117 1.00 0.00 H ATOM 507 HB3 SER A 32 30.588 -2.338 44.595 1.00 0.00 H ATOM 508 HG SER A 32 30.092 -2.464 46.860 1.00 0.00 H ATOM 509 H SER A 32 29.363 -1.126 42.620 1.00 0.00 H ATOM 510 N LEU A 33 26.652 -1.238 44.493 1.00 14.41 N ATOM 511 CA LEU A 33 25.297 -0.976 44.990 1.00 17.08 C ATOM 512 C LEU A 33 24.288 -1.797 44.201 1.00 16.55 C ATOM 513 O LEU A 33 23.412 -2.438 44.775 1.00 16.13 O ATOM 514 CB LEU A 33 24.957 0.509 44.867 1.00 16.41 C ATOM 515 CG LEU A 33 25.466 1.413 45.991 1.00 17.00 C ATOM 516 CD1 LEU A 33 25.606 2.852 45.495 1.00 16.16 C ATOM 517 CD2 LEU A 33 24.500 1.317 47.175 1.00 17.67 C ATOM 518 HA LEU A 33 25.254 -1.260 46.041 1.00 0.00 H ATOM 519 HB2 LEU A 33 25.381 0.871 43.930 1.00 0.00 H ATOM 520 HB3 LEU A 33 23.871 0.600 44.832 1.00 0.00 H ATOM 521 HG LEU A 33 26.454 1.087 46.315 1.00 0.00 H ATOM 522 HD21 LEU A 33 23.508 1.640 46.860 1.00 0.00 H ATOM 523 HD22 LEU A 33 24.454 0.285 47.522 1.00 0.00 H ATOM 524 HD23 LEU A 33 24.853 1.958 47.983 1.00 0.00 H ATOM 525 HD11 LEU A 33 26.313 2.882 44.666 1.00 0.00 H ATOM 526 HD12 LEU A 33 24.635 3.215 45.159 1.00 0.00 H ATOM 527 HD13 LEU A 33 25.969 3.481 46.308 1.00 0.00 H ATOM 528 H LEU A 33 27.221 -0.458 44.106 1.00 0.00 H ATOM 529 N GLY A 34 24.409 -1.758 42.881 1.00 15.72 N ATOM 530 CA GLY A 34 23.484 -2.463 42.011 1.00 17.89 C ATOM 531 C GLY A 34 23.430 -3.955 42.302 1.00 19.37 C ATOM 532 O GLY A 34 22.357 -4.535 42.436 1.00 19.80 O ATOM 533 HA3 GLY A 34 23.798 -2.320 40.977 1.00 0.00 H ATOM 534 HA2 GLY A 34 22.487 -2.044 42.148 1.00 0.00 H ATOM 535 H GLY A 34 25.185 -1.209 42.459 1.00 0.00 H ATOM 536 N PHE A 35 24.588 -4.588 42.404 1.00 14.81 N ATOM 537 CA PHE A 35 24.588 -6.013 42.659 1.00 18.31 C ATOM 538 C PHE A 35 24.179 -6.392 44.069 1.00 16.92 C ATOM 539 O PHE A 35 23.659 -7.477 44.274 1.00 17.42 O ATOM 540 CB PHE A 35 25.893 -6.672 42.213 1.00 19.29 C ATOM 541 CG PHE A 35 25.934 -6.912 40.740 1.00 20.72 C ATOM 542 CD1 PHE A 35 25.305 -8.026 40.189 1.00 19.49 C ATOM 543 CD2 PHE A 35 26.544 -6.004 39.897 1.00 20.31 C ATOM 544 CE1 PHE A 35 25.308 -8.239 38.829 1.00 20.28 C ATOM 545 CE2 PHE A 35 26.557 -6.210 38.535 1.00 22.46 C ATOM 546 CZ PHE A 35 25.937 -7.330 37.996 1.00 22.98 C ATOM 547 HA PHE A 35 23.796 -6.424 42.033 1.00 0.00 H ATOM 548 HB2 PHE A 35 26.725 -6.022 42.486 1.00 0.00 H ATOM 549 HB3 PHE A 35 25.997 -7.628 42.727 1.00 0.00 H ATOM 550 HD2 PHE A 35 27.020 -5.116 40.313 1.00 0.00 H ATOM 551 HE2 PHE A 35 27.054 -5.494 37.880 1.00 0.00 H ATOM 552 HZ PHE A 35 25.946 -7.493 36.918 1.00 0.00 H ATOM 553 HE1 PHE A 35 24.818 -9.118 38.411 1.00 0.00 H ATOM 554 HD1 PHE A 35 24.804 -8.739 40.844 1.00 0.00 H ATOM 555 H PHE A 35 25.484 -4.070 42.303 1.00 0.00 H ATOM 556 N TYR A 36 24.403 -5.503 45.034 1.00 16.03 N ATOM 557 CA TYR A 36 23.877 -5.731 46.374 1.00 16.56 C ATOM 558 C TYR A 36 22.341 -5.875 46.363 1.00 17.07 C ATOM 559 O TYR A 36 21.780 -6.756 47.031 1.00 16.22 O ATOM 560 CB TYR A 36 24.326 -4.616 47.325 1.00 17.02 C ATOM 561 CG TYR A 36 23.664 -4.672 48.689 1.00 16.45 C ATOM 562 CD1 TYR A 36 24.096 -5.563 49.666 1.00 17.61 C ATOM 563 CD2 TYR A 36 22.612 -3.830 48.996 1.00 17.80 C ATOM 564 CE1 TYR A 36 23.485 -5.609 50.914 1.00 19.33 C ATOM 565 CE2 TYR A 36 22.007 -3.866 50.236 1.00 18.31 C ATOM 566 CZ TYR A 36 22.445 -4.752 51.185 1.00 18.99 C ATOM 567 OH TYR A 36 21.826 -4.773 52.405 1.00 21.04 O ATOM 568 HA TYR A 36 24.285 -6.674 46.739 1.00 0.00 H ATOM 569 HB3 TYR A 36 24.088 -3.656 46.866 1.00 0.00 H ATOM 570 HB2 TYR A 36 25.404 -4.695 47.462 1.00 0.00 H ATOM 571 HD2 TYR A 36 22.254 -3.125 48.246 1.00 0.00 H ATOM 572 HE2 TYR A 36 21.182 -3.190 50.460 1.00 0.00 H ATOM 573 HE1 TYR A 36 23.827 -6.317 51.669 1.00 0.00 H ATOM 574 HD1 TYR A 36 24.926 -6.235 49.450 1.00 0.00 H ATOM 575 HH TYR A 36 21.913 -3.885 52.833 1.00 0.00 H ATOM 576 H TYR A 36 24.954 -4.645 44.832 1.00 0.00 H ATOM 577 N PHE A 37 21.658 -5.025 45.603 1.00 16.12 N ATOM 578 CA PHE A 37 20.187 -5.072 45.588 1.00 17.24 C ATOM 579 C PHE A 37 19.644 -6.231 44.749 1.00 18.60 C ATOM 580 O PHE A 37 18.447 -6.553 44.780 1.00 19.50 O ATOM 581 CB PHE A 37 19.597 -3.711 45.196 1.00 17.68 C ATOM 582 CG PHE A 37 19.708 -2.693 46.293 1.00 18.23 C ATOM 583 CD1 PHE A 37 18.781 -2.670 47.317 1.00 17.83 C ATOM 584 CD2 PHE A 37 20.769 -1.808 46.332 1.00 17.50 C ATOM 585 CE1 PHE A 37 18.890 -1.758 48.351 1.00 19.80 C ATOM 586 CE2 PHE A 37 20.892 -0.895 47.357 1.00 16.02 C ATOM 587 CZ PHE A 37 19.953 -0.861 48.370 1.00 19.20 C ATOM 588 HA PHE A 37 19.854 -5.279 46.605 1.00 0.00 H ATOM 589 HB2 PHE A 37 20.129 -3.339 44.320 1.00 0.00 H ATOM 590 HB3 PHE A 37 18.544 -3.845 44.950 1.00 0.00 H ATOM 591 HD2 PHE A 37 21.519 -1.833 45.541 1.00 0.00 H ATOM 592 HE2 PHE A 37 21.731 -0.199 47.369 1.00 0.00 H ATOM 593 HZ PHE A 37 20.045 -0.136 49.179 1.00 0.00 H ATOM 594 HE1 PHE A 37 18.146 -1.742 49.148 1.00 0.00 H ATOM 595 HD1 PHE A 37 17.953 -3.379 47.310 1.00 0.00 H ATOM 596 H PHE A 37 22.162 -4.327 45.020 1.00 0.00 H ATOM 597 N ASP A 38 20.557 -6.886 44.040 1.00 18.25 N ATOM 598 CA ASP A 38 20.268 -8.088 43.268 1.00 17.95 C ATOM 599 C ASP A 38 20.418 -9.371 44.114 1.00 18.07 C ATOM 600 O ASP A 38 20.072 -10.456 43.656 1.00 19.18 O ATOM 601 CB ASP A 38 21.225 -8.119 42.063 1.00 20.78 C ATOM 602 CG ASP A 38 21.066 -9.353 41.204 1.00 23.41 C ATOM 603 OD1 ASP A 38 19.969 -9.541 40.646 1.00 24.33 O ATOM 604 OD2 ASP A 38 22.059 -10.110 41.047 1.00 21.99 O ATOM 605 HA ASP A 38 19.231 -8.058 42.935 1.00 0.00 H ATOM 606 HB2 ASP A 38 21.034 -7.241 41.446 1.00 0.00 H ATOM 607 HB3 ASP A 38 22.249 -8.085 42.434 1.00 0.00 H ATOM 608 H ASP A 38 21.531 -6.521 44.036 1.00 0.00 H ATOM 609 N ARG A 39 20.951 -9.250 45.333 1.00 16.30 N ATOM 610 CA ARG A 39 21.091 -10.405 46.236 1.00 17.17 C ATOM 611 C ARG A 39 19.718 -11.018 46.519 1.00 18.30 C ATOM 612 O ARG A 39 18.725 -10.296 46.616 1.00 16.34 O ATOM 613 CB ARG A 39 21.773 -10.011 47.560 1.00 18.48 C ATOM 614 CG ARG A 39 23.276 -9.687 47.436 1.00 16.75 C ATOM 615 CD ARG A 39 23.855 -9.098 48.722 1.00 18.26 C ATOM 616 NE ARG A 39 23.419 -9.793 49.933 1.00 20.74 N ATOM 617 CZ ARG A 39 24.020 -9.687 51.120 1.00 23.58 C ATOM 618 NH1 ARG A 39 25.118 -8.945 51.263 1.00 21.76 N ATOM 619 NH2 ARG A 39 23.543 -10.351 52.162 1.00 25.19 N ATOM 620 HA ARG A 39 21.724 -11.141 45.740 1.00 0.00 H ATOM 621 HB2 ARG A 39 21.266 -9.130 47.955 1.00 0.00 H ATOM 622 HB3 ARG A 39 21.660 -10.838 48.261 1.00 0.00 H ATOM 623 HG2 ARG A 39 23.814 -10.605 47.198 1.00 0.00 H ATOM 624 HG3 ARG A 39 23.414 -8.968 46.629 1.00 0.00 H ATOM 625 HD2 ARG A 39 23.546 -8.055 48.793 1.00 0.00 H ATOM 626 HD3 ARG A 39 24.942 -9.151 48.667 1.00 0.00 H ATOM 627 HE ARG A 39 22.585 -10.411 49.865 1.00 0.00 H ATOM 628 HH12 ARG A 39 25.577 -8.870 52.193 1.00 0.00 H ATOM 629 HH11 ARG A 39 25.515 -8.441 50.445 1.00 0.00 H ATOM 630 HH22 ARG A 39 24.009 -10.270 53.088 1.00 0.00 H ATOM 631 HH21 ARG A 39 22.702 -10.953 52.054 1.00 0.00 H ATOM 632 H ARG A 39 21.276 -8.315 45.653 1.00 0.00 H ATOM 633 N ASP A 40 19.657 -12.342 46.667 1.00 16.64 N ATOM 634 CA ASP A 40 18.365 -12.985 46.923 1.00 18.39 C ATOM 635 C ASP A 40 17.774 -12.551 48.270 1.00 17.47 C ATOM 636 O ASP A 40 16.552 -12.589 48.466 1.00 18.41 O ATOM 637 CB ASP A 40 18.477 -14.518 46.851 1.00 17.62 C ATOM 638 CG ASP A 40 19.136 -15.116 48.085 1.00 21.13 C ATOM 639 OD1 ASP A 40 20.380 -15.249 48.095 1.00 21.27 O ATOM 640 OD2 ASP A 40 18.410 -15.459 49.043 1.00 20.31 O ATOM 641 HA ASP A 40 17.685 -12.657 46.137 1.00 0.00 H ATOM 642 HB2 ASP A 40 17.476 -14.937 46.752 1.00 0.00 H ATOM 643 HB3 ASP A 40 19.069 -14.784 45.975 1.00 0.00 H ATOM 644 H ASP A 40 20.522 -12.916 46.601 1.00 0.00 H ATOM 645 N ASP A 41 18.637 -12.137 49.190 1.00 17.51 N ATOM 646 CA ASP A 41 18.185 -11.693 50.509 1.00 20.09 C ATOM 647 C ASP A 41 17.973 -10.176 50.612 1.00 19.92 C ATOM 648 O ASP A 41 17.764 -9.644 51.712 1.00 18.42 O ATOM 649 CB ASP A 41 19.131 -12.187 51.612 1.00 19.17 C ATOM 650 CG ASP A 41 20.548 -11.646 51.468 1.00 22.77 C ATOM 651 OD1 ASP A 41 20.864 -11.023 50.441 1.00 19.02 O ATOM 652 OD2 ASP A 41 21.359 -11.866 52.388 1.00 22.16 O ATOM 653 HA ASP A 41 17.204 -12.145 50.653 1.00 0.00 H ATOM 654 HB2 ASP A 41 18.735 -11.871 52.577 1.00 0.00 H ATOM 655 HB3 ASP A 41 19.169 -13.276 51.575 1.00 0.00 H ATOM 656 H ASP A 41 19.653 -12.128 48.969 1.00 0.00 H ATOM 657 N VAL A 42 18.033 -9.492 49.475 1.00 18.39 N ATOM 658 CA VAL A 42 17.719 -8.064 49.407 1.00 17.05 C ATOM 659 C VAL A 42 16.593 -7.893 48.405 1.00 16.33 C ATOM 660 O VAL A 42 15.513 -7.447 48.763 1.00 16.51 O ATOM 661 CB VAL A 42 18.937 -7.211 48.999 1.00 17.20 C ATOM 662 CG1 VAL A 42 18.538 -5.716 48.878 1.00 17.57 C ATOM 663 CG2 VAL A 42 20.061 -7.383 50.016 1.00 15.80 C ATOM 664 HA VAL A 42 17.424 -7.715 50.397 1.00 0.00 H ATOM 665 HB VAL A 42 19.291 -7.550 48.025 1.00 0.00 H ATOM 666 HG11 VAL A 42 17.761 -5.609 48.121 1.00 0.00 H ATOM 667 HG12 VAL A 42 18.163 -5.362 49.839 1.00 0.00 H ATOM 668 HG13 VAL A 42 19.411 -5.131 48.589 1.00 0.00 H ATOM 669 HG21 VAL A 42 19.713 -7.064 50.998 1.00 0.00 H ATOM 670 HG22 VAL A 42 20.355 -8.432 50.057 1.00 0.00 H ATOM 671 HG23 VAL A 42 20.916 -6.776 49.717 1.00 0.00 H ATOM 672 H VAL A 42 18.312 -9.987 48.604 1.00 0.00 H ATOM 673 N ALA A 43 16.858 -8.266 47.156 1.00 15.95 N ATOM 674 CA ALA A 43 15.818 -8.498 46.159 1.00 16.79 C ATOM 675 C ALA A 43 14.942 -7.278 45.877 1.00 18.07 C ATOM 676 O ALA A 43 13.720 -7.342 45.984 1.00 16.76 O ATOM 677 CB ALA A 43 14.932 -9.706 46.574 1.00 16.89 C ATOM 678 HA ALA A 43 16.341 -8.717 45.228 1.00 0.00 H ATOM 679 HB1 ALA A 43 15.552 -10.599 46.656 1.00 0.00 H ATOM 680 HB2 ALA A 43 14.463 -9.498 47.536 1.00 0.00 H ATOM 681 HB3 ALA A 43 14.161 -9.866 45.820 1.00 0.00 H ATOM 682 H ALA A 43 17.851 -8.398 46.877 1.00 0.00 H ATOM 683 N LEU A 44 15.564 -6.175 45.497 1.00 16.20 N ATOM 684 CA LEU A 44 14.808 -4.997 45.109 1.00 18.23 C ATOM 685 C LEU A 44 15.212 -4.599 43.693 1.00 17.85 C ATOM 686 O LEU A 44 16.123 -3.799 43.507 1.00 17.81 O ATOM 687 CB LEU A 44 15.039 -3.869 46.114 1.00 16.17 C ATOM 688 CG LEU A 44 14.389 -4.106 47.486 1.00 18.05 C ATOM 689 CD1 LEU A 44 14.966 -3.212 48.566 1.00 18.11 C ATOM 690 CD2 LEU A 44 12.866 -3.934 47.415 1.00 17.44 C ATOM 691 HA LEU A 44 13.739 -5.212 45.113 1.00 0.00 H ATOM 692 HB2 LEU A 44 16.113 -3.755 46.259 1.00 0.00 H ATOM 693 HB3 LEU A 44 14.630 -2.949 45.696 1.00 0.00 H ATOM 694 HG LEU A 44 14.617 -5.136 47.759 1.00 0.00 H ATOM 695 HD21 LEU A 44 12.631 -2.921 47.088 1.00 0.00 H ATOM 696 HD22 LEU A 44 12.453 -4.651 46.705 1.00 0.00 H ATOM 697 HD23 LEU A 44 12.436 -4.108 48.401 1.00 0.00 H ATOM 698 HD11 LEU A 44 16.034 -3.405 48.663 1.00 0.00 H ATOM 699 HD12 LEU A 44 14.807 -2.168 48.295 1.00 0.00 H ATOM 700 HD13 LEU A 44 14.470 -3.422 49.513 1.00 0.00 H ATOM 701 H LEU A 44 16.603 -6.151 45.476 1.00 0.00 H ATOM 702 N GLU A 45 14.517 -5.158 42.702 1.00 17.29 N ATOM 703 CA GLU A 45 14.946 -5.057 41.303 1.00 20.57 C ATOM 704 C GLU A 45 15.021 -3.612 40.789 1.00 20.13 C ATOM 705 O GLU A 45 15.929 -3.255 40.033 1.00 20.21 O ATOM 706 CB GLU A 45 14.037 -5.891 40.394 1.00 22.65 C ATOM 707 CG GLU A 45 14.493 -5.906 38.943 1.00 30.77 C ATOM 708 CD GLU A 45 13.780 -6.963 38.111 1.00 39.96 C ATOM 709 OE1 GLU A 45 12.798 -7.563 38.613 1.00 37.46 O ATOM 710 OE2 GLU A 45 14.210 -7.195 36.958 1.00 47.04 O ATOM 711 HA GLU A 45 15.960 -5.455 41.272 1.00 0.00 H ATOM 712 HB2 GLU A 45 14.023 -6.916 40.764 1.00 0.00 H ATOM 713 HB3 GLU A 45 13.030 -5.477 40.437 1.00 0.00 H ATOM 714 HG2 GLU A 45 14.296 -4.927 38.506 1.00 0.00 H ATOM 715 HG3 GLU A 45 15.564 -6.106 38.916 1.00 0.00 H ATOM 716 H GLU A 45 13.646 -5.680 42.927 1.00 0.00 H ATOM 717 N GLY A 46 14.071 -2.781 41.197 1.00 18.37 N ATOM 718 CA GLY A 46 14.075 -1.387 40.776 1.00 20.10 C ATOM 719 C GLY A 46 15.251 -0.610 41.353 1.00 18.41 C ATOM 720 O GLY A 46 15.788 0.291 40.712 1.00 17.53 O ATOM 721 HA3 GLY A 46 13.149 -0.918 41.108 1.00 0.00 H ATOM 722 HA2 GLY A 46 14.130 -1.350 39.688 1.00 0.00 H ATOM 723 H GLY A 46 13.317 -3.128 41.823 1.00 0.00 H ATOM 724 N VAL A 47 15.653 -0.950 42.572 1.00 16.09 N ATOM 725 CA VAL A 47 16.821 -0.319 43.171 1.00 16.39 C ATOM 726 C VAL A 47 18.095 -0.787 42.455 1.00 18.94 C ATOM 727 O VAL A 47 18.992 0.013 42.149 1.00 16.44 O ATOM 728 CB VAL A 47 16.909 -0.613 44.687 1.00 17.06 C ATOM 729 CG1 VAL A 47 18.063 0.175 45.313 1.00 18.24 C ATOM 730 CG2 VAL A 47 15.589 -0.258 45.357 1.00 16.01 C ATOM 731 HA VAL A 47 16.722 0.760 43.052 1.00 0.00 H ATOM 732 HB VAL A 47 17.102 -1.675 44.836 1.00 0.00 H ATOM 733 HG11 VAL A 47 19.000 -0.116 44.838 1.00 0.00 H ATOM 734 HG12 VAL A 47 17.895 1.242 45.165 1.00 0.00 H ATOM 735 HG13 VAL A 47 18.113 -0.042 46.380 1.00 0.00 H ATOM 736 HG21 VAL A 47 15.379 0.801 45.206 1.00 0.00 H ATOM 737 HG22 VAL A 47 14.789 -0.854 44.919 1.00 0.00 H ATOM 738 HG23 VAL A 47 15.657 -0.467 46.425 1.00 0.00 H ATOM 739 H VAL A 47 15.129 -1.674 43.104 1.00 0.00 H ATOM 740 N CYS A 48 18.165 -2.085 42.182 1.00 17.23 N ATOM 741 CA CYS A 48 19.277 -2.629 41.427 1.00 18.66 C ATOM 742 C CYS A 48 19.426 -1.909 40.090 1.00 20.62 C ATOM 743 O CYS A 48 20.522 -1.509 39.698 1.00 18.62 O ATOM 744 CB CYS A 48 19.086 -4.127 41.183 1.00 19.41 C ATOM 745 SG CYS A 48 20.330 -4.780 40.050 1.00 29.73 S ATOM 746 HA CYS A 48 20.183 -2.478 42.014 1.00 0.00 H ATOM 747 HB2 CYS A 48 18.097 -4.293 40.756 1.00 0.00 H ATOM 748 HB3 CYS A 48 19.163 -4.653 42.134 1.00 0.00 H ATOM 749 HG CYS A 48 21.586 -4.582 40.585 1.00 0.00 H ATOM 750 H CYS A 48 17.412 -2.720 42.514 1.00 0.00 H ATOM 751 N HIS A 49 18.317 -1.739 39.385 1.00 19.36 N ATOM 752 CA HIS A 49 18.379 -1.110 38.076 1.00 21.74 C ATOM 753 C HIS A 49 18.773 0.369 38.159 1.00 19.90 C ATOM 754 O HIS A 49 19.529 0.855 37.321 1.00 20.81 O ATOM 755 CB HIS A 49 17.056 -1.265 37.316 1.00 26.75 C ATOM 756 CG HIS A 49 17.192 -1.036 35.843 1.00 34.77 C ATOM 757 ND1 HIS A 49 17.585 -2.032 34.971 1.00 39.47 N ATOM 758 CD2 HIS A 49 17.036 0.083 35.094 1.00 36.80 C ATOM 759 CE1 HIS A 49 17.643 -1.540 33.745 1.00 43.48 C ATOM 760 NE2 HIS A 49 17.316 -0.260 33.792 1.00 44.35 N ATOM 761 HA HIS A 49 19.161 -1.630 37.522 1.00 0.00 H ATOM 762 HB2 HIS A 49 16.680 -2.275 37.477 1.00 0.00 H ATOM 763 HB3 HIS A 49 16.341 -0.545 37.714 1.00 0.00 H ATOM 764 HD2 HIS A 49 16.744 1.069 35.456 1.00 0.00 H ATOM 765 HE1 HIS A 49 17.914 -2.096 32.848 1.00 0.00 H ATOM 766 H HIS A 49 17.403 -2.055 39.768 1.00 0.00 H ATOM 767 N PHE A 50 18.245 1.074 39.156 1.00 18.58 N ATOM 768 CA PHE A 50 18.581 2.481 39.385 1.00 19.66 C ATOM 769 C PHE A 50 20.092 2.651 39.527 1.00 18.88 C ATOM 770 O PHE A 50 20.694 3.514 38.896 1.00 18.90 O ATOM 771 CB PHE A 50 17.871 2.991 40.644 1.00 18.06 C ATOM 772 CG PHE A 50 18.186 4.428 41.005 1.00 20.64 C ATOM 773 CD1 PHE A 50 17.533 5.479 40.378 1.00 22.29 C ATOM 774 CD2 PHE A 50 19.098 4.723 42.000 1.00 20.52 C ATOM 775 CE1 PHE A 50 17.805 6.800 40.721 1.00 21.78 C ATOM 776 CE2 PHE A 50 19.369 6.044 42.348 1.00 20.37 C ATOM 777 CZ PHE A 50 18.721 7.076 41.706 1.00 23.11 C ATOM 778 HA PHE A 50 18.245 3.065 38.528 1.00 0.00 H ATOM 779 HB2 PHE A 50 16.796 2.907 40.486 1.00 0.00 H ATOM 780 HB3 PHE A 50 18.165 2.357 41.481 1.00 0.00 H ATOM 781 HD2 PHE A 50 19.611 3.913 42.518 1.00 0.00 H ATOM 782 HE2 PHE A 50 20.096 6.262 43.131 1.00 0.00 H ATOM 783 HZ PHE A 50 18.935 8.109 41.979 1.00 0.00 H ATOM 784 HE1 PHE A 50 17.292 7.614 40.209 1.00 0.00 H ATOM 785 HD1 PHE A 50 16.795 5.267 39.604 1.00 0.00 H ATOM 786 H PHE A 50 17.569 0.609 39.796 1.00 0.00 H ATOM 787 N PHE A 51 20.707 1.820 40.353 1.00 17.36 N ATOM 788 CA PHE A 51 22.143 1.950 40.585 1.00 18.37 C ATOM 789 C PHE A 51 22.974 1.433 39.413 1.00 18.53 C ATOM 790 O PHE A 51 23.975 2.039 39.052 1.00 18.21 O ATOM 791 CB PHE A 51 22.538 1.308 41.918 1.00 17.04 C ATOM 792 CG PHE A 51 22.089 2.106 43.120 1.00 17.15 C ATOM 793 CD1 PHE A 51 22.379 3.459 43.212 1.00 15.86 C ATOM 794 CD2 PHE A 51 21.345 1.514 44.131 1.00 16.83 C ATOM 795 CE1 PHE A 51 21.979 4.193 44.304 1.00 15.73 C ATOM 796 CE2 PHE A 51 20.933 2.247 45.234 1.00 19.09 C ATOM 797 CZ PHE A 51 21.247 3.588 45.322 1.00 17.19 C ATOM 798 HA PHE A 51 22.370 3.014 40.655 1.00 0.00 H ATOM 799 HB2 PHE A 51 22.088 0.317 41.972 1.00 0.00 H ATOM 800 HB3 PHE A 51 23.624 1.215 41.950 1.00 0.00 H ATOM 801 HD2 PHE A 51 21.081 0.459 44.057 1.00 0.00 H ATOM 802 HE2 PHE A 51 20.363 1.766 46.029 1.00 0.00 H ATOM 803 HZ PHE A 51 20.923 4.171 46.184 1.00 0.00 H ATOM 804 HE1 PHE A 51 22.235 5.250 44.373 1.00 0.00 H ATOM 805 HD1 PHE A 51 22.931 3.947 42.409 1.00 0.00 H ATOM 806 H PHE A 51 20.168 1.074 40.837 1.00 0.00 H ATOM 807 N ARG A 52 22.555 0.337 38.787 1.00 19.32 N ATOM 808 CA ARG A 52 23.291 -0.137 37.615 1.00 19.16 C ATOM 809 C ARG A 52 23.306 0.911 36.494 1.00 20.21 C ATOM 810 O ARG A 52 24.314 1.089 35.821 1.00 19.92 O ATOM 811 CB ARG A 52 22.769 -1.492 37.124 1.00 21.79 C ATOM 812 CG ARG A 52 23.082 -2.621 38.110 1.00 26.21 C ATOM 813 CD ARG A 52 22.747 -3.988 37.544 1.00 32.35 C ATOM 814 NE ARG A 52 23.687 -4.410 36.511 1.00 36.30 N ATOM 815 CZ ARG A 52 23.534 -5.509 35.779 1.00 39.76 C ATOM 816 NH1 ARG A 52 22.478 -6.294 35.974 1.00 39.48 N ATOM 817 NH2 ARG A 52 24.433 -5.823 34.852 1.00 38.51 N ATOM 818 HA ARG A 52 24.325 -0.289 37.924 1.00 0.00 H ATOM 819 HB2 ARG A 52 21.689 -1.427 36.995 1.00 0.00 H ATOM 820 HB3 ARG A 52 23.235 -1.722 36.166 1.00 0.00 H ATOM 821 HG2 ARG A 52 24.145 -2.592 38.351 1.00 0.00 H ATOM 822 HG3 ARG A 52 22.500 -2.465 39.018 1.00 0.00 H ATOM 823 HD2 ARG A 52 21.746 -3.953 37.113 1.00 0.00 H ATOM 824 HD3 ARG A 52 22.767 -4.717 38.354 1.00 0.00 H ATOM 825 HE ARG A 52 24.524 -3.818 36.338 1.00 0.00 H ATOM 826 HH12 ARG A 52 22.357 -7.154 35.402 1.00 0.00 H ATOM 827 HH11 ARG A 52 21.774 -6.048 36.698 1.00 0.00 H ATOM 828 HH22 ARG A 52 24.312 -6.683 34.280 1.00 0.00 H ATOM 829 HH21 ARG A 52 25.258 -5.209 34.698 1.00 0.00 H ATOM 830 H ARG A 52 21.716 -0.176 39.126 1.00 0.00 H ATOM 831 N GLU A 53 22.205 1.633 36.323 1.00 19.57 N ATOM 832 CA GLU A 53 22.175 2.673 35.295 1.00 22.58 C ATOM 833 C GLU A 53 23.135 3.815 35.633 1.00 22.56 C ATOM 834 O GLU A 53 23.790 4.374 34.748 1.00 21.29 O ATOM 835 CB GLU A 53 20.766 3.220 35.082 1.00 23.73 C ATOM 836 CG GLU A 53 20.738 4.309 34.022 1.00 33.04 C ATOM 837 CD GLU A 53 21.351 3.844 32.704 1.00 39.08 C ATOM 838 OE1 GLU A 53 20.858 2.829 32.154 1.00 41.23 O ATOM 839 OE2 GLU A 53 22.333 4.477 32.231 1.00 36.90 O ATOM 840 HA GLU A 53 22.501 2.206 34.366 1.00 0.00 H ATOM 841 HB2 GLU A 53 20.114 2.405 34.768 1.00 0.00 H ATOM 842 HB3 GLU A 53 20.402 3.633 36.023 1.00 0.00 H ATOM 843 HG2 GLU A 53 19.703 4.601 33.845 1.00 0.00 H ATOM 844 HG3 GLU A 53 21.299 5.169 34.387 1.00 0.00 H ATOM 845 H GLU A 53 21.369 1.460 36.917 1.00 0.00 H ATOM 846 N LEU A 54 23.231 4.149 36.917 1.00 18.38 N ATOM 847 CA LEU A 54 24.174 5.180 37.357 1.00 18.66 C ATOM 848 C LEU A 54 25.626 4.743 37.171 1.00 19.08 C ATOM 849 O LEU A 54 26.483 5.557 36.835 1.00 18.68 O ATOM 850 CB LEU A 54 23.915 5.583 38.811 1.00 18.60 C ATOM 851 CG LEU A 54 22.649 6.400 39.053 1.00 19.98 C ATOM 852 CD1 LEU A 54 22.496 6.702 40.530 1.00 20.00 C ATOM 853 CD2 LEU A 54 22.670 7.690 38.227 1.00 21.43 C ATOM 854 HA LEU A 54 24.009 6.052 36.724 1.00 0.00 H ATOM 855 HB2 LEU A 54 23.845 4.671 39.405 1.00 0.00 H ATOM 856 HB3 LEU A 54 24.766 6.173 39.152 1.00 0.00 H ATOM 857 HG LEU A 54 21.788 5.813 38.732 1.00 0.00 H ATOM 858 HD21 LEU A 54 23.536 8.288 38.512 1.00 0.00 H ATOM 859 HD22 LEU A 54 22.732 7.441 37.168 1.00 0.00 H ATOM 860 HD23 LEU A 54 21.758 8.256 38.416 1.00 0.00 H ATOM 861 HD11 LEU A 54 22.430 5.767 41.086 1.00 0.00 H ATOM 862 HD12 LEU A 54 23.360 7.270 40.875 1.00 0.00 H ATOM 863 HD13 LEU A 54 21.589 7.285 40.688 1.00 0.00 H ATOM 864 H LEU A 54 22.629 3.672 37.618 1.00 0.00 H ATOM 865 N ALA A 55 25.908 3.461 37.386 1.00 16.96 N ATOM 866 CA ALA A 55 27.253 2.952 37.135 1.00 18.55 C ATOM 867 C ALA A 55 27.637 3.253 35.690 1.00 19.95 C ATOM 868 O ALA A 55 28.744 3.700 35.397 1.00 17.53 O ATOM 869 CB ALA A 55 27.320 1.444 37.402 1.00 19.64 C ATOM 870 HA ALA A 55 27.955 3.443 37.809 1.00 0.00 H ATOM 871 HB1 ALA A 55 27.057 1.248 38.441 1.00 0.00 H ATOM 872 HB2 ALA A 55 26.619 0.929 36.745 1.00 0.00 H ATOM 873 HB3 ALA A 55 28.331 1.087 37.208 1.00 0.00 H ATOM 874 H ALA A 55 25.168 2.819 37.734 1.00 0.00 H ATOM 875 N GLU A 56 26.693 3.024 34.790 1.00 20.16 N ATOM 876 CA GLU A 56 26.923 3.255 33.376 1.00 21.70 C ATOM 877 C GLU A 56 27.123 4.740 33.077 1.00 21.92 C ATOM 878 O GLU A 56 28.044 5.106 32.349 1.00 21.65 O ATOM 879 CB GLU A 56 25.765 2.679 32.552 1.00 24.14 C ATOM 880 CG GLU A 56 25.690 3.196 31.137 1.00 30.54 C ATOM 881 CD GLU A 56 24.607 2.496 30.334 1.00 38.19 C ATOM 882 OE1 GLU A 56 24.092 1.455 30.809 1.00 36.60 O ATOM 883 OE2 GLU A 56 24.276 2.988 29.233 1.00 43.75 O ATOM 884 HA GLU A 56 27.842 2.742 33.093 1.00 0.00 H ATOM 885 HB2 GLU A 56 25.879 1.596 32.514 1.00 0.00 H ATOM 886 HB3 GLU A 56 24.831 2.927 33.056 1.00 0.00 H ATOM 887 HG2 GLU A 56 25.475 4.264 31.163 1.00 0.00 H ATOM 888 HG3 GLU A 56 26.651 3.032 30.650 1.00 0.00 H ATOM 889 H GLU A 56 25.766 2.671 35.103 1.00 0.00 H ATOM 890 N GLU A 57 26.270 5.592 33.637 1.00 19.62 N ATOM 891 CA GLU A 57 26.427 7.036 33.451 1.00 23.17 C ATOM 892 C GLU A 57 27.813 7.528 33.909 1.00 20.91 C ATOM 893 O GLU A 57 28.438 8.370 33.253 1.00 20.39 O ATOM 894 CB GLU A 57 25.313 7.807 34.170 1.00 24.46 C ATOM 895 CG GLU A 57 23.917 7.518 33.628 1.00 27.81 C ATOM 896 CD GLU A 57 23.859 7.666 32.120 1.00 34.39 C ATOM 897 OE1 GLU A 57 24.097 8.790 31.630 1.00 36.71 O ATOM 898 OE2 GLU A 57 23.609 6.652 31.428 1.00 37.42 O ATOM 899 HA GLU A 57 26.348 7.232 32.382 1.00 0.00 H ATOM 900 HB2 GLU A 57 25.335 7.538 35.226 1.00 0.00 H ATOM 901 HB3 GLU A 57 25.509 8.874 34.064 1.00 0.00 H ATOM 902 HG2 GLU A 57 23.639 6.498 33.894 1.00 0.00 H ATOM 903 HG3 GLU A 57 23.211 8.216 34.079 1.00 0.00 H ATOM 904 H GLU A 57 25.483 5.229 34.213 1.00 0.00 H ATOM 905 N LYS A 58 28.293 7.008 35.033 1.00 16.97 N ATOM 906 CA LYS A 58 29.556 7.495 35.576 1.00 17.42 C ATOM 907 C LYS A 58 30.710 7.031 34.710 1.00 20.27 C ATOM 908 O LYS A 58 31.674 7.764 34.514 1.00 17.98 O ATOM 909 CB LYS A 58 29.755 7.055 37.031 1.00 18.97 C ATOM 910 CG LYS A 58 28.721 7.652 37.985 1.00 18.18 C ATOM 911 CD LYS A 58 28.646 9.166 37.825 1.00 19.86 C ATOM 912 CE LYS A 58 27.551 9.738 38.703 1.00 25.22 C ATOM 913 NZ LYS A 58 27.162 11.124 38.345 1.00 21.12 N ATOM 914 HA LYS A 58 29.526 8.585 35.570 1.00 0.00 H ATOM 915 HB2 LYS A 58 29.684 5.968 37.078 1.00 0.00 H ATOM 916 HB3 LYS A 58 30.748 7.367 37.355 1.00 0.00 H ATOM 917 HG2 LYS A 58 27.744 7.221 37.768 1.00 0.00 H ATOM 918 HG3 LYS A 58 29.002 7.414 39.011 1.00 0.00 H ATOM 919 HD2 LYS A 58 29.602 9.605 38.111 1.00 0.00 H ATOM 920 HD3 LYS A 58 28.434 9.407 36.783 1.00 0.00 H ATOM 921 HE2 LYS A 58 27.900 9.734 39.736 1.00 0.00 H ATOM 922 HE3 LYS A 58 26.671 9.100 38.616 1.00 0.00 H ATOM 923 HZ1 LYS A 58 27.989 11.749 38.434 1.00 0.00 H ATOM 924 HZ2 LYS A 58 26.815 11.143 37.365 1.00 0.00 H ATOM 925 HZ3 LYS A 58 26.410 11.448 38.986 1.00 0.00 H ATOM 926 H LYS A 58 27.770 6.256 35.525 1.00 0.00 H ATOM 927 N ARG A 59 30.616 5.810 34.193 1.00 17.57 N ATOM 928 CA ARG A 59 31.647 5.320 33.290 1.00 19.34 C ATOM 929 C ARG A 59 31.701 6.180 32.037 1.00 20.92 C ATOM 930 O ARG A 59 32.780 6.476 31.513 1.00 20.95 O ATOM 931 CB ARG A 59 31.399 3.867 32.902 1.00 21.84 C ATOM 932 CG ARG A 59 32.476 3.341 31.980 1.00 26.27 C ATOM 933 CD ARG A 59 32.175 1.953 31.490 1.00 28.37 C ATOM 934 NE ARG A 59 30.786 1.812 31.073 1.00 32.51 N ATOM 935 CZ ARG A 59 30.287 2.285 29.935 1.00 34.98 C ATOM 936 NH1 ARG A 59 31.057 2.960 29.085 1.00 34.86 N ATOM 937 NH2 ARG A 59 29.005 2.096 29.652 1.00 35.76 N ATOM 938 HA ARG A 59 32.601 5.378 33.813 1.00 0.00 H ATOM 939 HB2 ARG A 59 31.380 3.258 33.806 1.00 0.00 H ATOM 940 HB3 ARG A 59 30.436 3.796 32.397 1.00 0.00 H ATOM 941 HG2 ARG A 59 32.559 4.007 31.121 1.00 0.00 H ATOM 942 HG3 ARG A 59 33.423 3.326 32.519 1.00 0.00 H ATOM 943 HD2 ARG A 59 32.375 1.244 32.294 1.00 0.00 H ATOM 944 HD3 ARG A 59 32.822 1.731 30.641 1.00 0.00 H ATOM 945 HE ARG A 59 30.139 1.306 31.711 1.00 0.00 H ATOM 946 HH12 ARG A 59 30.656 3.325 28.198 1.00 0.00 H ATOM 947 HH11 ARG A 59 32.060 3.122 29.308 1.00 0.00 H ATOM 948 HH22 ARG A 59 28.609 2.464 28.763 1.00 0.00 H ATOM 949 HH21 ARG A 59 28.396 1.580 30.319 1.00 0.00 H ATOM 950 H ARG A 59 29.805 5.205 34.434 1.00 0.00 H ATOM 951 N GLU A 60 30.529 6.568 31.547 1.00 20.96 N ATOM 952 CA GLU A 60 30.450 7.403 30.352 1.00 20.12 C ATOM 953 C GLU A 60 31.020 8.795 30.600 1.00 19.53 C ATOM 954 O GLU A 60 31.618 9.397 29.700 1.00 20.43 O ATOM 955 CB GLU A 60 29.007 7.467 29.842 1.00 24.31 C ATOM 956 CG GLU A 60 28.531 6.117 29.331 1.00 28.03 C ATOM 957 CD GLU A 60 27.060 6.104 28.986 1.00 35.02 C ATOM 958 OE1 GLU A 60 26.638 5.211 28.217 1.00 41.87 O ATOM 959 OE2 GLU A 60 26.329 6.979 29.495 1.00 35.07 O ATOM 960 HA GLU A 60 31.065 6.945 29.577 1.00 0.00 H ATOM 961 HB2 GLU A 60 28.358 7.785 30.657 1.00 0.00 H ATOM 962 HB3 GLU A 60 28.951 8.192 29.030 1.00 0.00 H ATOM 963 HG2 GLU A 60 29.100 5.863 28.437 1.00 0.00 H ATOM 964 HG3 GLU A 60 28.714 5.369 30.102 1.00 0.00 H ATOM 965 H GLU A 60 29.653 6.272 32.023 1.00 0.00 H ATOM 966 N GLY A 61 30.843 9.301 31.817 1.00 17.21 N ATOM 967 CA GLY A 61 31.442 10.564 32.201 1.00 22.23 C ATOM 968 C GLY A 61 32.957 10.476 32.130 1.00 19.21 C ATOM 969 O GLY A 61 33.615 11.348 31.582 1.00 17.45 O ATOM 970 HA3 GLY A 61 31.144 10.808 33.221 1.00 0.00 H ATOM 971 HA2 GLY A 61 31.095 11.346 31.525 1.00 0.00 H ATOM 972 H GLY A 61 30.264 8.781 32.506 1.00 0.00 H ATOM 973 N ALA A 62 33.517 9.406 32.683 1.00 19.08 N ATOM 974 CA ALA A 62 34.953 9.175 32.578 1.00 18.28 C ATOM 975 C ALA A 62 35.427 9.150 31.121 1.00 17.98 C ATOM 976 O ALA A 62 36.444 9.761 30.791 1.00 16.93 O ATOM 977 CB ALA A 62 35.344 7.880 33.301 1.00 19.36 C ATOM 978 HA ALA A 62 35.454 10.012 33.064 1.00 0.00 H ATOM 979 HB1 ALA A 62 35.074 7.957 34.354 1.00 0.00 H ATOM 980 HB2 ALA A 62 34.816 7.040 32.850 1.00 0.00 H ATOM 981 HB3 ALA A 62 36.419 7.726 33.211 1.00 0.00 H ATOM 982 H ALA A 62 32.924 8.724 33.197 1.00 0.00 H ATOM 983 N GLU A 63 34.697 8.455 30.250 1.00 18.31 N ATOM 984 CA GLU A 63 35.081 8.390 28.843 1.00 19.17 C ATOM 985 C GLU A 63 35.022 9.756 28.167 1.00 19.03 C ATOM 986 O GLU A 63 35.857 10.071 27.334 1.00 19.46 O ATOM 987 CB GLU A 63 34.231 7.368 28.071 1.00 19.84 C ATOM 988 CG GLU A 63 34.455 5.928 28.532 1.00 26.43 C ATOM 989 CD GLU A 63 33.617 4.921 27.755 1.00 32.65 C ATOM 990 OE1 GLU A 63 33.485 3.776 28.235 1.00 37.94 O ATOM 991 OE2 GLU A 63 33.096 5.269 26.672 1.00 36.79 O ATOM 992 HA GLU A 63 36.118 8.056 28.821 1.00 0.00 H ATOM 993 HB2 GLU A 63 33.179 7.617 28.210 1.00 0.00 H ATOM 994 HB3 GLU A 63 34.483 7.436 27.013 1.00 0.00 H ATOM 995 HG2 GLU A 63 35.508 5.680 28.400 1.00 0.00 H ATOM 996 HG3 GLU A 63 34.195 5.856 29.588 1.00 0.00 H ATOM 997 H GLU A 63 33.846 7.954 30.575 1.00 0.00 H ATOM 998 N ARG A 64 34.040 10.567 28.531 1.00 20.34 N ATOM 999 CA ARG A 64 33.931 11.904 27.962 1.00 20.24 C ATOM 1000 C ARG A 64 35.134 12.759 28.375 1.00 19.30 C ATOM 1001 O ARG A 64 35.679 13.511 27.571 1.00 18.91 O ATOM 1002 CB ARG A 64 32.605 12.549 28.386 1.00 24.19 C ATOM 1003 CG ARG A 64 32.302 13.874 27.702 1.00 34.14 C ATOM 1004 CD ARG A 64 30.800 14.184 27.736 1.00 38.40 C ATOM 1005 NE ARG A 64 30.027 13.140 27.070 1.00 42.31 N ATOM 1006 CZ ARG A 64 28.859 13.341 26.465 1.00 47.08 C ATOM 1007 NH1 ARG A 64 28.317 14.557 26.443 1.00 48.10 N ATOM 1008 NH2 ARG A 64 28.233 12.326 25.879 1.00 46.13 N ATOM 1009 HA ARG A 64 33.936 11.833 26.874 1.00 0.00 H ATOM 1010 HB2 ARG A 64 31.798 11.854 28.155 1.00 0.00 H ATOM 1011 HB3 ARG A 64 32.638 12.720 29.462 1.00 0.00 H ATOM 1012 HG2 ARG A 64 32.842 14.671 28.214 1.00 0.00 H ATOM 1013 HG3 ARG A 64 32.632 13.823 26.664 1.00 0.00 H ATOM 1014 HD2 ARG A 64 30.622 15.134 27.232 1.00 0.00 H ATOM 1015 HD3 ARG A 64 30.476 14.258 28.774 1.00 0.00 H ATOM 1016 HE ARG A 64 30.415 12.175 27.068 1.00 0.00 H ATOM 1017 HH12 ARG A 64 27.404 14.711 25.969 1.00 0.00 H ATOM 1018 HH11 ARG A 64 28.807 15.353 26.899 1.00 0.00 H ATOM 1019 HH22 ARG A 64 27.320 12.482 25.406 1.00 0.00 H ATOM 1020 HH21 ARG A 64 28.656 11.376 25.894 1.00 0.00 H ATOM 1021 H ARG A 64 33.340 10.246 29.230 1.00 0.00 H ATOM 1022 N LEU A 65 35.551 12.629 29.632 1.00 19.14 N ATOM 1023 CA LEU A 65 36.720 13.342 30.133 1.00 16.98 C ATOM 1024 C LEU A 65 37.987 12.885 29.415 1.00 17.23 C ATOM 1025 O LEU A 65 38.844 13.701 29.064 1.00 16.18 O ATOM 1026 CB LEU A 65 36.857 13.125 31.642 1.00 18.31 C ATOM 1027 CG LEU A 65 35.816 13.855 32.498 1.00 18.00 C ATOM 1028 CD1 LEU A 65 35.715 13.203 33.869 1.00 18.24 C ATOM 1029 CD2 LEU A 65 36.197 15.337 32.614 1.00 19.94 C ATOM 1030 HA LEU A 65 36.585 14.406 29.937 1.00 0.00 H ATOM 1031 HB2 LEU A 65 36.769 12.057 31.840 1.00 0.00 H ATOM 1032 HB3 LEU A 65 37.846 13.469 31.945 1.00 0.00 H ATOM 1033 HG LEU A 65 34.838 13.786 32.023 1.00 0.00 H ATOM 1034 HD21 LEU A 65 37.178 15.423 33.082 1.00 0.00 H ATOM 1035 HD22 LEU A 65 36.227 15.782 31.619 1.00 0.00 H ATOM 1036 HD23 LEU A 65 35.456 15.855 33.223 1.00 0.00 H ATOM 1037 HD11 LEU A 65 35.416 12.161 33.753 1.00 0.00 H ATOM 1038 HD12 LEU A 65 36.684 13.252 34.365 1.00 0.00 H ATOM 1039 HD13 LEU A 65 34.972 13.731 34.467 1.00 0.00 H ATOM 1040 H LEU A 65 35.028 12.001 30.275 1.00 0.00 H ATOM 1041 N LEU A 66 38.099 11.575 29.200 1.00 16.68 N ATOM 1042 CA LEU A 66 39.264 11.009 28.525 1.00 16.99 C ATOM 1043 C LEU A 66 39.351 11.483 27.074 1.00 17.62 C ATOM 1044 O LEU A 66 40.425 11.832 26.582 1.00 17.06 O ATOM 1045 CB LEU A 66 39.227 9.478 28.599 1.00 17.96 C ATOM 1046 CG LEU A 66 39.524 8.905 29.993 1.00 16.59 C ATOM 1047 CD1 LEU A 66 39.213 7.411 30.034 1.00 17.69 C ATOM 1048 CD2 LEU A 66 40.997 9.159 30.370 1.00 17.03 C ATOM 1049 HA LEU A 66 40.159 11.361 29.038 1.00 0.00 H ATOM 1050 HB2 LEU A 66 38.234 9.145 28.297 1.00 0.00 H ATOM 1051 HB3 LEU A 66 39.968 9.084 27.903 1.00 0.00 H ATOM 1052 HG LEU A 66 38.886 9.409 30.719 1.00 0.00 H ATOM 1053 HD21 LEU A 66 41.646 8.676 29.639 1.00 0.00 H ATOM 1054 HD22 LEU A 66 41.189 10.232 30.376 1.00 0.00 H ATOM 1055 HD23 LEU A 66 41.193 8.748 31.360 1.00 0.00 H ATOM 1056 HD11 LEU A 66 38.159 7.254 29.803 1.00 0.00 H ATOM 1057 HD12 LEU A 66 39.829 6.893 29.299 1.00 0.00 H ATOM 1058 HD13 LEU A 66 39.430 7.023 31.029 1.00 0.00 H ATOM 1059 H LEU A 66 37.339 10.941 29.520 1.00 0.00 H ATOM 1060 N LYS A 67 38.211 11.480 26.392 1.00 16.59 N ATOM 1061 CA LYS A 67 38.132 11.987 25.031 1.00 16.92 C ATOM 1062 C LYS A 67 38.556 13.454 24.981 1.00 18.23 C ATOM 1063 O LYS A 67 39.323 13.854 24.111 1.00 16.79 O ATOM 1064 CB LYS A 67 36.705 11.852 24.520 1.00 17.30 C ATOM 1065 CG LYS A 67 36.513 12.360 23.107 1.00 23.34 C ATOM 1066 CD LYS A 67 35.037 12.444 22.741 1.00 31.77 C ATOM 1067 CE LYS A 67 34.855 12.680 21.244 1.00 40.90 C ATOM 1068 NZ LYS A 67 33.426 12.889 20.875 1.00 44.85 N ATOM 1069 HA LYS A 67 38.805 11.406 24.401 1.00 0.00 H ATOM 1070 HB2 LYS A 67 36.428 10.798 24.548 1.00 0.00 H ATOM 1071 HB3 LYS A 67 36.048 12.417 25.181 1.00 0.00 H ATOM 1072 HG2 LYS A 67 36.956 13.352 23.024 1.00 0.00 H ATOM 1073 HG3 LYS A 67 37.012 11.681 22.415 1.00 0.00 H ATOM 1074 HD2 LYS A 67 34.548 11.510 23.017 1.00 0.00 H ATOM 1075 HD3 LYS A 67 34.580 13.268 23.290 1.00 0.00 H ATOM 1076 HE2 LYS A 67 35.234 11.813 20.703 1.00 0.00 H ATOM 1077 HE3 LYS A 67 35.425 13.564 20.956 1.00 0.00 H ATOM 1078 HZ1 LYS A 67 32.874 12.048 21.139 1.00 0.00 H ATOM 1079 HZ2 LYS A 67 33.057 13.720 21.380 1.00 0.00 H ATOM 1080 HZ3 LYS A 67 33.353 13.045 19.849 1.00 0.00 H ATOM 1081 H LYS A 67 37.352 11.105 26.843 1.00 0.00 H ATOM 1082 N MET A 68 38.056 14.246 25.927 1.00 17.58 N ATOM 1083 CA MET A 68 38.361 15.674 25.980 1.00 18.82 C ATOM 1084 C MET A 68 39.845 15.906 26.240 1.00 18.38 C ATOM 1085 O MET A 68 40.472 16.764 25.617 1.00 18.63 O ATOM 1086 CB MET A 68 37.509 16.373 27.054 1.00 19.00 C ATOM 1087 CG MET A 68 37.781 17.880 27.181 1.00 21.27 C ATOM 1088 SD MET A 68 39.217 18.268 28.209 1.00 22.32 S ATOM 1089 CE MET A 68 38.539 17.997 29.843 1.00 18.20 C ATOM 1090 HA MET A 68 38.115 16.106 25.010 1.00 0.00 H ATOM 1091 HB2 MET A 68 36.458 16.234 26.803 1.00 0.00 H ATOM 1092 HB3 MET A 68 37.717 15.904 28.016 1.00 0.00 H ATOM 1093 HG2 MET A 68 36.903 18.354 27.621 1.00 0.00 H ATOM 1094 HG3 MET A 68 37.950 18.286 26.184 1.00 0.00 H ATOM 1095 HE1 MET A 68 37.694 18.667 30.000 1.00 0.00 H ATOM 1096 HE2 MET A 68 38.205 16.963 29.930 1.00 0.00 H ATOM 1097 HE3 MET A 68 39.306 18.196 30.591 1.00 0.00 H ATOM 1098 H MET A 68 37.430 13.836 26.649 1.00 0.00 H ATOM 1099 N GLN A 69 40.404 15.132 27.167 1.00 17.32 N ATOM 1100 CA GLN A 69 41.833 15.179 27.466 1.00 16.01 C ATOM 1101 C GLN A 69 42.665 15.042 26.182 1.00 17.92 C ATOM 1102 O GLN A 69 43.566 15.851 25.900 1.00 16.29 O ATOM 1103 CB GLN A 69 42.181 14.063 28.469 1.00 15.83 C ATOM 1104 CG GLN A 69 43.644 14.002 28.913 1.00 16.63 C ATOM 1105 CD GLN A 69 43.992 15.033 29.972 1.00 18.65 C ATOM 1106 OE1 GLN A 69 44.120 16.225 29.680 1.00 19.22 O ATOM 1107 NE2 GLN A 69 44.146 14.577 31.217 1.00 18.46 N ATOM 1108 HA GLN A 69 42.074 16.145 27.911 1.00 0.00 H ATOM 1109 HB2 GLN A 69 41.567 14.208 29.358 1.00 0.00 H ATOM 1110 HB3 GLN A 69 41.931 13.108 28.008 1.00 0.00 H ATOM 1111 HG2 GLN A 69 43.842 13.009 29.317 1.00 0.00 H ATOM 1112 HG3 GLN A 69 44.278 14.172 28.043 1.00 0.00 H ATOM 1113 HE22 GLN A 69 44.029 13.563 31.418 1.00 0.00 H ATOM 1114 HE21 GLN A 69 44.383 15.235 31.986 1.00 0.00 H ATOM 1115 H GLN A 69 39.802 14.470 27.697 1.00 0.00 H ATOM 1116 N ASN A 70 42.361 14.016 25.397 1.00 15.13 N ATOM 1117 CA ASN A 70 43.048 13.826 24.121 1.00 18.05 C ATOM 1118 C ASN A 70 42.790 14.952 23.128 1.00 16.91 C ATOM 1119 O ASN A 70 43.695 15.350 22.385 1.00 17.26 O ATOM 1120 CB ASN A 70 42.687 12.476 23.485 1.00 17.41 C ATOM 1121 CG ASN A 70 43.573 11.346 23.976 1.00 19.46 C ATOM 1122 OD1 ASN A 70 44.589 11.585 24.632 1.00 20.94 O ATOM 1123 ND2 ASN A 70 43.198 10.108 23.654 1.00 15.29 N ATOM 1124 HA ASN A 70 44.112 13.838 24.356 1.00 0.00 H ATOM 1125 HB2 ASN A 70 41.651 12.240 23.730 1.00 0.00 H ATOM 1126 HB3 ASN A 70 42.794 12.559 22.403 1.00 0.00 H ATOM 1127 HD22 ASN A 70 42.332 9.955 23.099 1.00 0.00 H ATOM 1128 HD21 ASN A 70 43.771 9.295 23.958 1.00 0.00 H ATOM 1129 H ASN A 70 41.627 13.341 25.693 1.00 0.00 H ATOM 1130 N GLN A 71 41.565 15.464 23.108 1.00 16.87 N ATOM 1131 CA GLN A 71 41.239 16.560 22.188 1.00 19.32 C ATOM 1132 C GLN A 71 42.083 17.793 22.454 1.00 19.33 C ATOM 1133 O GLN A 71 42.431 18.509 21.524 1.00 18.31 O ATOM 1134 CB GLN A 71 39.763 16.937 22.260 1.00 19.19 C ATOM 1135 CG GLN A 71 38.847 15.969 21.542 1.00 23.05 C ATOM 1136 CD GLN A 71 37.393 16.309 21.755 1.00 31.31 C ATOM 1137 OE1 GLN A 71 36.975 16.590 22.879 1.00 34.08 O ATOM 1138 NE2 GLN A 71 36.612 16.302 20.679 1.00 35.13 N ATOM 1139 HA GLN A 71 41.462 16.191 21.187 1.00 0.00 H ATOM 1140 HB2 GLN A 71 39.469 16.975 23.309 1.00 0.00 H ATOM 1141 HB3 GLN A 71 39.638 17.923 21.813 1.00 0.00 H ATOM 1142 HG2 GLN A 71 39.065 16.003 20.474 1.00 0.00 H ATOM 1143 HG3 GLN A 71 39.033 14.963 21.918 1.00 0.00 H ATOM 1144 HE22 GLN A 71 37.010 16.058 19.749 1.00 0.00 H ATOM 1145 HE21 GLN A 71 35.604 16.540 20.767 1.00 0.00 H ATOM 1146 H GLN A 71 40.835 15.087 23.746 1.00 0.00 H ATOM 1147 N ARG A 72 42.420 18.020 23.724 1.00 16.86 N ATOM 1148 CA ARG A 72 43.193 19.190 24.125 1.00 17.38 C ATOM 1149 C ARG A 72 44.706 18.944 24.069 1.00 18.29 C ATOM 1150 O ARG A 72 45.494 19.868 24.264 1.00 18.35 O ATOM 1151 CB ARG A 72 42.795 19.647 25.536 1.00 17.36 C ATOM 1152 CG ARG A 72 41.365 20.175 25.668 1.00 17.38 C ATOM 1153 CD ARG A 72 41.129 21.426 24.802 1.00 17.57 C ATOM 1154 NE ARG A 72 42.051 22.524 25.110 1.00 18.15 N ATOM 1155 CZ ARG A 72 41.872 23.419 26.079 1.00 18.68 C ATOM 1156 NH1 ARG A 72 40.793 23.366 26.862 1.00 17.86 N ATOM 1157 NH2 ARG A 72 42.771 24.383 26.261 1.00 18.18 N ATOM 1158 HA ARG A 72 42.960 19.976 23.407 1.00 0.00 H ATOM 1159 HB2 ARG A 72 42.905 18.798 26.210 1.00 0.00 H ATOM 1160 HB3 ARG A 72 43.478 20.441 25.839 1.00 0.00 H ATOM 1161 HG2 ARG A 72 40.671 19.394 25.356 1.00 0.00 H ATOM 1162 HG3 ARG A 72 41.178 20.429 26.711 1.00 0.00 H ATOM 1163 HD2 ARG A 72 40.109 21.774 24.966 1.00 0.00 H ATOM 1164 HD3 ARG A 72 41.254 21.151 23.755 1.00 0.00 H ATOM 1165 HE ARG A 72 42.909 22.610 24.528 1.00 0.00 H ATOM 1166 HH12 ARG A 72 40.663 24.070 27.616 1.00 0.00 H ATOM 1167 HH11 ARG A 72 40.082 22.621 26.718 1.00 0.00 H ATOM 1168 HH22 ARG A 72 42.635 25.084 27.017 1.00 0.00 H ATOM 1169 HH21 ARG A 72 43.609 24.435 25.648 1.00 0.00 H ATOM 1170 H ARG A 72 42.122 17.340 24.453 1.00 0.00 H ATOM 1171 N GLY A 73 45.108 17.703 23.808 1.00 16.80 N ATOM 1172 CA GLY A 73 46.520 17.379 23.726 1.00 17.83 C ATOM 1173 C GLY A 73 47.136 17.025 25.065 1.00 19.73 C ATOM 1174 O GLY A 73 48.355 16.944 25.187 1.00 19.25 O ATOM 1175 HA3 GLY A 73 47.049 18.241 23.319 1.00 0.00 H ATOM 1176 HA2 GLY A 73 46.641 16.529 23.054 1.00 0.00 H ATOM 1177 H GLY A 73 44.401 16.955 23.661 1.00 0.00 H ATOM 1178 N GLY A 74 46.287 16.805 26.064 1.00 17.55 N ATOM 1179 CA GLY A 74 46.721 16.310 27.356 1.00 18.69 C ATOM 1180 C GLY A 74 46.929 14.804 27.299 1.00 21.35 C ATOM 1181 O GLY A 74 46.578 14.146 26.318 1.00 17.54 O ATOM 1182 HA3 GLY A 74 45.962 16.541 28.104 1.00 0.00 H ATOM 1183 HA2 GLY A 74 47.659 16.793 27.631 1.00 0.00 H ATOM 1184 H GLY A 74 45.276 16.995 25.914 1.00 0.00 H ATOM 1185 N ARG A 75 47.506 14.243 28.350 1.00 20.00 N ATOM 1186 CA ARG A 75 47.821 12.825 28.320 1.00 19.15 C ATOM 1187 C ARG A 75 47.136 12.090 29.462 1.00 20.36 C ATOM 1188 O ARG A 75 47.333 12.413 30.629 1.00 19.94 O ATOM 1189 CB ARG A 75 49.341 12.617 28.334 1.00 18.93 C ATOM 1190 CG ARG A 75 50.051 13.141 27.055 1.00 23.43 C ATOM 1191 CD ARG A 75 49.599 12.352 25.811 1.00 22.39 C ATOM 1192 NE ARG A 75 50.055 12.914 24.527 1.00 23.76 N ATOM 1193 CZ ARG A 75 49.235 13.429 23.610 1.00 22.14 C ATOM 1194 NH1 ARG A 75 47.927 13.472 23.834 1.00 21.50 N ATOM 1195 NH2 ARG A 75 49.715 13.902 22.467 1.00 24.80 N ATOM 1196 HA ARG A 75 47.437 12.401 27.393 1.00 0.00 H ATOM 1197 HB2 ARG A 75 49.753 13.141 29.197 1.00 0.00 H ATOM 1198 HB3 ARG A 75 49.542 11.550 28.428 1.00 0.00 H ATOM 1199 HG2 ARG A 75 49.807 14.194 26.918 1.00 0.00 H ATOM 1200 HG3 ARG A 75 51.129 13.032 27.175 1.00 0.00 H ATOM 1201 HD2 ARG A 75 48.509 12.325 25.803 1.00 0.00 H ATOM 1202 HD3 ARG A 75 49.985 11.336 25.894 1.00 0.00 H ATOM 1203 HE ARG A 75 51.075 12.909 24.324 1.00 0.00 H ATOM 1204 HH12 ARG A 75 47.290 13.874 23.117 1.00 0.00 H ATOM 1205 HH11 ARG A 75 47.540 13.104 24.726 1.00 0.00 H ATOM 1206 HH22 ARG A 75 49.068 14.302 21.757 1.00 0.00 H ATOM 1207 HH21 ARG A 75 50.738 13.873 22.281 1.00 0.00 H ATOM 1208 H ARG A 75 47.732 14.813 29.190 1.00 0.00 H ATOM 1209 N ALA A 76 46.317 11.106 29.112 1.00 19.56 N ATOM 1210 CA ALA A 76 45.628 10.300 30.113 1.00 18.66 C ATOM 1211 C ALA A 76 46.638 9.583 30.996 1.00 19.53 C ATOM 1212 O ALA A 76 47.569 8.952 30.500 1.00 19.29 O ATOM 1213 CB ALA A 76 44.720 9.284 29.435 1.00 17.10 C ATOM 1214 HA ALA A 76 45.021 10.959 30.733 1.00 0.00 H ATOM 1215 HB1 ALA A 76 43.982 9.807 28.827 1.00 0.00 H ATOM 1216 HB2 ALA A 76 45.318 8.631 28.800 1.00 0.00 H ATOM 1217 HB3 ALA A 76 44.212 8.689 30.194 1.00 0.00 H ATOM 1218 H ALA A 76 46.163 10.906 28.103 1.00 0.00 H ATOM 1219 N LEU A 77 46.455 9.677 32.307 1.00 17.30 N ATOM 1220 CA LEU A 77 47.265 8.894 33.226 1.00 18.54 C ATOM 1221 C LEU A 77 46.341 8.197 34.204 1.00 20.67 C ATOM 1222 O LEU A 77 45.639 8.849 34.969 1.00 20.66 O ATOM 1223 CB LEU A 77 48.266 9.778 33.968 1.00 21.99 C ATOM 1224 CG LEU A 77 49.516 10.156 33.168 1.00 25.34 C ATOM 1225 CD1 LEU A 77 50.392 11.124 33.967 1.00 28.86 C ATOM 1226 CD2 LEU A 77 50.300 8.903 32.800 1.00 24.23 C ATOM 1227 HA LEU A 77 47.839 8.156 32.666 1.00 0.00 H ATOM 1228 HB2 LEU A 77 47.757 10.698 34.254 1.00 0.00 H ATOM 1229 HB3 LEU A 77 48.586 9.247 34.865 1.00 0.00 H ATOM 1230 HG LEU A 77 49.206 10.656 32.250 1.00 0.00 H ATOM 1231 HD21 LEU A 77 50.600 8.383 33.710 1.00 0.00 H ATOM 1232 HD22 LEU A 77 49.672 8.248 32.196 1.00 0.00 H ATOM 1233 HD23 LEU A 77 51.186 9.184 32.232 1.00 0.00 H ATOM 1234 HD11 LEU A 77 49.825 12.028 34.187 1.00 0.00 H ATOM 1235 HD12 LEU A 77 50.698 10.650 34.900 1.00 0.00 H ATOM 1236 HD13 LEU A 77 51.275 11.381 33.382 1.00 0.00 H ATOM 1237 H LEU A 77 45.725 10.317 32.681 1.00 0.00 H ATOM 1238 N PHE A 78 46.334 6.871 34.169 1.00 16.15 N ATOM 1239 CA PHE A 78 45.427 6.112 35.012 1.00 17.19 C ATOM 1240 C PHE A 78 46.096 5.712 36.314 1.00 17.54 C ATOM 1241 O PHE A 78 47.307 5.501 36.360 1.00 20.79 O ATOM 1242 CB PHE A 78 44.902 4.887 34.268 1.00 14.88 C ATOM 1243 CG PHE A 78 44.106 5.235 33.055 1.00 17.33 C ATOM 1244 CD1 PHE A 78 42.804 5.689 33.178 1.00 18.88 C ATOM 1245 CD2 PHE A 78 44.673 5.156 31.794 1.00 17.39 C ATOM 1246 CE1 PHE A 78 42.067 6.026 32.057 1.00 20.56 C ATOM 1247 CE2 PHE A 78 43.944 5.500 30.665 1.00 19.48 C ATOM 1248 CZ PHE A 78 42.640 5.926 30.798 1.00 19.19 C ATOM 1249 HA PHE A 78 44.579 6.751 35.259 1.00 0.00 H ATOM 1250 HB2 PHE A 78 45.751 4.276 33.962 1.00 0.00 H ATOM 1251 HB3 PHE A 78 44.269 4.314 34.946 1.00 0.00 H ATOM 1252 HD2 PHE A 78 45.704 4.820 31.687 1.00 0.00 H ATOM 1253 HE2 PHE A 78 44.400 5.434 29.677 1.00 0.00 H ATOM 1254 HZ PHE A 78 42.059 6.185 29.913 1.00 0.00 H ATOM 1255 HE1 PHE A 78 41.038 6.369 32.163 1.00 0.00 H ATOM 1256 HD1 PHE A 78 42.356 5.782 34.167 1.00 0.00 H ATOM 1257 H PHE A 78 46.985 6.370 33.531 1.00 0.00 H ATOM 1258 N GLN A 79 45.299 5.643 37.372 1.00 17.60 N ATOM 1259 CA GLN A 79 45.794 5.262 38.694 1.00 19.26 C ATOM 1260 C GLN A 79 44.959 4.115 39.240 1.00 17.50 C ATOM 1261 O GLN A 79 43.903 3.800 38.698 1.00 15.01 O ATOM 1262 CB GLN A 79 45.715 6.450 39.657 1.00 21.34 C ATOM 1263 CG GLN A 79 46.476 7.690 39.189 1.00 23.48 C ATOM 1264 CD GLN A 79 47.980 7.513 39.233 1.00 29.36 C ATOM 1265 OE1 GLN A 79 48.490 6.512 39.749 1.00 30.45 O ATOM 1266 NE2 GLN A 79 48.708 8.493 38.694 1.00 32.34 N ATOM 1267 HA GLN A 79 46.834 4.950 38.601 1.00 0.00 H ATOM 1268 HB2 GLN A 79 44.666 6.720 39.782 1.00 0.00 H ATOM 1269 HB3 GLN A 79 46.126 6.139 40.618 1.00 0.00 H ATOM 1270 HG2 GLN A 79 46.182 7.912 38.163 1.00 0.00 H ATOM 1271 HG3 GLN A 79 46.206 8.527 39.832 1.00 0.00 H ATOM 1272 HE22 GLN A 79 48.237 9.318 38.270 1.00 0.00 H ATOM 1273 HE21 GLN A 79 49.746 8.432 38.698 1.00 0.00 H ATOM 1274 H GLN A 79 44.290 5.867 37.258 1.00 0.00 H ATOM 1275 N ASP A 80 45.429 3.485 40.314 1.00 17.93 N ATOM 1276 CA ASP A 80 44.652 2.422 40.930 1.00 18.05 C ATOM 1277 C ASP A 80 43.267 2.950 41.259 1.00 18.98 C ATOM 1278 O ASP A 80 43.091 4.133 41.574 1.00 18.60 O ATOM 1279 CB ASP A 80 45.315 1.926 42.214 1.00 18.94 C ATOM 1280 CG ASP A 80 46.678 1.312 41.975 1.00 19.10 C ATOM 1281 OD1 ASP A 80 46.926 0.768 40.872 1.00 16.48 O ATOM 1282 OD2 ASP A 80 47.507 1.371 42.909 1.00 20.89 O ATOM 1283 HA ASP A 80 44.590 1.589 40.230 1.00 0.00 H ATOM 1284 HB2 ASP A 80 45.428 2.769 42.895 1.00 0.00 H ATOM 1285 HB3 ASP A 80 44.670 1.175 42.671 1.00 0.00 H ATOM 1286 H ASP A 80 46.352 3.753 40.712 1.00 0.00 H ATOM 1287 N LEU A 81 42.284 2.064 41.194 1.00 15.62 N ATOM 1288 CA LEU A 81 40.920 2.400 41.555 1.00 16.98 C ATOM 1289 C LEU A 81 40.580 1.752 42.884 1.00 18.76 C ATOM 1290 O LEU A 81 40.555 0.519 43.004 1.00 17.32 O ATOM 1291 CB LEU A 81 39.947 1.908 40.479 1.00 20.14 C ATOM 1292 CG LEU A 81 40.000 2.631 39.131 1.00 22.14 C ATOM 1293 CD1 LEU A 81 39.109 1.907 38.125 1.00 20.21 C ATOM 1294 CD2 LEU A 81 39.567 4.083 39.285 1.00 20.29 C ATOM 1295 HA LEU A 81 40.830 3.483 41.638 1.00 0.00 H ATOM 1296 HB2 LEU A 81 40.157 0.854 40.299 1.00 0.00 H ATOM 1297 HB3 LEU A 81 38.936 2.013 40.873 1.00 0.00 H ATOM 1298 HG LEU A 81 41.026 2.623 38.764 1.00 0.00 H ATOM 1299 HD21 LEU A 81 38.546 4.118 39.666 1.00 0.00 H ATOM 1300 HD22 LEU A 81 40.234 4.588 39.984 1.00 0.00 H ATOM 1301 HD23 LEU A 81 39.612 4.579 38.315 1.00 0.00 H ATOM 1302 HD11 LEU A 81 39.461 0.883 38.001 1.00 0.00 H ATOM 1303 HD12 LEU A 81 38.082 1.898 38.491 1.00 0.00 H ATOM 1304 HD13 LEU A 81 39.150 2.425 37.167 1.00 0.00 H ATOM 1305 H LEU A 81 42.497 1.098 40.874 1.00 0.00 H ATOM 1306 N GLN A 82 40.318 2.570 43.894 1.00 18.04 N ATOM 1307 CA GLN A 82 39.991 1.998 45.188 1.00 19.09 C ATOM 1308 C GLN A 82 38.604 1.381 45.175 1.00 17.27 C ATOM 1309 O GLN A 82 37.710 1.838 44.452 1.00 17.11 O ATOM 1310 CB GLN A 82 40.106 3.032 46.300 1.00 20.89 C ATOM 1311 CG GLN A 82 39.190 4.208 46.160 1.00 23.56 C ATOM 1312 CD GLN A 82 39.529 5.284 47.174 1.00 28.69 C ATOM 1313 OE1 GLN A 82 39.152 5.189 48.340 1.00 28.69 O ATOM 1314 NE2 GLN A 82 40.265 6.301 46.740 1.00 30.26 N ATOM 1315 HA GLN A 82 40.716 1.209 45.389 1.00 0.00 H ATOM 1316 HB2 GLN A 82 39.883 2.539 47.246 1.00 0.00 H ATOM 1317 HB3 GLN A 82 41.132 3.401 46.316 1.00 0.00 H ATOM 1318 HG2 GLN A 82 39.289 4.620 45.156 1.00 0.00 H ATOM 1319 HG3 GLN A 82 38.162 3.881 46.317 1.00 0.00 H ATOM 1320 HE22 GLN A 82 40.562 6.340 45.744 1.00 0.00 H ATOM 1321 HE21 GLN A 82 40.545 7.058 47.396 1.00 0.00 H ATOM 1322 H GLN A 82 40.346 3.601 43.762 1.00 0.00 H ATOM 1323 N LYS A 83 38.433 0.344 45.985 1.00 16.50 N ATOM 1324 CA LYS A 83 37.164 -0.356 46.064 1.00 16.12 C ATOM 1325 C LYS A 83 36.147 0.548 46.757 1.00 17.74 C ATOM 1326 O LYS A 83 36.516 1.534 47.389 1.00 16.44 O ATOM 1327 CB LYS A 83 37.325 -1.676 46.822 1.00 17.40 C ATOM 1328 CG LYS A 83 37.553 -1.518 48.318 1.00 17.90 C ATOM 1329 CD LYS A 83 37.705 -2.876 48.989 1.00 21.05 C ATOM 1330 CE LYS A 83 37.789 -2.732 50.505 1.00 25.69 C ATOM 1331 NZ LYS A 83 37.944 -4.049 51.190 1.00 30.81 N ATOM 1332 HA LYS A 83 36.812 -0.594 45.060 1.00 0.00 H ATOM 1333 HB2 LYS A 83 36.421 -2.266 46.675 1.00 0.00 H ATOM 1334 HB3 LYS A 83 38.178 -2.209 46.401 1.00 0.00 H ATOM 1335 HG2 LYS A 83 38.459 -0.935 48.482 1.00 0.00 H ATOM 1336 HG3 LYS A 83 36.702 -0.996 48.756 1.00 0.00 H ATOM 1337 HD2 LYS A 83 36.845 -3.496 48.737 1.00 0.00 H ATOM 1338 HD3 LYS A 83 38.615 -3.353 48.625 1.00 0.00 H ATOM 1339 HE2 LYS A 83 36.877 -2.255 50.863 1.00 0.00 H ATOM 1340 HE3 LYS A 83 38.646 -2.105 50.751 1.00 0.00 H ATOM 1341 HZ1 LYS A 83 37.127 -4.652 50.967 1.00 0.00 H ATOM 1342 HZ2 LYS A 83 38.816 -4.509 50.860 1.00 0.00 H ATOM 1343 HZ3 LYS A 83 37.997 -3.900 52.218 1.00 0.00 H ATOM 1344 H LYS A 83 39.227 0.025 46.577 1.00 0.00 H ATOM 1345 N PRO A 84 34.858 0.236 46.612 1.00 16.15 N ATOM 1346 CA PRO A 84 33.841 1.086 47.251 1.00 16.59 C ATOM 1347 C PRO A 84 33.960 1.084 48.774 1.00 19.23 C ATOM 1348 O PRO A 84 34.608 0.204 49.346 1.00 19.40 O ATOM 1349 CB PRO A 84 32.517 0.464 46.790 1.00 16.55 C ATOM 1350 CG PRO A 84 32.877 -0.241 45.495 1.00 15.05 C ATOM 1351 CD PRO A 84 34.266 -0.781 45.723 1.00 14.81 C ATOM 1352 HA PRO A 84 33.941 2.135 46.972 1.00 0.00 H ATOM 1353 HD3 PRO A 84 34.236 -1.758 46.206 1.00 0.00 H ATOM 1354 HD2 PRO A 84 34.819 -0.857 44.787 1.00 0.00 H ATOM 1355 HG3 PRO A 84 32.870 0.460 44.661 1.00 0.00 H ATOM 1356 HG2 PRO A 84 32.178 -1.052 45.292 1.00 0.00 H ATOM 1357 HB2 PRO A 84 32.144 -0.246 47.528 1.00 0.00 H ATOM 1358 HB3 PRO A 84 31.766 1.234 46.617 1.00 0.00 H ATOM 1359 N SER A 85 33.332 2.068 49.413 1.00 18.58 N ATOM 1360 CA SER A 85 33.480 2.290 50.850 1.00 23.36 C ATOM 1361 C SER A 85 32.806 1.200 51.671 1.00 21.71 C ATOM 1362 O SER A 85 33.141 1.011 52.830 1.00 23.50 O ATOM 1363 CB SER A 85 32.880 3.645 51.238 1.00 22.15 C ATOM 1364 OG SER A 85 31.489 3.665 50.938 1.00 25.71 O ATOM 1365 HA SER A 85 34.548 2.271 51.067 1.00 0.00 H ATOM 1366 HB2 SER A 85 33.381 4.435 50.680 1.00 0.00 H ATOM 1367 HB3 SER A 85 33.022 3.810 52.306 1.00 0.00 H ATOM 1368 HG SER A 85 31.110 4.544 51.192 1.00 0.00 H ATOM 1369 H SER A 85 32.713 2.703 48.870 1.00 0.00 H ATOM 1370 N GLN A 86 31.859 0.484 51.068 1.00 19.02 N ATOM 1371 CA GLN A 86 31.120 -0.561 51.775 1.00 19.97 C ATOM 1372 C GLN A 86 30.993 -1.844 50.949 1.00 19.13 C ATOM 1373 O GLN A 86 31.068 -1.809 49.727 1.00 18.28 O ATOM 1374 CB GLN A 86 29.724 -0.047 52.155 1.00 19.03 C ATOM 1375 CG GLN A 86 29.771 1.148 53.099 1.00 21.47 C ATOM 1376 CD GLN A 86 28.406 1.732 53.382 1.00 26.68 C ATOM 1377 OE1 GLN A 86 28.268 2.940 53.553 1.00 29.68 O ATOM 1378 NE2 GLN A 86 27.385 0.877 53.436 1.00 26.21 N ATOM 1379 HA GLN A 86 31.685 -0.806 52.675 1.00 0.00 H ATOM 1380 HB2 GLN A 86 29.202 0.248 51.245 1.00 0.00 H ATOM 1381 HB3 GLN A 86 29.176 -0.854 52.641 1.00 0.00 H ATOM 1382 HG2 GLN A 86 30.215 0.829 54.042 1.00 0.00 H ATOM 1383 HG3 GLN A 86 30.394 1.922 52.650 1.00 0.00 H ATOM 1384 HE22 GLN A 86 27.549 -0.139 53.285 1.00 0.00 H ATOM 1385 HE21 GLN A 86 26.424 1.226 53.629 1.00 0.00 H ATOM 1386 H GLN A 86 31.639 0.673 50.069 1.00 0.00 H ATOM 1387 N ASP A 87 30.804 -2.976 51.627 1.00 19.37 N ATOM 1388 CA ASP A 87 30.545 -4.245 50.951 1.00 18.39 C ATOM 1389 C ASP A 87 29.041 -4.514 50.896 1.00 20.59 C ATOM 1390 O ASP A 87 28.535 -5.148 49.960 1.00 18.52 O ATOM 1391 CB ASP A 87 31.230 -5.393 51.696 1.00 17.74 C ATOM 1392 CG ASP A 87 32.750 -5.282 51.671 1.00 24.83 C ATOM 1393 OD1 ASP A 87 33.306 -4.838 50.648 1.00 21.85 O ATOM 1394 OD2 ASP A 87 33.387 -5.646 52.675 1.00 24.19 O ATOM 1395 HA ASP A 87 30.943 -4.181 49.938 1.00 0.00 H ATOM 1396 HB2 ASP A 87 30.896 -5.385 52.733 1.00 0.00 H ATOM 1397 HB3 ASP A 87 30.940 -6.335 51.229 1.00 0.00 H ATOM 1398 H ASP A 87 30.842 -2.955 52.666 1.00 0.00 H ATOM 1399 N GLU A 88 28.340 -4.037 51.919 1.00 17.12 N ATOM 1400 CA GLU A 88 26.884 -4.167 51.996 1.00 19.26 C ATOM 1401 C GLU A 88 26.287 -2.787 52.230 1.00 19.78 C ATOM 1402 O GLU A 88 26.880 -1.969 52.922 1.00 19.19 O ATOM 1403 CB GLU A 88 26.502 -5.109 53.140 1.00 21.37 C ATOM 1404 CG GLU A 88 27.065 -6.504 52.973 1.00 22.71 C ATOM 1405 CD GLU A 88 26.526 -7.474 54.011 1.00 32.67 C ATOM 1406 OE1 GLU A 88 26.302 -7.042 55.159 1.00 33.91 O ATOM 1407 OE2 GLU A 88 26.321 -8.660 53.675 1.00 32.20 O ATOM 1408 HA GLU A 88 26.497 -4.584 51.066 1.00 0.00 H ATOM 1409 HB2 GLU A 88 26.879 -4.692 54.074 1.00 0.00 H ATOM 1410 HB3 GLU A 88 25.415 -5.176 53.186 1.00 0.00 H ATOM 1411 HG2 GLU A 88 26.803 -6.871 51.981 1.00 0.00 H ATOM 1412 HG3 GLU A 88 28.150 -6.458 53.067 1.00 0.00 H ATOM 1413 H GLU A 88 28.843 -3.555 52.691 1.00 0.00 H ATOM 1414 N TRP A 89 25.115 -2.527 51.664 1.00 18.19 N ATOM 1415 CA TRP A 89 24.626 -1.161 51.601 1.00 17.07 C ATOM 1416 C TRP A 89 23.331 -0.892 52.375 1.00 19.90 C ATOM 1417 O TRP A 89 22.762 0.188 52.269 1.00 18.73 O ATOM 1418 CB TRP A 89 24.499 -0.737 50.137 1.00 17.46 C ATOM 1419 CG TRP A 89 25.815 -0.796 49.399 1.00 16.76 C ATOM 1420 CD1 TRP A 89 26.287 -1.833 48.627 1.00 16.71 C ATOM 1421 CD2 TRP A 89 26.836 0.211 49.384 1.00 17.08 C ATOM 1422 NE1 TRP A 89 27.529 -1.521 48.128 1.00 16.77 N ATOM 1423 CE2 TRP A 89 27.889 -0.273 48.573 1.00 18.05 C ATOM 1424 CE3 TRP A 89 26.951 1.485 49.956 1.00 20.48 C ATOM 1425 CZ2 TRP A 89 29.049 0.467 48.334 1.00 17.19 C ATOM 1426 CZ3 TRP A 89 28.105 2.225 49.715 1.00 20.17 C ATOM 1427 CH2 TRP A 89 29.140 1.710 48.908 1.00 18.59 C ATOM 1428 HA TRP A 89 25.368 -0.549 52.114 1.00 0.00 H ATOM 1429 HB2 TRP A 89 23.790 -1.401 49.641 1.00 0.00 H ATOM 1430 HB3 TRP A 89 24.124 0.286 50.101 1.00 0.00 H ATOM 1431 HE1 TRP A 89 28.103 -2.132 47.513 1.00 0.00 H ATOM 1432 HD1 TRP A 89 25.754 -2.765 48.439 1.00 0.00 H ATOM 1433 HZ2 TRP A 89 29.853 0.071 47.714 1.00 0.00 H ATOM 1434 HH2 TRP A 89 30.032 2.312 48.736 1.00 0.00 H ATOM 1435 HZ3 TRP A 89 28.210 3.216 50.156 1.00 0.00 H ATOM 1436 HE3 TRP A 89 26.152 1.889 50.578 1.00 0.00 H ATOM 1437 H TRP A 89 24.547 -3.302 51.266 1.00 0.00 H ATOM 1438 N GLY A 90 22.870 -1.872 53.150 1.00 19.48 N ATOM 1439 CA GLY A 90 21.736 -1.664 54.034 1.00 20.41 C ATOM 1440 C GLY A 90 20.412 -1.497 53.298 1.00 20.50 C ATOM 1441 O GLY A 90 20.094 -2.225 52.353 1.00 20.47 O ATOM 1442 HA3 GLY A 90 21.919 -0.766 54.624 1.00 0.00 H ATOM 1443 HA2 GLY A 90 21.655 -2.524 54.699 1.00 0.00 H ATOM 1444 H GLY A 90 23.331 -2.804 53.122 1.00 0.00 H ATOM 1445 N THR A 91 19.620 -0.533 53.737 1.00 19.41 N ATOM 1446 CA THR A 91 18.314 -0.317 53.126 1.00 19.23 C ATOM 1447 C THR A 91 18.417 0.588 51.901 1.00 19.83 C ATOM 1448 O THR A 91 19.466 1.171 51.625 1.00 17.14 O ATOM 1449 CB THR A 91 17.350 0.347 54.105 1.00 21.70 C ATOM 1450 OG1 THR A 91 17.911 1.591 54.531 1.00 21.31 O ATOM 1451 CG2 THR A 91 17.105 -0.548 55.316 1.00 23.88 C ATOM 1452 HA THR A 91 17.943 -1.301 52.837 1.00 0.00 H ATOM 1453 HB THR A 91 16.395 0.515 53.607 1.00 0.00 H ATOM 1454 HG1 THR A 91 17.292 2.030 55.167 1.00 0.00 H ATOM 1455 HG23 THR A 91 16.677 -1.495 54.986 1.00 0.00 H ATOM 1456 HG21 THR A 91 18.050 -0.733 55.827 1.00 0.00 H ATOM 1457 HG22 THR A 91 16.413 -0.053 55.998 1.00 0.00 H ATOM 1458 H THR A 91 19.930 0.074 54.522 1.00 0.00 H ATOM 1459 N THR A 92 17.310 0.712 51.177 1.00 17.95 N ATOM 1460 CA THR A 92 17.244 1.628 50.040 1.00 19.37 C ATOM 1461 C THR A 92 17.580 3.026 50.527 1.00 18.89 C ATOM 1462 O THR A 92 18.322 3.763 49.887 1.00 18.77 O ATOM 1463 CB THR A 92 15.838 1.619 49.413 1.00 19.50 C ATOM 1464 OG1 THR A 92 15.521 0.287 48.999 1.00 18.10 O ATOM 1465 CG2 THR A 92 15.784 2.535 48.197 1.00 21.39 C ATOM 1466 HA THR A 92 17.956 1.310 49.279 1.00 0.00 H ATOM 1467 HB THR A 92 15.122 1.972 50.155 1.00 0.00 H ATOM 1468 HG1 THR A 92 15.541 -0.315 49.785 1.00 0.00 H ATOM 1469 HG23 THR A 92 16.024 3.554 48.500 1.00 0.00 H ATOM 1470 HG21 THR A 92 16.507 2.195 47.455 1.00 0.00 H ATOM 1471 HG22 THR A 92 14.782 2.509 47.768 1.00 0.00 H ATOM 1472 H THR A 92 16.473 0.146 51.424 1.00 0.00 H ATOM 1473 N LEU A 93 17.031 3.380 51.684 1.00 18.45 N ATOM 1474 CA LEU A 93 17.342 4.648 52.329 1.00 19.50 C ATOM 1475 C LEU A 93 18.851 4.819 52.553 1.00 19.49 C ATOM 1476 O LEU A 93 19.425 5.829 52.139 1.00 20.03 O ATOM 1477 CB LEU A 93 16.604 4.756 53.663 1.00 21.46 C ATOM 1478 CG LEU A 93 16.742 6.094 54.391 1.00 24.34 C ATOM 1479 CD1 LEU A 93 16.464 7.252 53.435 1.00 23.16 C ATOM 1480 CD2 LEU A 93 15.816 6.137 55.595 1.00 28.68 C ATOM 1481 HA LEU A 93 17.011 5.445 51.663 1.00 0.00 H ATOM 1482 HB2 LEU A 93 15.544 4.585 53.475 1.00 0.00 H ATOM 1483 HB3 LEU A 93 16.985 3.975 54.321 1.00 0.00 H ATOM 1484 HG LEU A 93 17.766 6.196 54.751 1.00 0.00 H ATOM 1485 HD21 LEU A 93 14.785 6.016 55.263 1.00 0.00 H ATOM 1486 HD22 LEU A 93 16.075 5.330 56.280 1.00 0.00 H ATOM 1487 HD23 LEU A 93 15.926 7.095 56.102 1.00 0.00 H ATOM 1488 HD11 LEU A 93 17.177 7.220 52.611 1.00 0.00 H ATOM 1489 HD12 LEU A 93 15.451 7.163 53.044 1.00 0.00 H ATOM 1490 HD13 LEU A 93 16.567 8.196 53.970 1.00 0.00 H ATOM 1491 H LEU A 93 16.359 2.732 52.143 1.00 0.00 H ATOM 1492 N ASP A 94 19.493 3.848 53.207 1.00 19.15 N ATOM 1493 CA ASP A 94 20.942 3.927 53.429 1.00 19.72 C ATOM 1494 C ASP A 94 21.671 4.140 52.115 1.00 18.75 C ATOM 1495 O ASP A 94 22.584 4.968 52.010 1.00 19.12 O ATOM 1496 CB ASP A 94 21.494 2.631 54.046 1.00 22.32 C ATOM 1497 CG ASP A 94 21.053 2.417 55.471 1.00 24.59 C ATOM 1498 OD1 ASP A 94 20.892 3.403 56.210 1.00 24.82 O ATOM 1499 OD2 ASP A 94 20.866 1.243 55.852 1.00 21.68 O ATOM 1500 HA ASP A 94 21.105 4.763 54.110 1.00 0.00 H ATOM 1501 HB2 ASP A 94 21.151 1.788 53.446 1.00 0.00 H ATOM 1502 HB3 ASP A 94 22.583 2.672 54.023 1.00 0.00 H ATOM 1503 H ASP A 94 18.961 3.028 53.563 1.00 0.00 H ATOM 1504 N ALA A 95 21.280 3.356 51.117 1.00 18.07 N ATOM 1505 CA ALA A 95 21.926 3.367 49.817 1.00 19.45 C ATOM 1506 C ALA A 95 21.760 4.711 49.129 1.00 18.22 C ATOM 1507 O ALA A 95 22.732 5.273 48.632 1.00 15.94 O ATOM 1508 CB ALA A 95 21.370 2.247 48.933 1.00 17.08 C ATOM 1509 HA ALA A 95 22.991 3.198 49.973 1.00 0.00 H ATOM 1510 HB1 ALA A 95 21.551 1.284 49.411 1.00 0.00 H ATOM 1511 HB2 ALA A 95 20.298 2.391 48.798 1.00 0.00 H ATOM 1512 HB3 ALA A 95 21.866 2.271 47.963 1.00 0.00 H ATOM 1513 H ALA A 95 20.480 2.709 51.273 1.00 0.00 H ATOM 1514 N MET A 96 20.531 5.217 49.095 1.00 16.85 N ATOM 1515 CA MET A 96 20.260 6.516 48.482 1.00 17.73 C ATOM 1516 C MET A 96 20.983 7.647 49.212 1.00 18.62 C ATOM 1517 O MET A 96 21.422 8.612 48.597 1.00 18.82 O ATOM 1518 CB MET A 96 18.754 6.800 48.432 1.00 17.29 C ATOM 1519 CG MET A 96 18.374 7.899 47.438 1.00 18.92 C ATOM 1520 SD MET A 96 18.656 7.420 45.713 1.00 23.43 S ATOM 1521 CE MET A 96 17.489 6.091 45.511 1.00 19.03 C ATOM 1522 HA MET A 96 20.642 6.473 47.462 1.00 0.00 H ATOM 1523 HB2 MET A 96 18.239 5.883 48.147 1.00 0.00 H ATOM 1524 HB3 MET A 96 18.427 7.105 49.426 1.00 0.00 H ATOM 1525 HG2 MET A 96 18.970 8.785 47.655 1.00 0.00 H ATOM 1526 HG3 MET A 96 17.317 8.133 47.566 1.00 0.00 H ATOM 1527 HE1 MET A 96 17.719 5.296 46.221 1.00 0.00 H ATOM 1528 HE2 MET A 96 16.481 6.463 45.694 1.00 0.00 H ATOM 1529 HE3 MET A 96 17.555 5.703 44.495 1.00 0.00 H ATOM 1530 H MET A 96 19.746 4.678 49.513 1.00 0.00 H ATOM 1531 N LYS A 97 21.127 7.529 50.525 1.00 17.46 N ATOM 1532 CA LYS A 97 21.883 8.531 51.271 1.00 20.13 C ATOM 1533 C LYS A 97 23.349 8.542 50.856 1.00 20.55 C ATOM 1534 O LYS A 97 23.946 9.604 50.643 1.00 17.80 O ATOM 1535 CB LYS A 97 21.756 8.291 52.770 1.00 22.52 C ATOM 1536 CG LYS A 97 20.423 8.759 53.312 1.00 24.96 C ATOM 1537 CD LYS A 97 20.479 8.969 54.794 1.00 29.63 C ATOM 1538 CE LYS A 97 19.782 7.849 55.516 1.00 32.81 C ATOM 1539 NZ LYS A 97 19.163 8.351 56.776 1.00 37.65 N ATOM 1540 HA LYS A 97 21.461 9.508 51.037 1.00 0.00 H ATOM 1541 HB2 LYS A 97 21.860 7.224 52.965 1.00 0.00 H ATOM 1542 HB3 LYS A 97 22.553 8.831 53.281 1.00 0.00 H ATOM 1543 HG2 LYS A 97 20.154 9.699 52.830 1.00 0.00 H ATOM 1544 HG3 LYS A 97 19.665 8.008 53.088 1.00 0.00 H ATOM 1545 HD2 LYS A 97 21.521 9.006 55.111 1.00 0.00 H ATOM 1546 HD3 LYS A 97 19.992 9.912 55.041 1.00 0.00 H ATOM 1547 HE2 LYS A 97 20.506 7.070 55.756 1.00 0.00 H ATOM 1548 HE3 LYS A 97 19.005 7.435 54.873 1.00 0.00 H ATOM 1549 HZ1 LYS A 97 19.903 8.744 57.392 1.00 0.00 H ATOM 1550 HZ2 LYS A 97 18.470 9.092 56.549 1.00 0.00 H ATOM 1551 HZ3 LYS A 97 18.686 7.566 57.263 1.00 0.00 H ATOM 1552 H LYS A 97 20.701 6.722 51.024 1.00 0.00 H ATOM 1553 N ALA A 98 23.919 7.349 50.732 1.00 18.35 N ATOM 1554 CA ALA A 98 25.318 7.224 50.325 1.00 19.54 C ATOM 1555 C ALA A 98 25.490 7.731 48.894 1.00 19.02 C ATOM 1556 O ALA A 98 26.498 8.362 48.567 1.00 16.79 O ATOM 1557 CB ALA A 98 25.783 5.782 50.455 1.00 20.24 C ATOM 1558 HA ALA A 98 25.937 7.834 50.983 1.00 0.00 H ATOM 1559 HB1 ALA A 98 25.685 5.462 51.492 1.00 0.00 H ATOM 1560 HB2 ALA A 98 25.170 5.145 49.818 1.00 0.00 H ATOM 1561 HB3 ALA A 98 26.826 5.709 50.148 1.00 0.00 H ATOM 1562 H ALA A 98 23.363 6.492 50.927 1.00 0.00 H ATOM 1563 N ALA A 99 24.506 7.461 48.040 1.00 17.39 N ATOM 1564 CA ALA A 99 24.569 7.934 46.657 1.00 17.82 C ATOM 1565 C ALA A 99 24.562 9.462 46.568 1.00 19.27 C ATOM 1566 O ALA A 99 25.293 10.041 45.773 1.00 16.95 O ATOM 1567 CB ALA A 99 23.428 7.342 45.817 1.00 17.19 C ATOM 1568 HA ALA A 99 25.518 7.587 46.249 1.00 0.00 H ATOM 1569 HB1 ALA A 99 23.504 6.255 45.818 1.00 0.00 H ATOM 1570 HB2 ALA A 99 22.471 7.641 46.245 1.00 0.00 H ATOM 1571 HB3 ALA A 99 23.502 7.712 44.794 1.00 0.00 H ATOM 1572 H ALA A 99 23.684 6.909 48.359 1.00 0.00 H ATOM 1573 N ILE A 100 23.730 10.131 47.358 1.00 18.76 N ATOM 1574 CA ILE A 100 23.687 11.591 47.251 1.00 17.22 C ATOM 1575 C ILE A 100 24.981 12.224 47.791 1.00 18.80 C ATOM 1576 O ILE A 100 25.457 13.223 47.254 1.00 19.58 O ATOM 1577 CB ILE A 100 22.416 12.204 47.897 1.00 19.53 C ATOM 1578 CG1 ILE A 100 22.157 13.601 47.327 1.00 23.63 C ATOM 1579 CG2 ILE A 100 22.536 12.241 49.403 1.00 21.36 C ATOM 1580 CD1 ILE A 100 20.840 14.233 47.775 1.00 25.16 C ATOM 1581 HA ILE A 100 23.622 11.831 46.190 1.00 0.00 H ATOM 1582 HB ILE A 100 21.563 11.570 47.654 1.00 0.00 H ATOM 1583 HG12 ILE A 100 22.972 14.253 47.640 1.00 0.00 H ATOM 1584 HG13 ILE A 100 22.148 13.529 46.239 1.00 0.00 H ATOM 1585 HD11 ILE A 100 20.010 13.602 47.459 1.00 0.00 H ATOM 1586 HD12 ILE A 100 20.834 14.327 48.861 1.00 0.00 H ATOM 1587 HD13 ILE A 100 20.740 15.220 47.323 1.00 0.00 H ATOM 1588 HG21 ILE A 100 22.666 11.227 49.781 1.00 0.00 H ATOM 1589 HG22 ILE A 100 23.397 12.847 49.683 1.00 0.00 H ATOM 1590 HG23 ILE A 100 21.631 12.675 49.828 1.00 0.00 H ATOM 1591 H ILE A 100 23.123 9.629 48.037 1.00 0.00 H ATOM 1592 N VAL A 101 25.558 11.621 48.828 1.00 17.71 N ATOM 1593 CA VAL A 101 26.880 12.025 49.311 1.00 19.24 C ATOM 1594 C VAL A 101 27.907 11.885 48.191 1.00 18.44 C ATOM 1595 O VAL A 101 28.717 12.792 47.955 1.00 19.06 O ATOM 1596 CB VAL A 101 27.327 11.198 50.536 1.00 20.88 C ATOM 1597 CG1 VAL A 101 28.817 11.400 50.816 1.00 22.41 C ATOM 1598 CG2 VAL A 101 26.496 11.564 51.765 1.00 22.33 C ATOM 1599 HA VAL A 101 26.811 13.067 49.623 1.00 0.00 H ATOM 1600 HB VAL A 101 27.163 10.144 50.311 1.00 0.00 H ATOM 1601 HG11 VAL A 101 29.395 11.082 49.948 1.00 0.00 H ATOM 1602 HG12 VAL A 101 29.008 12.454 51.015 1.00 0.00 H ATOM 1603 HG13 VAL A 101 29.106 10.807 51.683 1.00 0.00 H ATOM 1604 HG21 VAL A 101 26.625 12.623 51.987 1.00 0.00 H ATOM 1605 HG22 VAL A 101 25.444 11.359 51.565 1.00 0.00 H ATOM 1606 HG23 VAL A 101 26.828 10.970 52.616 1.00 0.00 H ATOM 1607 H VAL A 101 25.058 10.845 49.306 1.00 0.00 H ATOM 1608 N LEU A 102 27.867 10.749 47.503 1.00 17.47 N ATOM 1609 CA LEU A 102 28.746 10.500 46.361 1.00 17.18 C ATOM 1610 C LEU A 102 28.588 11.552 45.263 1.00 19.28 C ATOM 1611 O LEU A 102 29.577 12.126 44.791 1.00 17.94 O ATOM 1612 CB LEU A 102 28.496 9.099 45.776 1.00 17.40 C ATOM 1613 CG LEU A 102 29.331 8.674 44.565 1.00 18.21 C ATOM 1614 CD1 LEU A 102 30.814 8.873 44.851 1.00 20.79 C ATOM 1615 CD2 LEU A 102 29.054 7.206 44.169 1.00 17.84 C ATOM 1616 HA LEU A 102 29.768 10.561 46.735 1.00 0.00 H ATOM 1617 HB2 LEU A 102 28.683 8.376 46.570 1.00 0.00 H ATOM 1618 HB3 LEU A 102 27.448 9.051 45.482 1.00 0.00 H ATOM 1619 HG LEU A 102 29.041 9.304 43.724 1.00 0.00 H ATOM 1620 HD21 LEU A 102 29.302 6.552 45.005 1.00 0.00 H ATOM 1621 HD22 LEU A 102 28.000 7.092 43.918 1.00 0.00 H ATOM 1622 HD23 LEU A 102 29.665 6.942 43.306 1.00 0.00 H ATOM 1623 HD11 LEU A 102 31.004 9.925 45.064 1.00 0.00 H ATOM 1624 HD12 LEU A 102 31.101 8.269 45.712 1.00 0.00 H ATOM 1625 HD13 LEU A 102 31.395 8.567 43.981 1.00 0.00 H ATOM 1626 H LEU A 102 27.189 10.013 47.786 1.00 0.00 H ATOM 1627 N GLU A 103 27.352 11.792 44.841 1.00 16.28 N ATOM 1628 CA GLU A 103 27.104 12.794 43.802 1.00 18.43 C ATOM 1629 C GLU A 103 27.548 14.198 44.213 1.00 18.21 C ATOM 1630 O GLU A 103 28.075 14.950 43.384 1.00 17.59 O ATOM 1631 CB GLU A 103 25.627 12.809 43.390 1.00 19.43 C ATOM 1632 CG GLU A 103 25.183 11.540 42.646 1.00 17.81 C ATOM 1633 CD GLU A 103 26.058 11.209 41.452 1.00 21.00 C ATOM 1634 OE1 GLU A 103 26.480 12.139 40.731 1.00 22.12 O ATOM 1635 OE2 GLU A 103 26.310 10.007 41.214 1.00 21.24 O ATOM 1636 HA GLU A 103 27.711 12.500 42.946 1.00 0.00 H ATOM 1637 HB2 GLU A 103 25.019 12.912 44.289 1.00 0.00 H ATOM 1638 HB3 GLU A 103 25.459 13.667 42.739 1.00 0.00 H ATOM 1639 HG2 GLU A 103 25.214 10.702 43.342 1.00 0.00 H ATOM 1640 HG3 GLU A 103 24.160 11.683 42.297 1.00 0.00 H ATOM 1641 H GLU A 103 26.555 11.265 45.251 1.00 0.00 H ATOM 1642 N LYS A 104 27.331 14.554 45.476 1.00 17.20 N ATOM 1643 CA LYS A 104 27.781 15.856 45.969 1.00 20.18 C ATOM 1644 C LYS A 104 29.300 15.971 45.867 1.00 19.66 C ATOM 1645 O LYS A 104 29.825 17.036 45.521 1.00 19.19 O ATOM 1646 CB LYS A 104 27.371 16.080 47.420 1.00 22.10 C ATOM 1647 CG LYS A 104 25.909 16.453 47.648 1.00 25.68 C ATOM 1648 CD LYS A 104 25.641 16.396 49.152 1.00 29.20 C ATOM 1649 CE LYS A 104 24.297 16.967 49.538 1.00 30.71 C ATOM 1650 NZ LYS A 104 24.285 18.439 49.336 1.00 32.81 N ATOM 1651 HA LYS A 104 27.306 16.614 45.347 1.00 0.00 H ATOM 1652 HB2 LYS A 104 27.571 15.161 47.970 1.00 0.00 H ATOM 1653 HB3 LYS A 104 27.988 16.884 47.822 1.00 0.00 H ATOM 1654 HG2 LYS A 104 25.720 17.460 47.275 1.00 0.00 H ATOM 1655 HG3 LYS A 104 25.261 15.747 47.129 1.00 0.00 H ATOM 1656 HD2 LYS A 104 25.680 15.355 49.472 1.00 0.00 H ATOM 1657 HD3 LYS A 104 26.419 16.962 49.665 1.00 0.00 H ATOM 1658 HE2 LYS A 104 24.100 16.746 50.587 1.00 0.00 H ATOM 1659 HE3 LYS A 104 23.522 16.513 48.921 1.00 0.00 H ATOM 1660 HZ1 LYS A 104 25.022 18.875 49.926 1.00 0.00 H ATOM 1661 HZ2 LYS A 104 24.470 18.652 48.335 1.00 0.00 H ATOM 1662 HZ3 LYS A 104 23.354 18.817 49.606 1.00 0.00 H ATOM 1663 H LYS A 104 26.838 13.902 46.118 1.00 0.00 H ATOM 1664 N SER A 105 30.006 14.886 46.186 1.00 18.62 N ATOM 1665 CA SER A 105 31.467 14.882 46.072 1.00 17.94 C ATOM 1666 C SER A 105 31.913 15.038 44.614 1.00 17.96 C ATOM 1667 O SER A 105 32.886 15.737 44.322 1.00 18.05 O ATOM 1668 CB SER A 105 32.086 13.621 46.691 1.00 20.25 C ATOM 1669 OG SER A 105 31.959 12.496 45.833 1.00 22.74 O ATOM 1670 HA SER A 105 31.830 15.741 46.636 1.00 0.00 H ATOM 1671 HB2 SER A 105 31.581 13.406 47.633 1.00 0.00 H ATOM 1672 HB3 SER A 105 33.144 13.803 46.880 1.00 0.00 H ATOM 1673 HG SER A 105 31.000 12.320 45.661 1.00 0.00 H ATOM 1674 H SER A 105 29.514 14.033 46.520 1.00 0.00 H ATOM 1675 N LEU A 106 31.204 14.392 43.696 1.00 17.85 N ATOM 1676 CA LEU A 106 31.505 14.558 42.278 1.00 17.13 C ATOM 1677 C LEU A 106 31.232 15.999 41.853 1.00 17.77 C ATOM 1678 O LEU A 106 32.053 16.624 41.178 1.00 17.35 O ATOM 1679 CB LEU A 106 30.685 13.596 41.414 1.00 18.50 C ATOM 1680 CG LEU A 106 30.985 12.095 41.506 1.00 18.52 C ATOM 1681 CD1 LEU A 106 30.115 11.329 40.494 1.00 19.39 C ATOM 1682 CD2 LEU A 106 32.444 11.802 41.255 1.00 20.55 C ATOM 1683 HA LEU A 106 32.560 14.327 42.130 1.00 0.00 H ATOM 1684 HB2 LEU A 106 29.638 13.733 41.685 1.00 0.00 H ATOM 1685 HB3 LEU A 106 30.832 13.891 40.375 1.00 0.00 H ATOM 1686 HG LEU A 106 30.749 11.766 42.518 1.00 0.00 H ATOM 1687 HD21 LEU A 106 32.716 12.147 40.257 1.00 0.00 H ATOM 1688 HD22 LEU A 106 33.050 12.320 41.998 1.00 0.00 H ATOM 1689 HD23 LEU A 106 32.616 10.728 41.329 1.00 0.00 H ATOM 1690 HD11 LEU A 106 29.062 11.502 40.718 1.00 0.00 H ATOM 1691 HD12 LEU A 106 30.336 11.681 39.487 1.00 0.00 H ATOM 1692 HD13 LEU A 106 30.332 10.263 40.564 1.00 0.00 H ATOM 1693 H LEU A 106 30.429 13.764 43.990 1.00 0.00 H ATOM 1694 N ASN A 107 30.069 16.510 42.242 1.00 18.06 N ATOM 1695 CA ASN A 107 29.681 17.877 41.906 1.00 18.27 C ATOM 1696 C ASN A 107 30.730 18.865 42.402 1.00 17.20 C ATOM 1697 O ASN A 107 31.136 19.774 41.676 1.00 18.28 O ATOM 1698 CB ASN A 107 28.312 18.208 42.512 1.00 19.96 C ATOM 1699 CG ASN A 107 27.632 19.379 41.821 1.00 19.83 C ATOM 1700 OD1 ASN A 107 27.793 19.584 40.614 1.00 22.08 O ATOM 1701 ND2 ASN A 107 26.858 20.145 42.580 1.00 20.63 N ATOM 1702 HA ASN A 107 29.611 17.959 40.821 1.00 0.00 H ATOM 1703 HB2 ASN A 107 27.671 17.331 42.425 1.00 0.00 H ATOM 1704 HB3 ASN A 107 28.447 18.455 43.565 1.00 0.00 H ATOM 1705 HD22 ASN A 107 26.752 19.935 43.593 1.00 0.00 H ATOM 1706 HD21 ASN A 107 26.358 20.955 42.162 1.00 0.00 H ATOM 1707 H ASN A 107 29.418 15.921 42.800 1.00 0.00 H ATOM 1708 N GLN A 108 31.179 18.685 43.635 1.00 17.74 N ATOM 1709 CA GLN A 108 32.211 19.571 44.183 1.00 18.05 C ATOM 1710 C GLN A 108 33.512 19.485 43.375 1.00 19.49 C ATOM 1711 O GLN A 108 34.211 20.489 43.181 1.00 17.46 O ATOM 1712 CB GLN A 108 32.495 19.255 45.650 1.00 19.65 C ATOM 1713 CG GLN A 108 33.356 20.314 46.309 1.00 20.56 C ATOM 1714 CD GLN A 108 32.721 21.696 46.208 1.00 24.65 C ATOM 1715 OE1 GLN A 108 31.578 21.892 46.616 1.00 22.22 O ATOM 1716 NE2 GLN A 108 33.451 22.649 45.645 1.00 22.50 N ATOM 1717 HA GLN A 108 31.824 20.587 44.113 1.00 0.00 H ATOM 1718 HB2 GLN A 108 31.548 19.190 46.185 1.00 0.00 H ATOM 1719 HB3 GLN A 108 33.011 18.297 45.709 1.00 0.00 H ATOM 1720 HG2 GLN A 108 33.486 20.060 47.361 1.00 0.00 H ATOM 1721 HG3 GLN A 108 34.329 20.335 45.818 1.00 0.00 H ATOM 1722 HE22 GLN A 108 34.414 22.439 45.314 1.00 0.00 H ATOM 1723 HE21 GLN A 108 33.060 23.607 45.535 1.00 0.00 H ATOM 1724 H GLN A 108 30.798 17.912 44.217 1.00 0.00 H ATOM 1725 N ALA A 109 33.845 18.285 42.912 1.00 17.84 N ATOM 1726 CA ALA A 109 35.042 18.130 42.099 1.00 18.25 C ATOM 1727 C ALA A 109 34.883 18.852 40.770 1.00 18.38 C ATOM 1728 O ALA A 109 35.849 19.422 40.263 1.00 17.41 O ATOM 1729 CB ALA A 109 35.378 16.667 41.884 1.00 18.52 C ATOM 1730 HA ALA A 109 35.874 18.582 42.638 1.00 0.00 H ATOM 1731 HB1 ALA A 109 35.550 16.189 42.849 1.00 0.00 H ATOM 1732 HB2 ALA A 109 34.548 16.176 41.376 1.00 0.00 H ATOM 1733 HB3 ALA A 109 36.277 16.588 41.273 1.00 0.00 H ATOM 1734 H ALA A 109 33.252 17.459 43.130 1.00 0.00 H ATOM 1735 N LEU A 110 33.672 18.815 40.201 1.00 16.41 N ATOM 1736 CA LEU A 110 33.388 19.531 38.961 1.00 17.04 C ATOM 1737 C LEU A 110 33.507 21.036 39.176 1.00 17.93 C ATOM 1738 O LEU A 110 34.080 21.757 38.357 1.00 17.44 O ATOM 1739 CB LEU A 110 31.984 19.195 38.446 1.00 18.39 C ATOM 1740 CG LEU A 110 31.770 17.769 37.933 1.00 18.61 C ATOM 1741 CD1 LEU A 110 30.311 17.524 37.599 1.00 22.76 C ATOM 1742 CD2 LEU A 110 32.631 17.561 36.704 1.00 21.92 C ATOM 1743 HA LEU A 110 34.120 19.216 38.217 1.00 0.00 H ATOM 1744 HB2 LEU A 110 31.282 19.363 39.263 1.00 0.00 H ATOM 1745 HB3 LEU A 110 31.758 19.879 37.628 1.00 0.00 H ATOM 1746 HG LEU A 110 32.054 17.061 38.712 1.00 0.00 H ATOM 1747 HD21 LEU A 110 32.344 18.279 35.935 1.00 0.00 H ATOM 1748 HD22 LEU A 110 33.679 17.707 36.967 1.00 0.00 H ATOM 1749 HD23 LEU A 110 32.487 16.548 36.329 1.00 0.00 H ATOM 1750 HD11 LEU A 110 29.706 17.669 38.494 1.00 0.00 H ATOM 1751 HD12 LEU A 110 29.994 18.225 36.827 1.00 0.00 H ATOM 1752 HD13 LEU A 110 30.189 16.503 37.237 1.00 0.00 H ATOM 1753 H LEU A 110 32.915 18.263 40.653 1.00 0.00 H ATOM 1754 N LEU A 111 32.945 21.506 40.281 1.00 16.01 N ATOM 1755 CA LEU A 111 33.028 22.921 40.634 1.00 18.10 C ATOM 1756 C LEU A 111 34.472 23.382 40.848 1.00 18.60 C ATOM 1757 O LEU A 111 34.848 24.480 40.431 1.00 20.07 O ATOM 1758 CB LEU A 111 32.185 23.207 41.878 1.00 18.62 C ATOM 1759 CG LEU A 111 30.676 23.003 41.716 1.00 17.14 C ATOM 1760 CD1 LEU A 111 29.958 23.250 43.048 1.00 22.26 C ATOM 1761 CD2 LEU A 111 30.133 23.929 40.624 1.00 21.71 C ATOM 1762 HA LEU A 111 32.631 23.489 39.793 1.00 0.00 H ATOM 1763 HB2 LEU A 111 32.529 22.548 42.675 1.00 0.00 H ATOM 1764 HB3 LEU A 111 32.354 24.244 42.167 1.00 0.00 H ATOM 1765 HG LEU A 111 30.490 21.972 41.416 1.00 0.00 H ATOM 1766 HD21 LEU A 111 30.327 24.966 40.899 1.00 0.00 H ATOM 1767 HD22 LEU A 111 30.628 23.704 39.679 1.00 0.00 H ATOM 1768 HD23 LEU A 111 29.059 23.774 40.519 1.00 0.00 H ATOM 1769 HD11 LEU A 111 30.333 22.552 43.796 1.00 0.00 H ATOM 1770 HD12 LEU A 111 30.146 24.272 43.376 1.00 0.00 H ATOM 1771 HD13 LEU A 111 28.887 23.101 42.915 1.00 0.00 H ATOM 1772 H LEU A 111 32.434 20.854 40.910 1.00 0.00 H ATOM 1773 N ASP A 112 35.279 22.561 41.515 1.00 18.69 N ATOM 1774 CA ASP A 112 36.684 22.909 41.736 1.00 20.81 C ATOM 1775 C ASP A 112 37.418 22.976 40.402 1.00 20.92 C ATOM 1776 O ASP A 112 38.257 23.856 40.163 1.00 20.12 O ATOM 1777 CB ASP A 112 37.372 21.875 42.633 1.00 21.74 C ATOM 1778 CG ASP A 112 36.798 21.832 44.034 1.00 23.07 C ATOM 1779 OD1 ASP A 112 36.067 22.761 44.426 1.00 24.08 O ATOM 1780 OD2 ASP A 112 37.094 20.862 44.754 1.00 24.97 O ATOM 1781 HA ASP A 112 36.716 23.881 42.229 1.00 0.00 H ATOM 1782 HB2 ASP A 112 37.257 20.890 42.180 1.00 0.00 H ATOM 1783 HB3 ASP A 112 38.432 22.122 42.699 1.00 0.00 H ATOM 1784 H ASP A 112 34.908 21.662 41.883 1.00 0.00 H ATOM 1785 N LEU A 113 37.109 22.029 39.527 1.00 20.09 N ATOM 1786 CA LEU A 113 37.755 21.991 38.226 1.00 20.85 C ATOM 1787 C LEU A 113 37.354 23.209 37.422 1.00 20.34 C ATOM 1788 O LEU A 113 38.172 23.804 36.724 1.00 22.55 O ATOM 1789 CB LEU A 113 37.384 20.721 37.469 1.00 19.50 C ATOM 1790 CG LEU A 113 37.972 20.682 36.061 1.00 20.16 C ATOM 1791 CD1 LEU A 113 39.485 20.840 36.119 1.00 20.33 C ATOM 1792 CD2 LEU A 113 37.579 19.386 35.375 1.00 20.57 C ATOM 1793 HA LEU A 113 38.835 21.994 38.376 1.00 0.00 H ATOM 1794 HB2 LEU A 113 37.756 19.861 38.026 1.00 0.00 H ATOM 1795 HB3 LEU A 113 36.298 20.663 37.396 1.00 0.00 H ATOM 1796 HG LEU A 113 37.571 21.512 35.478 1.00 0.00 H ATOM 1797 HD21 LEU A 113 37.961 18.542 35.949 1.00 0.00 H ATOM 1798 HD22 LEU A 113 36.492 19.324 35.314 1.00 0.00 H ATOM 1799 HD23 LEU A 113 38.002 19.365 34.371 1.00 0.00 H ATOM 1800 HD11 LEU A 113 39.732 21.795 36.583 1.00 0.00 H ATOM 1801 HD12 LEU A 113 39.912 20.028 36.707 1.00 0.00 H ATOM 1802 HD13 LEU A 113 39.891 20.810 35.108 1.00 0.00 H ATOM 1803 H LEU A 113 36.400 21.309 39.773 1.00 0.00 H ATOM 1804 N HIS A 114 36.085 23.588 37.520 1.00 20.12 N ATOM 1805 CA HIS A 114 35.640 24.784 36.837 1.00 24.46 C ATOM 1806 C HIS A 114 36.367 26.024 37.362 1.00 21.01 C ATOM 1807 O HIS A 114 36.774 26.886 36.587 1.00 21.20 O ATOM 1808 CB HIS A 114 34.135 24.989 36.964 1.00 23.14 C ATOM 1809 CG HIS A 114 33.689 26.284 36.375 1.00 27.54 C ATOM 1810 ND1 HIS A 114 33.598 27.446 37.114 1.00 26.89 N ATOM 1811 CD2 HIS A 114 33.390 26.619 35.099 1.00 28.04 C ATOM 1812 CE1 HIS A 114 33.231 28.435 36.318 1.00 28.31 C ATOM 1813 NE2 HIS A 114 33.097 27.958 35.092 1.00 27.89 N ATOM 1814 HA HIS A 114 35.880 24.645 35.783 1.00 0.00 H ATOM 1815 HB2 HIS A 114 33.625 24.175 36.449 1.00 0.00 H ATOM 1816 HB3 HIS A 114 33.867 24.973 38.020 1.00 0.00 H ATOM 1817 HD2 HIS A 114 33.383 25.950 34.238 1.00 0.00 H ATOM 1818 HE1 HIS A 114 33.067 29.469 36.621 1.00 0.00 H ATOM 1819 H HIS A 114 35.414 23.028 38.085 1.00 0.00 H ATOM 1820 N ALA A 115 36.535 26.103 38.679 1.00 18.76 N ATOM 1821 CA ALA A 115 37.227 27.233 39.288 1.00 22.31 C ATOM 1822 C ALA A 115 38.676 27.290 38.810 1.00 22.38 C ATOM 1823 O ALA A 115 39.204 28.366 38.522 1.00 22.87 O ATOM 1824 CB ALA A 115 37.160 27.153 40.816 1.00 22.86 C ATOM 1825 HA ALA A 115 36.727 28.150 38.978 1.00 0.00 H ATOM 1826 HB1 ALA A 115 36.117 27.166 41.134 1.00 0.00 H ATOM 1827 HB2 ALA A 115 37.632 26.229 41.151 1.00 0.00 H ATOM 1828 HB3 ALA A 115 37.683 28.007 41.247 1.00 0.00 H ATOM 1829 H ALA A 115 36.166 25.344 39.286 1.00 0.00 H ATOM 1830 N LEU A 116 39.313 26.127 38.727 1.00 20.31 N ATOM 1831 CA LEU A 116 40.674 26.031 38.209 1.00 23.84 C ATOM 1832 C LEU A 116 40.734 26.535 36.764 1.00 22.47 C ATOM 1833 O LEU A 116 41.622 27.317 36.398 1.00 25.59 O ATOM 1834 CB LEU A 116 41.177 24.583 38.290 1.00 19.69 C ATOM 1835 CG LEU A 116 42.558 24.277 37.703 1.00 23.09 C ATOM 1836 CD1 LEU A 116 43.648 25.117 38.370 1.00 25.44 C ATOM 1837 CD2 LEU A 116 42.879 22.791 37.831 1.00 20.74 C ATOM 1838 HA LEU A 116 41.321 26.658 38.822 1.00 0.00 H ATOM 1839 HB2 LEU A 116 41.201 24.305 39.344 1.00 0.00 H ATOM 1840 HB3 LEU A 116 40.454 23.957 37.767 1.00 0.00 H ATOM 1841 HG LEU A 116 42.533 24.540 36.646 1.00 0.00 H ATOM 1842 HD21 LEU A 116 42.872 22.508 38.884 1.00 0.00 H ATOM 1843 HD22 LEU A 116 42.129 22.211 37.293 1.00 0.00 H ATOM 1844 HD23 LEU A 116 43.864 22.596 37.408 1.00 0.00 H ATOM 1845 HD11 LEU A 116 43.434 26.175 38.218 1.00 0.00 H ATOM 1846 HD12 LEU A 116 43.670 24.900 39.438 1.00 0.00 H ATOM 1847 HD13 LEU A 116 44.614 24.873 37.928 1.00 0.00 H ATOM 1848 H LEU A 116 38.829 25.261 39.040 1.00 0.00 H ATOM 1849 N GLY A 117 39.790 26.081 35.943 1.00 22.44 N ATOM 1850 CA GLY A 117 39.726 26.493 34.548 1.00 21.52 C ATOM 1851 C GLY A 117 39.552 27.993 34.416 1.00 24.54 C ATOM 1852 O GLY A 117 40.201 28.642 33.588 1.00 24.60 O ATOM 1853 HA3 GLY A 117 38.882 25.995 34.070 1.00 0.00 H ATOM 1854 HA2 GLY A 117 40.649 26.199 34.049 1.00 0.00 H ATOM 1855 H GLY A 117 39.080 25.415 36.307 1.00 0.00 H ATOM 1856 N SER A 118 38.673 28.555 35.240 1.00 24.14 N ATOM 1857 CA SER A 118 38.479 29.993 35.236 1.00 23.90 C ATOM 1858 C SER A 118 39.777 30.712 35.636 1.00 24.70 C ATOM 1859 O SER A 118 40.153 31.710 35.023 1.00 24.81 O ATOM 1860 CB SER A 118 37.311 30.379 36.145 1.00 27.68 C ATOM 1861 OG SER A 118 37.087 31.774 36.114 1.00 31.86 O ATOM 1862 HA SER A 118 38.226 30.312 34.225 1.00 0.00 H ATOM 1863 HB2 SER A 118 37.539 30.077 37.167 1.00 0.00 H ATOM 1864 HB3 SER A 118 36.411 29.865 35.807 1.00 0.00 H ATOM 1865 HG SER A 118 36.328 31.998 36.709 1.00 0.00 H ATOM 1866 H SER A 118 38.121 27.961 35.891 1.00 0.00 H ATOM 1867 N ALA A 119 40.477 30.193 36.641 1.00 23.36 N ATOM 1868 CA ALA A 119 41.731 30.814 37.069 1.00 26.32 C ATOM 1869 C ALA A 119 42.797 30.711 35.982 1.00 26.22 C ATOM 1870 O ALA A 119 43.670 31.580 35.866 1.00 27.07 O ATOM 1871 CB ALA A 119 42.227 30.202 38.366 1.00 25.78 C ATOM 1872 HA ALA A 119 41.532 31.871 37.246 1.00 0.00 H ATOM 1873 HB1 ALA A 119 41.479 30.350 39.145 1.00 0.00 H ATOM 1874 HB2 ALA A 119 42.397 29.135 38.221 1.00 0.00 H ATOM 1875 HB3 ALA A 119 43.160 30.683 38.660 1.00 0.00 H ATOM 1876 H ALA A 119 40.131 29.340 37.126 1.00 0.00 H ATOM 1877 N GLN A 120 42.715 29.652 35.183 1.00 25.90 N ATOM 1878 CA GLN A 120 43.671 29.421 34.101 1.00 24.18 C ATOM 1879 C GLN A 120 43.184 30.036 32.790 1.00 25.97 C ATOM 1880 O GLN A 120 43.824 29.886 31.747 1.00 26.32 O ATOM 1881 CB GLN A 120 43.920 27.923 33.923 1.00 24.92 C ATOM 1882 CG GLN A 120 44.627 27.263 35.108 1.00 24.77 C ATOM 1883 CD GLN A 120 46.091 27.676 35.208 1.00 30.42 C ATOM 1884 OE1 GLN A 120 46.713 28.040 34.206 1.00 31.07 O ATOM 1885 NE2 GLN A 120 46.645 27.620 36.415 1.00 25.55 N ATOM 1886 HA GLN A 120 44.608 29.906 34.373 1.00 0.00 H ATOM 1887 HB2 GLN A 120 42.958 27.430 33.780 1.00 0.00 H ATOM 1888 HB3 GLN A 120 44.535 27.781 33.034 1.00 0.00 H ATOM 1889 HG2 GLN A 120 44.117 27.552 36.027 1.00 0.00 H ATOM 1890 HG3 GLN A 120 44.575 26.181 34.990 1.00 0.00 H ATOM 1891 HE22 GLN A 120 46.082 27.307 37.232 1.00 0.00 H ATOM 1892 HE21 GLN A 120 47.641 27.889 36.543 1.00 0.00 H ATOM 1893 H GLN A 120 41.947 28.967 35.332 1.00 0.00 H ATOM 1894 N ALA A 121 42.057 30.737 32.861 1.00 24.83 N ATOM 1895 CA ALA A 121 41.415 31.338 31.690 1.00 23.06 C ATOM 1896 C ALA A 121 41.300 30.343 30.542 1.00 22.30 C ATOM 1897 O ALA A 121 41.778 30.591 29.436 1.00 23.15 O ATOM 1898 CB ALA A 121 42.145 32.615 31.247 1.00 28.03 C ATOM 1899 HA ALA A 121 40.403 31.618 31.983 1.00 0.00 H ATOM 1900 HB1 ALA A 121 42.132 33.340 32.061 1.00 0.00 H ATOM 1901 HB2 ALA A 121 43.176 32.372 30.991 1.00 0.00 H ATOM 1902 HB3 ALA A 121 41.643 33.035 30.376 1.00 0.00 H ATOM 1903 H ALA A 121 41.610 30.865 33.791 1.00 0.00 H ATOM 1904 N ASP A 122 40.650 29.219 30.822 1.00 21.36 N ATOM 1905 CA ASP A 122 40.468 28.145 29.852 1.00 22.25 C ATOM 1906 C ASP A 122 38.985 28.046 29.491 1.00 21.17 C ATOM 1907 O ASP A 122 38.255 27.260 30.080 1.00 21.51 O ATOM 1908 CB ASP A 122 40.957 26.830 30.476 1.00 22.25 C ATOM 1909 CG ASP A 122 41.075 25.701 29.466 1.00 20.07 C ATOM 1910 OD1 ASP A 122 40.403 25.760 28.412 1.00 21.04 O ATOM 1911 OD2 ASP A 122 41.844 24.752 29.736 1.00 21.66 O ATOM 1912 HA ASP A 122 41.039 28.346 28.946 1.00 0.00 H ATOM 1913 HB2 ASP A 122 41.936 27.000 30.923 1.00 0.00 H ATOM 1914 HB3 ASP A 122 40.252 26.530 31.252 1.00 0.00 H ATOM 1915 H ASP A 122 40.253 29.099 31.776 1.00 0.00 H ATOM 1916 N PRO A 123 38.520 28.864 28.531 1.00 23.69 N ATOM 1917 CA PRO A 123 37.077 28.881 28.253 1.00 22.36 C ATOM 1918 C PRO A 123 36.579 27.595 27.586 1.00 23.12 C ATOM 1919 O PRO A 123 35.401 27.273 27.700 1.00 21.95 O ATOM 1920 CB PRO A 123 36.914 30.067 27.300 1.00 24.92 C ATOM 1921 CG PRO A 123 38.246 30.216 26.651 1.00 25.48 C ATOM 1922 CD PRO A 123 39.260 29.830 27.698 1.00 24.46 C ATOM 1923 HA PRO A 123 36.495 28.961 29.171 1.00 0.00 H ATOM 1924 HD3 PRO A 123 40.136 29.367 27.244 1.00 0.00 H ATOM 1925 HD2 PRO A 123 39.570 30.696 28.283 1.00 0.00 H ATOM 1926 HG3 PRO A 123 38.401 31.247 26.335 1.00 0.00 H ATOM 1927 HG2 PRO A 123 38.323 29.557 25.787 1.00 0.00 H ATOM 1928 HB2 PRO A 123 36.145 29.860 26.556 1.00 0.00 H ATOM 1929 HB3 PRO A 123 36.651 30.970 27.851 1.00 0.00 H ATOM 1930 N HIS A 124 37.443 26.870 26.884 1.00 21.41 N ATOM 1931 CA HIS A 124 36.962 25.627 26.295 1.00 22.00 C ATOM 1932 C HIS A 124 36.597 24.630 27.392 1.00 21.49 C ATOM 1933 O HIS A 124 35.577 23.955 27.311 1.00 21.05 O ATOM 1934 CB HIS A 124 37.961 25.007 25.321 1.00 20.52 C ATOM 1935 CG HIS A 124 37.489 23.706 24.744 1.00 23.73 C ATOM 1936 ND1 HIS A 124 37.595 22.507 25.421 1.00 24.87 N ATOM 1937 CD2 HIS A 124 36.882 23.418 23.567 1.00 24.46 C ATOM 1938 CE1 HIS A 124 37.092 21.536 24.679 1.00 24.09 C ATOM 1939 NE2 HIS A 124 36.651 22.062 23.549 1.00 25.52 N ATOM 1940 HA HIS A 124 36.072 25.873 25.716 1.00 0.00 H ATOM 1941 HB2 HIS A 124 38.130 25.708 24.504 1.00 0.00 H ATOM 1942 HB3 HIS A 124 38.899 24.833 25.849 1.00 0.00 H ATOM 1943 HD2 HIS A 124 36.625 24.128 22.781 1.00 0.00 H ATOM 1944 HE1 HIS A 124 37.048 20.482 24.952 1.00 0.00 H ATOM 1945 H HIS A 124 38.428 27.179 26.759 1.00 0.00 H ATOM 1946 N LEU A 125 37.427 24.549 28.427 1.00 20.95 N ATOM 1947 CA LEU A 125 37.145 23.645 29.542 1.00 22.55 C ATOM 1948 C LEU A 125 35.839 24.040 30.231 1.00 23.52 C ATOM 1949 O LEU A 125 35.014 23.191 30.555 1.00 22.40 O ATOM 1950 CB LEU A 125 38.297 23.644 30.553 1.00 21.15 C ATOM 1951 CG LEU A 125 38.075 22.786 31.802 1.00 21.20 C ATOM 1952 CD1 LEU A 125 38.182 21.302 31.465 1.00 21.04 C ATOM 1953 CD2 LEU A 125 39.067 23.157 32.876 1.00 21.55 C ATOM 1954 HA LEU A 125 37.041 22.637 29.141 1.00 0.00 H ATOM 1955 HB2 LEU A 125 39.189 23.276 30.046 1.00 0.00 H ATOM 1956 HB3 LEU A 125 38.462 24.672 30.876 1.00 0.00 H ATOM 1957 HG LEU A 125 37.069 22.978 32.176 1.00 0.00 H ATOM 1958 HD21 LEU A 125 40.079 22.993 32.506 1.00 0.00 H ATOM 1959 HD22 LEU A 125 38.941 24.207 33.138 1.00 0.00 H ATOM 1960 HD23 LEU A 125 38.896 22.538 33.757 1.00 0.00 H ATOM 1961 HD11 LEU A 125 37.427 21.044 30.722 1.00 0.00 H ATOM 1962 HD12 LEU A 125 39.174 21.092 31.065 1.00 0.00 H ATOM 1963 HD13 LEU A 125 38.021 20.713 32.368 1.00 0.00 H ATOM 1964 H LEU A 125 38.286 25.135 28.444 1.00 0.00 H ATOM 1965 N CYS A 126 35.651 25.338 30.443 1.00 21.97 N ATOM 1966 CA CYS A 126 34.436 25.817 31.078 1.00 23.92 C ATOM 1967 C CYS A 126 33.190 25.380 30.310 1.00 26.72 C ATOM 1968 O CYS A 126 32.244 24.862 30.895 1.00 23.81 O ATOM 1969 CB CYS A 126 34.448 27.337 31.196 1.00 28.17 C ATOM 1970 SG CYS A 126 32.873 27.931 31.797 1.00 33.70 S ATOM 1971 HA CYS A 126 34.403 25.377 32.075 1.00 0.00 H ATOM 1972 HB2 CYS A 126 34.645 27.772 30.216 1.00 0.00 H ATOM 1973 HB3 CYS A 126 35.233 27.637 31.890 1.00 0.00 H ATOM 1974 HG CYS A 126 32.622 27.386 33.040 1.00 0.00 H ATOM 1975 H CYS A 126 36.382 26.018 30.151 1.00 0.00 H ATOM 1976 N ASP A 127 33.193 25.609 29.001 1.00 25.33 N ATOM 1977 CA ASP A 127 32.095 25.187 28.141 1.00 26.84 C ATOM 1978 C ASP A 127 31.864 23.685 28.223 1.00 28.48 C ATOM 1979 O ASP A 127 30.725 23.215 28.271 1.00 27.97 O ATOM 1980 CB ASP A 127 32.404 25.536 26.693 1.00 27.78 C ATOM 1981 CG ASP A 127 31.323 25.063 25.748 1.00 32.36 C ATOM 1982 OD1 ASP A 127 31.661 24.367 24.771 1.00 38.11 O ATOM 1983 OD2 ASP A 127 30.142 25.390 25.986 1.00 35.53 O ATOM 1984 HA ASP A 127 31.200 25.707 28.483 1.00 0.00 H ATOM 1985 HB2 ASP A 127 32.499 26.618 26.605 1.00 0.00 H ATOM 1986 HB3 ASP A 127 33.347 25.066 26.412 1.00 0.00 H ATOM 1987 H ASP A 127 34.004 26.104 28.578 1.00 0.00 H ATOM 1988 N PHE A 128 32.961 22.936 28.210 1.00 25.15 N ATOM 1989 CA PHE A 128 32.905 21.483 28.299 1.00 23.59 C ATOM 1990 C PHE A 128 32.194 21.037 29.578 1.00 27.65 C ATOM 1991 O PHE A 128 31.301 20.180 29.540 1.00 26.63 O ATOM 1992 CB PHE A 128 34.320 20.886 28.222 1.00 23.61 C ATOM 1993 CG PHE A 128 34.368 19.406 28.498 1.00 24.37 C ATOM 1994 CD1 PHE A 128 34.045 18.494 27.510 1.00 26.09 C ATOM 1995 CD2 PHE A 128 34.734 18.932 29.749 1.00 24.33 C ATOM 1996 CE1 PHE A 128 34.070 17.132 27.765 1.00 24.56 C ATOM 1997 CE2 PHE A 128 34.775 17.574 30.005 1.00 25.36 C ATOM 1998 CZ PHE A 128 34.436 16.673 29.004 1.00 22.70 C ATOM 1999 HA PHE A 128 32.328 21.112 27.452 1.00 0.00 H ATOM 2000 HB2 PHE A 128 34.715 21.063 27.221 1.00 0.00 H ATOM 2001 HB3 PHE A 128 34.948 21.394 28.954 1.00 0.00 H ATOM 2002 HD2 PHE A 128 34.992 19.638 30.539 1.00 0.00 H ATOM 2003 HE2 PHE A 128 35.072 17.212 30.989 1.00 0.00 H ATOM 2004 HZ PHE A 128 34.461 15.602 29.203 1.00 0.00 H ATOM 2005 HE1 PHE A 128 33.799 16.426 26.980 1.00 0.00 H ATOM 2006 HD1 PHE A 128 33.767 18.851 26.518 1.00 0.00 H ATOM 2007 H PHE A 128 33.888 23.401 28.134 1.00 0.00 H ATOM 2008 N LEU A 129 32.583 21.614 30.712 1.00 24.25 N ATOM 2009 CA LEU A 129 31.964 21.235 31.978 1.00 25.57 C ATOM 2010 C LEU A 129 30.487 21.638 32.029 1.00 27.61 C ATOM 2011 O LEU A 129 29.647 20.896 32.529 1.00 24.97 O ATOM 2012 CB LEU A 129 32.739 21.815 33.165 1.00 24.72 C ATOM 2013 CG LEU A 129 34.160 21.253 33.315 1.00 24.60 C ATOM 2014 CD1 LEU A 129 34.913 21.950 34.452 1.00 23.66 C ATOM 2015 CD2 LEU A 129 34.130 19.748 33.537 1.00 23.48 C ATOM 2016 HA LEU A 129 32.005 20.148 32.049 1.00 0.00 H ATOM 2017 HB2 LEU A 129 32.809 22.895 33.035 1.00 0.00 H ATOM 2018 HB3 LEU A 129 32.185 21.595 34.077 1.00 0.00 H ATOM 2019 HG LEU A 129 34.693 21.451 32.385 1.00 0.00 H ATOM 2020 HD21 LEU A 129 33.568 19.527 34.445 1.00 0.00 H ATOM 2021 HD22 LEU A 129 33.651 19.266 32.685 1.00 0.00 H ATOM 2022 HD23 LEU A 129 35.150 19.377 33.640 1.00 0.00 H ATOM 2023 HD11 LEU A 129 34.981 23.017 34.241 1.00 0.00 H ATOM 2024 HD12 LEU A 129 34.377 21.797 35.389 1.00 0.00 H ATOM 2025 HD13 LEU A 129 35.916 21.530 34.533 1.00 0.00 H ATOM 2026 H LEU A 129 33.330 22.337 30.696 1.00 0.00 H ATOM 2027 N GLU A 130 30.165 22.814 31.507 1.00 28.10 N ATOM 2028 CA GLU A 130 28.776 23.269 31.528 1.00 31.38 C ATOM 2029 C GLU A 130 27.880 22.429 30.641 1.00 32.35 C ATOM 2030 O GLU A 130 26.776 22.055 31.032 1.00 38.78 O ATOM 2031 CB GLU A 130 28.695 24.716 31.087 1.00 32.14 C ATOM 2032 CG GLU A 130 29.448 25.631 31.985 1.00 28.10 C ATOM 2033 CD GLU A 130 29.453 27.020 31.439 1.00 35.67 C ATOM 2034 OE1 GLU A 130 29.478 27.148 30.199 1.00 37.85 O ATOM 2035 OE2 GLU A 130 29.415 27.964 32.242 1.00 35.20 O ATOM 2036 HA GLU A 130 28.424 23.166 32.555 1.00 0.00 H ATOM 2037 HB2 GLU A 130 29.106 24.798 30.081 1.00 0.00 H ATOM 2038 HB3 GLU A 130 27.648 25.020 31.077 1.00 0.00 H ATOM 2039 HG2 GLU A 130 28.978 25.634 32.968 1.00 0.00 H ATOM 2040 HG3 GLU A 130 30.475 25.278 32.076 1.00 0.00 H ATOM 2041 H GLU A 130 30.901 23.413 31.082 1.00 0.00 H ATOM 2042 N SER A 131 28.365 22.134 29.444 1.00 32.28 N ATOM 2043 CA SER A 131 27.598 21.379 28.467 1.00 36.83 C ATOM 2044 C SER A 131 27.313 19.937 28.896 1.00 37.17 C ATOM 2045 O SER A 131 26.220 19.416 28.649 1.00 39.41 O ATOM 2046 CB SER A 131 28.323 21.382 27.116 1.00 37.01 C ATOM 2047 OG SER A 131 28.555 22.710 26.667 1.00 40.56 O ATOM 2048 HA SER A 131 26.632 21.877 28.383 1.00 0.00 H ATOM 2049 HB2 SER A 131 27.711 20.859 26.381 1.00 0.00 H ATOM 2050 HB3 SER A 131 29.279 20.869 27.223 1.00 0.00 H ATOM 2051 HG SER A 131 29.114 23.188 27.330 1.00 0.00 H ATOM 2052 H SER A 131 29.324 22.452 29.196 1.00 0.00 H ATOM 2053 N HIS A 132 28.284 19.287 29.532 1.00 31.34 N ATOM 2054 CA HIS A 132 28.184 17.837 29.732 1.00 34.06 C ATOM 2055 C HIS A 132 28.074 17.337 31.166 1.00 31.18 C ATOM 2056 O HIS A 132 27.761 16.161 31.383 1.00 32.55 O ATOM 2057 CB HIS A 132 29.351 17.133 29.048 1.00 35.32 C ATOM 2058 CG HIS A 132 29.510 17.514 27.615 1.00 39.88 C ATOM 2059 ND1 HIS A 132 28.449 17.542 26.734 1.00 43.76 N ATOM 2060 CD2 HIS A 132 30.597 17.905 26.911 1.00 38.76 C ATOM 2061 CE1 HIS A 132 28.878 17.925 25.547 1.00 44.49 C ATOM 2062 NE2 HIS A 132 30.177 18.153 25.629 1.00 45.53 N ATOM 2063 HA HIS A 132 27.223 17.587 29.282 1.00 0.00 H ATOM 2064 HB2 HIS A 132 30.269 17.388 29.578 1.00 0.00 H ATOM 2065 HB3 HIS A 132 29.188 16.057 29.104 1.00 0.00 H ATOM 2066 HD2 HIS A 132 31.614 18.004 27.291 1.00 0.00 H ATOM 2067 HE1 HIS A 132 28.266 18.035 24.652 1.00 0.00 H ATOM 2068 H HIS A 132 29.113 19.806 29.887 1.00 0.00 H ATOM 2069 N PHE A 133 28.325 18.205 32.143 1.00 26.95 N ATOM 2070 CA PHE A 133 28.396 17.739 33.524 1.00 23.84 C ATOM 2071 C PHE A 133 27.561 18.531 34.516 1.00 26.92 C ATOM 2072 O PHE A 133 26.812 17.947 35.297 1.00 24.73 O ATOM 2073 CB PHE A 133 29.852 17.702 33.999 1.00 24.91 C ATOM 2074 CG PHE A 133 30.678 16.654 33.313 1.00 26.72 C ATOM 2075 CD1 PHE A 133 30.812 15.395 33.865 1.00 27.47 C ATOM 2076 CD2 PHE A 133 31.304 16.922 32.110 1.00 25.74 C ATOM 2077 CE1 PHE A 133 31.564 14.417 33.230 1.00 25.01 C ATOM 2078 CE2 PHE A 133 32.052 15.950 31.472 1.00 27.13 C ATOM 2079 CZ PHE A 133 32.179 14.697 32.033 1.00 24.76 C ATOM 2080 HA PHE A 133 27.964 16.738 33.504 1.00 0.00 H ATOM 2081 HB2 PHE A 133 30.302 18.676 33.809 1.00 0.00 H ATOM 2082 HB3 PHE A 133 29.861 17.502 35.070 1.00 0.00 H ATOM 2083 HD2 PHE A 133 31.207 17.910 31.660 1.00 0.00 H ATOM 2084 HE2 PHE A 133 32.542 16.174 30.524 1.00 0.00 H ATOM 2085 HZ PHE A 133 32.766 13.930 31.528 1.00 0.00 H ATOM 2086 HE1 PHE A 133 31.667 13.429 33.679 1.00 0.00 H ATOM 2087 HD1 PHE A 133 30.321 15.167 34.811 1.00 0.00 H ATOM 2088 H PHE A 133 28.470 19.211 31.923 1.00 0.00 H ATOM 2089 N LEU A 134 27.698 19.854 34.501 1.00 25.05 N ATOM 2090 CA LEU A 134 27.171 20.664 35.602 1.00 27.20 C ATOM 2091 C LEU A 134 25.667 20.495 35.785 1.00 21.80 C ATOM 2092 O LEU A 134 25.192 20.272 36.900 1.00 22.72 O ATOM 2093 CB LEU A 134 27.551 22.151 35.455 1.00 23.59 C ATOM 2094 CG LEU A 134 29.045 22.481 35.583 1.00 26.26 C ATOM 2095 CD1 LEU A 134 29.260 23.990 35.602 1.00 26.52 C ATOM 2096 CD2 LEU A 134 29.658 21.844 36.843 1.00 23.27 C ATOM 2097 HA LEU A 134 27.645 20.289 36.509 1.00 0.00 H ATOM 2098 HB2 LEU A 134 27.219 22.485 34.472 1.00 0.00 H ATOM 2099 HB3 LEU A 134 27.019 22.709 36.226 1.00 0.00 H ATOM 2100 HG LEU A 134 29.550 22.061 34.713 1.00 0.00 H ATOM 2101 HD21 LEU A 134 29.144 22.222 37.727 1.00 0.00 H ATOM 2102 HD22 LEU A 134 29.547 20.761 36.792 1.00 0.00 H ATOM 2103 HD23 LEU A 134 30.716 22.099 36.900 1.00 0.00 H ATOM 2104 HD11 LEU A 134 28.880 24.422 34.676 1.00 0.00 H ATOM 2105 HD12 LEU A 134 28.728 24.421 36.450 1.00 0.00 H ATOM 2106 HD13 LEU A 134 30.325 24.203 35.693 1.00 0.00 H ATOM 2107 H LEU A 134 28.181 20.315 33.704 1.00 0.00 H ATOM 2108 N ASP A 135 24.911 20.585 34.699 1.00 25.26 N ATOM 2109 CA ASP A 135 23.464 20.457 34.831 1.00 28.00 C ATOM 2110 C ASP A 135 23.046 19.007 35.058 1.00 27.83 C ATOM 2111 O ASP A 135 22.061 18.746 35.750 1.00 27.40 O ATOM 2112 CB ASP A 135 22.726 21.053 33.635 1.00 30.46 C ATOM 2113 CG ASP A 135 21.233 21.195 33.890 1.00 33.50 C ATOM 2114 OD1 ASP A 135 20.838 21.407 35.062 1.00 30.42 O ATOM 2115 OD2 ASP A 135 20.452 21.090 32.919 1.00 38.41 O ATOM 2116 HA ASP A 135 23.179 21.031 35.713 1.00 0.00 H ATOM 2117 HB2 ASP A 135 23.141 22.038 33.422 1.00 0.00 H ATOM 2118 HB3 ASP A 135 22.874 20.404 32.772 1.00 0.00 H ATOM 2119 H ASP A 135 25.344 20.745 33.767 1.00 0.00 H ATOM 2120 N GLU A 136 23.800 18.070 34.484 1.00 27.47 N ATOM 2121 CA GLU A 136 23.561 16.648 34.711 1.00 29.01 C ATOM 2122 C GLU A 136 23.594 16.341 36.212 1.00 25.89 C ATOM 2123 O GLU A 136 22.686 15.700 36.744 1.00 24.18 O ATOM 2124 CB GLU A 136 24.602 15.796 33.965 1.00 32.75 C ATOM 2125 CG GLU A 136 24.714 14.354 34.452 1.00 36.15 C ATOM 2126 CD GLU A 136 25.717 13.519 33.646 1.00 40.88 C ATOM 2127 OE1 GLU A 136 25.382 13.102 32.512 1.00 42.16 O ATOM 2128 OE2 GLU A 136 26.839 13.279 34.152 1.00 39.79 O ATOM 2129 HA GLU A 136 22.574 16.396 34.323 1.00 0.00 H ATOM 2130 HB2 GLU A 136 24.332 15.778 32.909 1.00 0.00 H ATOM 2131 HB3 GLU A 136 25.576 16.271 34.082 1.00 0.00 H ATOM 2132 HG2 GLU A 136 25.031 14.364 35.495 1.00 0.00 H ATOM 2133 HG3 GLU A 136 23.733 13.885 34.376 1.00 0.00 H ATOM 2134 H GLU A 136 24.579 18.359 33.858 1.00 0.00 H ATOM 2135 N GLU A 137 24.639 16.813 36.886 1.00 23.93 N ATOM 2136 CA GLU A 137 24.784 16.611 38.322 1.00 22.63 C ATOM 2137 C GLU A 137 23.648 17.260 39.083 1.00 19.55 C ATOM 2138 O GLU A 137 23.036 16.632 39.945 1.00 18.45 O ATOM 2139 CB GLU A 137 26.101 17.194 38.834 1.00 23.43 C ATOM 2140 CG GLU A 137 27.270 16.255 38.792 1.00 24.94 C ATOM 2141 CD GLU A 137 26.944 14.869 39.313 1.00 24.49 C ATOM 2142 OE1 GLU A 137 27.124 13.917 38.531 1.00 27.58 O ATOM 2143 OE2 GLU A 137 26.518 14.730 40.485 1.00 23.08 O ATOM 2144 HA GLU A 137 24.771 15.534 38.490 1.00 0.00 H ATOM 2145 HB2 GLU A 137 26.345 18.065 38.225 1.00 0.00 H ATOM 2146 HB3 GLU A 137 25.954 17.505 39.868 1.00 0.00 H ATOM 2147 HG2 GLU A 137 27.606 16.167 37.759 1.00 0.00 H ATOM 2148 HG3 GLU A 137 28.072 16.674 39.399 1.00 0.00 H ATOM 2149 H GLU A 137 25.374 17.341 36.374 1.00 0.00 H ATOM 2150 N VAL A 138 23.376 18.527 38.786 1.00 18.46 N ATOM 2151 CA VAL A 138 22.291 19.219 39.493 1.00 19.01 C ATOM 2152 C VAL A 138 20.962 18.447 39.373 1.00 18.59 C ATOM 2153 O VAL A 138 20.250 18.249 40.368 1.00 18.67 O ATOM 2154 CB VAL A 138 22.142 20.688 39.023 1.00 20.89 C ATOM 2155 CG1 VAL A 138 20.736 21.217 39.314 1.00 18.99 C ATOM 2156 CG2 VAL A 138 23.207 21.563 39.692 1.00 20.28 C ATOM 2157 HA VAL A 138 22.559 19.248 40.549 1.00 0.00 H ATOM 2158 HB VAL A 138 22.290 20.724 37.944 1.00 0.00 H ATOM 2159 HG11 VAL A 138 20.003 20.605 38.788 1.00 0.00 H ATOM 2160 HG12 VAL A 138 20.547 21.172 40.387 1.00 0.00 H ATOM 2161 HG13 VAL A 138 20.660 22.250 38.974 1.00 0.00 H ATOM 2162 HG21 VAL A 138 23.085 21.518 40.774 1.00 0.00 H ATOM 2163 HG22 VAL A 138 24.198 21.198 39.421 1.00 0.00 H ATOM 2164 HG23 VAL A 138 23.093 22.593 39.355 1.00 0.00 H ATOM 2165 H VAL A 138 23.928 19.024 38.058 1.00 0.00 H ATOM 2166 N LYS A 139 20.635 18.008 38.160 1.00 19.09 N ATOM 2167 CA LYS A 139 19.423 17.214 37.935 1.00 20.01 C ATOM 2168 C LYS A 139 19.423 15.907 38.731 1.00 19.87 C ATOM 2169 O LYS A 139 18.438 15.561 39.391 1.00 17.39 O ATOM 2170 CB LYS A 139 19.239 16.920 36.444 1.00 25.24 C ATOM 2171 CG LYS A 139 18.943 18.157 35.608 1.00 29.54 C ATOM 2172 CD LYS A 139 18.222 17.796 34.311 1.00 33.86 C ATOM 2173 CE LYS A 139 19.080 16.944 33.378 1.00 37.25 C ATOM 2174 NZ LYS A 139 20.124 17.733 32.656 1.00 41.76 N ATOM 2175 HA LYS A 139 18.585 17.813 38.291 1.00 0.00 H ATOM 2176 HB2 LYS A 139 20.153 16.461 36.068 1.00 0.00 H ATOM 2177 HB3 LYS A 139 18.410 16.221 36.331 1.00 0.00 H ATOM 2178 HG2 LYS A 139 18.314 18.834 36.187 1.00 0.00 H ATOM 2179 HG3 LYS A 139 19.882 18.654 35.365 1.00 0.00 H ATOM 2180 HD2 LYS A 139 17.317 17.241 34.558 1.00 0.00 H ATOM 2181 HD3 LYS A 139 17.952 18.717 33.794 1.00 0.00 H ATOM 2182 HE2 LYS A 139 18.429 16.474 32.641 1.00 0.00 H ATOM 2183 HE3 LYS A 139 19.575 16.173 33.969 1.00 0.00 H ATOM 2184 HZ1 LYS A 139 19.665 18.467 32.080 1.00 0.00 H ATOM 2185 HZ2 LYS A 139 20.759 18.180 33.348 1.00 0.00 H ATOM 2186 HZ3 LYS A 139 20.672 17.099 32.040 1.00 0.00 H ATOM 2187 H LYS A 139 21.253 18.233 37.354 1.00 0.00 H ATOM 2188 N LEU A 140 20.530 15.177 38.671 1.00 19.81 N ATOM 2189 CA LEU A 140 20.617 13.918 39.395 1.00 19.20 C ATOM 2190 C LEU A 140 20.457 14.110 40.907 1.00 18.29 C ATOM 2191 O LEU A 140 19.742 13.355 41.560 1.00 18.20 O ATOM 2192 CB LEU A 140 21.927 13.209 39.084 1.00 19.79 C ATOM 2193 CG LEU A 140 22.079 11.825 39.731 1.00 18.69 C ATOM 2194 CD1 LEU A 140 20.922 10.911 39.375 1.00 19.98 C ATOM 2195 CD2 LEU A 140 23.405 11.212 39.335 1.00 19.92 C ATOM 2196 HA LEU A 140 19.789 13.295 39.057 1.00 0.00 H ATOM 2197 HB2 LEU A 140 21.999 13.088 38.003 1.00 0.00 H ATOM 2198 HB3 LEU A 140 22.745 13.839 39.433 1.00 0.00 H ATOM 2199 HG LEU A 140 22.062 11.950 40.814 1.00 0.00 H ATOM 2200 HD21 LEU A 140 23.447 11.108 38.251 1.00 0.00 H ATOM 2201 HD22 LEU A 140 24.217 11.857 39.671 1.00 0.00 H ATOM 2202 HD23 LEU A 140 23.503 10.231 39.799 1.00 0.00 H ATOM 2203 HD11 LEU A 140 19.990 11.354 39.725 1.00 0.00 H ATOM 2204 HD12 LEU A 140 20.881 10.783 38.293 1.00 0.00 H ATOM 2205 HD13 LEU A 140 21.066 9.942 39.852 1.00 0.00 H ATOM 2206 H LEU A 140 21.338 15.506 38.105 1.00 0.00 H ATOM 2207 N ILE A 141 21.131 15.112 41.459 1.00 16.80 N ATOM 2208 CA ILE A 141 21.048 15.381 42.889 1.00 17.66 C ATOM 2209 C ILE A 141 19.620 15.769 43.312 1.00 18.11 C ATOM 2210 O ILE A 141 19.150 15.352 44.372 1.00 16.62 O ATOM 2211 CB ILE A 141 22.096 16.428 43.324 1.00 17.29 C ATOM 2212 CG1 ILE A 141 23.510 15.858 43.129 1.00 15.61 C ATOM 2213 CG2 ILE A 141 21.907 16.821 44.783 1.00 19.00 C ATOM 2214 CD1 ILE A 141 24.640 16.871 43.343 1.00 18.30 C ATOM 2215 HA ILE A 141 21.286 14.457 43.415 1.00 0.00 H ATOM 2216 HB ILE A 141 21.964 17.317 42.707 1.00 0.00 H ATOM 2217 HG12 ILE A 141 23.648 15.040 43.836 1.00 0.00 H ATOM 2218 HG13 ILE A 141 23.585 15.474 42.112 1.00 0.00 H ATOM 2219 HD11 ILE A 141 24.529 17.692 42.635 1.00 0.00 H ATOM 2220 HD12 ILE A 141 24.592 17.258 44.361 1.00 0.00 H ATOM 2221 HD13 ILE A 141 25.601 16.381 43.185 1.00 0.00 H ATOM 2222 HG21 ILE A 141 20.912 17.246 44.918 1.00 0.00 H ATOM 2223 HG22 ILE A 141 22.014 15.938 45.413 1.00 0.00 H ATOM 2224 HG23 ILE A 141 22.660 17.559 45.060 1.00 0.00 H ATOM 2225 H ILE A 141 21.729 15.716 40.860 1.00 0.00 H ATOM 2226 N LYS A 142 18.933 16.536 42.469 1.00 15.73 N ATOM 2227 CA LYS A 142 17.532 16.887 42.709 1.00 18.62 C ATOM 2228 C LYS A 142 16.676 15.628 42.767 1.00 17.71 C ATOM 2229 O LYS A 142 15.841 15.477 43.654 1.00 17.52 O ATOM 2230 CB LYS A 142 16.999 17.813 41.608 1.00 18.23 C ATOM 2231 CG LYS A 142 15.499 18.145 41.704 1.00 17.84 C ATOM 2232 CD LYS A 142 15.143 18.818 43.027 1.00 18.77 C ATOM 2233 CE LYS A 142 13.755 19.459 42.962 1.00 17.01 C ATOM 2234 NZ LYS A 142 12.647 18.447 42.874 1.00 18.83 N ATOM 2235 HA LYS A 142 17.478 17.410 43.664 1.00 0.00 H ATOM 2236 HB2 LYS A 142 17.556 18.749 41.654 1.00 0.00 H ATOM 2237 HB3 LYS A 142 17.178 17.332 40.646 1.00 0.00 H ATOM 2238 HG2 LYS A 142 15.234 18.815 40.886 1.00 0.00 H ATOM 2239 HG3 LYS A 142 14.928 17.221 41.615 1.00 0.00 H ATOM 2240 HD2 LYS A 142 15.154 18.071 43.821 1.00 0.00 H ATOM 2241 HD3 LYS A 142 15.882 19.589 43.245 1.00 0.00 H ATOM 2242 HE2 LYS A 142 13.709 20.102 42.083 1.00 0.00 H ATOM 2243 HE3 LYS A 142 13.607 20.060 43.859 1.00 0.00 H ATOM 2244 HZ1 LYS A 142 12.772 17.872 42.016 1.00 0.00 H ATOM 2245 HZ2 LYS A 142 12.674 17.832 43.712 1.00 0.00 H ATOM 2246 HZ3 LYS A 142 11.732 18.939 42.833 1.00 0.00 H ATOM 2247 H LYS A 142 19.405 16.896 41.615 1.00 0.00 H ATOM 2248 N LYS A 143 16.886 14.731 41.811 1.00 16.66 N ATOM 2249 CA LYS A 143 16.136 13.480 41.770 1.00 19.05 C ATOM 2250 C LYS A 143 16.375 12.626 43.015 1.00 17.76 C ATOM 2251 O LYS A 143 15.435 12.086 43.590 1.00 17.39 O ATOM 2252 CB LYS A 143 16.496 12.679 40.514 1.00 19.76 C ATOM 2253 CG LYS A 143 15.778 11.340 40.431 1.00 22.04 C ATOM 2254 CD LYS A 143 16.084 10.639 39.114 1.00 32.02 C ATOM 2255 CE LYS A 143 15.274 11.234 37.963 1.00 34.12 C ATOM 2256 NZ LYS A 143 15.328 10.366 36.737 1.00 45.64 N ATOM 2257 HA LYS A 143 15.078 13.742 41.743 1.00 0.00 H ATOM 2258 HB2 LYS A 143 16.230 13.270 39.638 1.00 0.00 H ATOM 2259 HB3 LYS A 143 17.571 12.497 40.515 1.00 0.00 H ATOM 2260 HG2 LYS A 143 16.105 10.708 41.256 1.00 0.00 H ATOM 2261 HG3 LYS A 143 14.703 11.506 40.506 1.00 0.00 H ATOM 2262 HD2 LYS A 143 17.146 10.747 38.893 1.00 0.00 H ATOM 2263 HD3 LYS A 143 15.840 9.581 39.210 1.00 0.00 H ATOM 2264 HE2 LYS A 143 15.677 12.217 37.718 1.00 0.00 H ATOM 2265 HE3 LYS A 143 14.236 11.337 38.278 1.00 0.00 H ATOM 2266 HZ1 LYS A 143 16.316 10.268 36.426 1.00 0.00 H ATOM 2267 HZ2 LYS A 143 14.939 9.428 36.961 1.00 0.00 H ATOM 2268 HZ3 LYS A 143 14.767 10.804 35.979 1.00 0.00 H ATOM 2269 H LYS A 143 17.598 14.924 41.078 1.00 0.00 H ATOM 2270 N MET A 144 17.638 12.492 43.420 1.00 17.26 N ATOM 2271 CA MET A 144 17.968 11.740 44.626 1.00 16.12 C ATOM 2272 C MET A 144 17.356 12.372 45.862 1.00 17.94 C ATOM 2273 O MET A 144 16.935 11.674 46.789 1.00 16.21 O ATOM 2274 CB MET A 144 19.483 11.645 44.812 1.00 17.15 C ATOM 2275 CG MET A 144 20.147 10.731 43.804 1.00 17.82 C ATOM 2276 SD MET A 144 21.910 10.637 44.110 1.00 21.83 S ATOM 2277 CE MET A 144 22.337 9.299 42.993 1.00 20.28 C ATOM 2278 HA MET A 144 17.553 10.740 44.500 1.00 0.00 H ATOM 2279 HB2 MET A 144 19.909 12.643 44.710 1.00 0.00 H ATOM 2280 HB3 MET A 144 19.687 11.265 45.813 1.00 0.00 H ATOM 2281 HG2 MET A 144 19.977 11.120 42.800 1.00 0.00 H ATOM 2282 HG3 MET A 144 19.715 9.734 43.884 1.00 0.00 H ATOM 2283 HE1 MET A 144 21.786 8.402 43.276 1.00 0.00 H ATOM 2284 HE2 MET A 144 22.075 9.581 41.973 1.00 0.00 H ATOM 2285 HE3 MET A 144 23.408 9.104 43.054 1.00 0.00 H ATOM 2286 H MET A 144 18.401 12.931 42.867 1.00 0.00 H ATOM 2287 N GLY A 145 17.346 13.698 45.897 1.00 17.49 N ATOM 2288 CA GLY A 145 16.697 14.400 46.985 1.00 16.00 C ATOM 2289 C GLY A 145 15.218 14.049 47.024 1.00 17.10 C ATOM 2290 O GLY A 145 14.686 13.737 48.092 1.00 16.70 O ATOM 2291 HA3 GLY A 145 16.809 15.474 46.839 1.00 0.00 H ATOM 2292 HA2 GLY A 145 17.161 14.112 47.928 1.00 0.00 H ATOM 2293 H GLY A 145 17.808 14.238 45.137 1.00 0.00 H ATOM 2294 N ASP A 146 14.554 14.095 45.864 1.00 17.39 N ATOM 2295 CA ASP A 146 13.140 13.706 45.773 1.00 17.48 C ATOM 2296 C ASP A 146 12.916 12.277 46.291 1.00 18.20 C ATOM 2297 O ASP A 146 11.994 12.024 47.069 1.00 16.90 O ATOM 2298 CB ASP A 146 12.621 13.805 44.335 1.00 16.54 C ATOM 2299 CG ASP A 146 12.585 15.235 43.811 1.00 19.18 C ATOM 2300 OD1 ASP A 146 12.771 16.184 44.599 1.00 18.55 O ATOM 2301 OD2 ASP A 146 12.378 15.409 42.593 1.00 23.57 O ATOM 2302 HA ASP A 146 12.585 14.404 46.400 1.00 0.00 H ATOM 2303 HB2 ASP A 146 13.271 13.215 43.689 1.00 0.00 H ATOM 2304 HB3 ASP A 146 11.611 13.397 44.301 1.00 0.00 H ATOM 2305 H ASP A 146 15.050 14.413 45.007 1.00 0.00 H ATOM 2306 N HIS A 147 13.753 11.349 45.836 1.00 17.21 N ATOM 2307 CA HIS A 147 13.667 9.956 46.252 1.00 19.18 C ATOM 2308 C HIS A 147 13.825 9.835 47.757 1.00 17.39 C ATOM 2309 O HIS A 147 13.040 9.140 48.409 1.00 17.43 O ATOM 2310 CB HIS A 147 14.729 9.095 45.547 1.00 19.67 C ATOM 2311 CG HIS A 147 14.438 8.823 44.104 1.00 20.34 C ATOM 2312 ND1 HIS A 147 13.201 9.040 43.534 1.00 17.59 N ATOM 2313 CD2 HIS A 147 15.227 8.340 43.113 1.00 20.51 C ATOM 2314 CE1 HIS A 147 13.241 8.706 42.256 1.00 20.84 C ATOM 2315 NE2 HIS A 147 14.461 8.276 41.977 1.00 21.97 N ATOM 2316 HA HIS A 147 12.681 9.590 45.966 1.00 0.00 H ATOM 2317 HB2 HIS A 147 15.687 9.612 45.612 1.00 0.00 H ATOM 2318 HB3 HIS A 147 14.797 8.140 46.068 1.00 0.00 H ATOM 2319 HD2 HIS A 147 16.275 8.055 43.202 1.00 0.00 H ATOM 2320 HE1 HIS A 147 12.411 8.773 41.552 1.00 0.00 H ATOM 2321 H HIS A 147 14.493 11.627 45.161 1.00 0.00 H ATOM 2322 N LEU A 148 14.832 10.511 48.311 1.00 17.42 N ATOM 2323 CA LEU A 148 15.073 10.467 49.755 1.00 18.53 C ATOM 2324 C LEU A 148 13.863 10.934 50.538 1.00 20.64 C ATOM 2325 O LEU A 148 13.511 10.357 51.572 1.00 18.97 O ATOM 2326 CB LEU A 148 16.297 11.316 50.154 1.00 19.77 C ATOM 2327 CG LEU A 148 17.661 10.693 49.867 1.00 19.27 C ATOM 2328 CD1 LEU A 148 18.790 11.641 50.248 1.00 20.52 C ATOM 2329 CD2 LEU A 148 17.806 9.383 50.622 1.00 24.50 C ATOM 2330 HA LEU A 148 15.272 9.424 50.002 1.00 0.00 H ATOM 2331 HB2 LEU A 148 16.240 12.260 49.613 1.00 0.00 H ATOM 2332 HB3 LEU A 148 16.236 11.508 51.225 1.00 0.00 H ATOM 2333 HG LEU A 148 17.726 10.500 48.796 1.00 0.00 H ATOM 2334 HD21 LEU A 148 17.715 9.570 51.692 1.00 0.00 H ATOM 2335 HD22 LEU A 148 17.023 8.694 50.305 1.00 0.00 H ATOM 2336 HD23 LEU A 148 18.783 8.949 50.409 1.00 0.00 H ATOM 2337 HD11 LEU A 148 18.699 12.562 49.672 1.00 0.00 H ATOM 2338 HD12 LEU A 148 18.728 11.869 51.312 1.00 0.00 H ATOM 2339 HD13 LEU A 148 19.748 11.168 50.032 1.00 0.00 H ATOM 2340 H LEU A 148 15.458 11.080 47.706 1.00 0.00 H ATOM 2341 N THR A 149 13.233 12.003 50.058 1.00 17.28 N ATOM 2342 CA THR A 149 12.059 12.525 50.732 1.00 17.05 C ATOM 2343 C THR A 149 10.921 11.498 50.702 1.00 17.86 C ATOM 2344 O THR A 149 10.267 11.255 51.710 1.00 18.83 O ATOM 2345 CB THR A 149 11.629 13.864 50.113 1.00 18.16 C ATOM 2346 OG1 THR A 149 12.634 14.849 50.411 1.00 17.33 O ATOM 2347 CG2 THR A 149 10.282 14.317 50.665 1.00 18.94 C ATOM 2348 HA THR A 149 12.310 12.711 51.776 1.00 0.00 H ATOM 2349 HB THR A 149 11.524 13.741 49.035 1.00 0.00 H ATOM 2350 HG1 THR A 149 12.722 14.943 51.393 1.00 0.00 H ATOM 2351 HG23 THR A 149 9.526 13.566 50.436 1.00 0.00 H ATOM 2352 HG21 THR A 149 10.357 14.441 51.745 1.00 0.00 H ATOM 2353 HG22 THR A 149 10.004 15.266 50.207 1.00 0.00 H ATOM 2354 H THR A 149 13.584 12.467 49.196 1.00 0.00 H ATOM 2355 N ASN A 150 10.694 10.894 49.548 1.00 17.02 N ATOM 2356 CA ASN A 150 9.655 9.869 49.426 1.00 17.97 C ATOM 2357 C ASN A 150 9.953 8.592 50.209 1.00 20.38 C ATOM 2358 O ASN A 150 9.061 7.996 50.816 1.00 19.20 O ATOM 2359 CB ASN A 150 9.418 9.548 47.954 1.00 15.73 C ATOM 2360 CG ASN A 150 8.508 10.559 47.298 1.00 17.87 C ATOM 2361 OD1 ASN A 150 7.290 10.481 47.442 1.00 18.54 O ATOM 2362 ND2 ASN A 150 9.092 11.530 46.598 1.00 17.14 N ATOM 2363 HA ASN A 150 8.752 10.287 49.871 1.00 0.00 H ATOM 2364 HB2 ASN A 150 10.376 9.546 47.434 1.00 0.00 H ATOM 2365 HB3 ASN A 150 8.962 8.561 47.877 1.00 0.00 H ATOM 2366 HD22 ASN A 150 10.128 11.553 46.505 1.00 0.00 H ATOM 2367 HD21 ASN A 150 8.512 12.265 46.145 1.00 0.00 H ATOM 2368 H ASN A 150 11.261 11.150 48.715 1.00 0.00 H ATOM 2369 N ILE A 151 11.213 8.180 50.200 1.00 18.92 N ATOM 2370 CA ILE A 151 11.633 7.035 51.001 1.00 19.12 C ATOM 2371 C ILE A 151 11.359 7.281 52.488 1.00 21.43 C ATOM 2372 O ILE A 151 10.729 6.456 53.162 1.00 21.43 O ATOM 2373 CB ILE A 151 13.127 6.692 50.744 1.00 20.13 C ATOM 2374 CG1 ILE A 151 13.302 6.190 49.310 1.00 18.93 C ATOM 2375 CG2 ILE A 151 13.617 5.660 51.743 1.00 20.53 C ATOM 2376 CD1 ILE A 151 14.743 5.996 48.867 1.00 18.81 C ATOM 2377 HA ILE A 151 11.043 6.171 50.695 1.00 0.00 H ATOM 2378 HB ILE A 151 13.726 7.593 50.874 1.00 0.00 H ATOM 2379 HG12 ILE A 151 12.789 5.232 49.222 1.00 0.00 H ATOM 2380 HG13 ILE A 151 12.837 6.913 48.640 1.00 0.00 H ATOM 2381 HD11 ILE A 151 15.273 6.946 48.932 1.00 0.00 H ATOM 2382 HD12 ILE A 151 15.226 5.264 49.515 1.00 0.00 H ATOM 2383 HD13 ILE A 151 14.760 5.639 47.837 1.00 0.00 H ATOM 2384 HG21 ILE A 151 13.514 6.056 52.753 1.00 0.00 H ATOM 2385 HG22 ILE A 151 13.023 4.751 51.645 1.00 0.00 H ATOM 2386 HG23 ILE A 151 14.665 5.434 51.546 1.00 0.00 H ATOM 2387 H ILE A 151 11.912 8.680 49.614 1.00 0.00 H ATOM 2388 N GLN A 152 11.802 8.431 52.994 1.00 20.78 N ATOM 2389 CA GLN A 152 11.630 8.757 54.406 1.00 24.99 C ATOM 2390 C GLN A 152 10.157 8.886 54.755 1.00 26.63 C ATOM 2391 O GLN A 152 9.732 8.493 55.836 1.00 27.50 O ATOM 2392 CB GLN A 152 12.387 10.041 54.773 1.00 23.43 C ATOM 2393 CG GLN A 152 13.858 9.961 54.393 1.00 29.30 C ATOM 2394 CD GLN A 152 14.683 11.126 54.893 1.00 37.30 C ATOM 2395 OE1 GLN A 152 14.436 12.281 54.530 1.00 41.73 O ATOM 2396 NE2 GLN A 152 15.681 10.828 55.727 1.00 38.42 N ATOM 2397 HA GLN A 152 12.050 7.939 54.991 1.00 0.00 H ATOM 2398 HB2 GLN A 152 11.932 10.881 54.248 1.00 0.00 H ATOM 2399 HB3 GLN A 152 12.309 10.201 55.848 1.00 0.00 H ATOM 2400 HG2 GLN A 152 14.271 9.043 54.810 1.00 0.00 H ATOM 2401 HG3 GLN A 152 13.931 9.930 53.306 1.00 0.00 H ATOM 2402 HE22 GLN A 152 15.850 9.840 56.004 1.00 0.00 H ATOM 2403 HE21 GLN A 152 16.290 11.584 56.100 1.00 0.00 H ATOM 2404 H GLN A 152 12.281 9.111 52.369 1.00 0.00 H ATOM 2405 N ARG A 153 9.383 9.440 53.832 1.00 21.85 N ATOM 2406 CA ARG A 153 7.940 9.539 54.016 1.00 25.76 C ATOM 2407 C ARG A 153 7.327 8.149 54.215 1.00 27.64 C ATOM 2408 O ARG A 153 6.356 7.982 54.955 1.00 28.36 O ATOM 2409 CB ARG A 153 7.342 10.254 52.804 1.00 25.40 C ATOM 2410 CG ARG A 153 5.920 9.923 52.460 1.00 29.24 C ATOM 2411 CD ARG A 153 5.528 10.687 51.196 1.00 25.16 C ATOM 2412 NE ARG A 153 5.611 12.125 51.420 1.00 22.46 N ATOM 2413 CZ ARG A 153 6.172 13.008 50.592 1.00 21.22 C ATOM 2414 NH1 ARG A 153 6.719 12.629 49.441 1.00 17.61 N ATOM 2415 NH2 ARG A 153 6.168 14.297 50.918 1.00 20.30 N ATOM 2416 HA ARG A 153 7.714 10.116 54.913 1.00 0.00 H ATOM 2417 HB2 ARG A 153 7.395 11.326 52.993 1.00 0.00 H ATOM 2418 HB3 ARG A 153 7.957 10.008 51.938 1.00 0.00 H ATOM 2419 HG2 ARG A 153 5.825 8.851 52.285 1.00 0.00 H ATOM 2420 HG3 ARG A 153 5.267 10.215 53.282 1.00 0.00 H ATOM 2421 HD2 ARG A 153 4.506 10.425 50.921 1.00 0.00 H ATOM 2422 HD3 ARG A 153 6.203 10.411 50.386 1.00 0.00 H ATOM 2423 HE ARG A 153 5.198 12.494 52.300 1.00 0.00 H ATOM 2424 HH12 ARG A 153 7.150 13.336 48.812 1.00 0.00 H ATOM 2425 HH11 ARG A 153 6.716 11.625 49.169 1.00 0.00 H ATOM 2426 HH22 ARG A 153 6.602 14.996 50.281 1.00 0.00 H ATOM 2427 HH21 ARG A 153 5.731 14.607 51.810 1.00 0.00 H ATOM 2428 H ARG A 153 9.813 9.811 52.961 1.00 0.00 H ATOM 2429 N LEU A 154 7.925 7.150 53.574 1.00 27.11 N ATOM 2430 CA LEU A 154 7.395 5.792 53.587 1.00 24.51 C ATOM 2431 C LEU A 154 7.868 4.916 54.750 1.00 28.46 C ATOM 2432 O LEU A 154 7.330 3.832 54.956 1.00 32.03 O ATOM 2433 CB LEU A 154 7.702 5.098 52.261 1.00 26.81 C ATOM 2434 CG LEU A 154 6.796 5.431 51.075 1.00 22.64 C ATOM 2435 CD1 LEU A 154 7.460 5.061 49.751 1.00 20.44 C ATOM 2436 CD2 LEU A 154 5.459 4.720 51.227 1.00 24.28 C ATOM 2437 HA LEU A 154 6.321 5.909 53.731 1.00 0.00 H ATOM 2438 HB2 LEU A 154 8.722 5.362 51.980 1.00 0.00 H ATOM 2439 HB3 LEU A 154 7.640 4.023 52.430 1.00 0.00 H ATOM 2440 HG LEU A 154 6.623 6.507 51.065 1.00 0.00 H ATOM 2441 HD21 LEU A 154 5.624 3.643 51.263 1.00 0.00 H ATOM 2442 HD22 LEU A 154 4.978 5.046 52.149 1.00 0.00 H ATOM 2443 HD23 LEU A 154 4.821 4.963 50.378 1.00 0.00 H ATOM 2444 HD11 LEU A 154 8.391 5.618 49.645 1.00 0.00 H ATOM 2445 HD12 LEU A 154 7.671 3.992 49.738 1.00 0.00 H ATOM 2446 HD13 LEU A 154 6.790 5.310 48.928 1.00 0.00 H ATOM 2447 H LEU A 154 8.800 7.343 53.046 1.00 0.00 H ATOM 2448 N VAL A 155 8.861 5.363 55.509 1.00 30.17 N ATOM 2449 CA VAL A 155 9.380 4.537 56.602 1.00 34.56 C ATOM 2450 C VAL A 155 8.348 4.367 57.715 1.00 38.54 C ATOM 2451 O VAL A 155 7.862 5.348 58.282 1.00 43.68 O ATOM 2452 CB VAL A 155 10.699 5.086 57.209 1.00 36.40 C ATOM 2453 CG1 VAL A 155 11.831 5.049 56.184 1.00 30.83 C ATOM 2454 CG2 VAL A 155 10.504 6.491 57.761 1.00 39.36 C ATOM 2455 HA VAL A 155 9.597 3.568 56.153 1.00 0.00 H ATOM 2456 HB VAL A 155 10.980 4.439 58.040 1.00 0.00 H ATOM 2457 HG11 VAL A 155 11.995 4.020 55.863 1.00 0.00 H ATOM 2458 HG12 VAL A 155 11.560 5.661 55.324 1.00 0.00 H ATOM 2459 HG13 VAL A 155 12.742 5.439 56.637 1.00 0.00 H ATOM 2460 HG21 VAL A 155 10.186 7.155 56.957 1.00 0.00 H ATOM 2461 HG22 VAL A 155 9.742 6.471 58.540 1.00 0.00 H ATOM 2462 HG23 VAL A 155 11.444 6.849 58.180 1.00 0.00 H ATOM 2463 H VAL A 155 9.271 6.301 55.327 1.00 0.00 H TER 2464 VAL A 155 ATOM 2465 N GLN A 158 6.118 0.834 59.503 1.00 42.94 N ATOM 2466 CA GLN A 158 6.060 -0.213 58.489 1.00 40.38 C ATOM 2467 C GLN A 158 7.161 -0.010 57.452 1.00 35.14 C ATOM 2468 O GLN A 158 6.881 0.300 56.290 1.00 32.63 O ATOM 2469 CB GLN A 158 4.699 -0.200 57.792 1.00 43.33 C ATOM 2470 CG GLN A 158 3.519 0.124 58.705 1.00 47.65 C ATOM 2471 CD GLN A 158 3.215 -0.979 59.704 1.00 54.72 C ATOM 2472 OE1 GLN A 158 4.117 -1.525 60.346 1.00 55.24 O ATOM 2473 NE2 GLN A 158 1.934 -1.313 59.840 1.00 56.79 N ATOM 2474 HA GLN A 158 6.204 -1.175 58.982 1.00 0.00 H ATOM 2475 HB2 GLN A 158 4.730 0.547 56.999 1.00 0.00 H ATOM 2476 HB3 GLN A 158 4.531 -1.185 57.356 1.00 0.00 H ATOM 2477 HG2 GLN A 158 3.747 1.037 59.255 1.00 0.00 H ATOM 2478 HG3 GLN A 158 2.636 0.285 58.087 1.00 0.00 H ATOM 2479 HE22 GLN A 158 1.207 -0.826 59.278 1.00 0.00 H ATOM 2480 HE21 GLN A 158 1.660 -2.061 60.508 1.00 0.00 H ATOM 2481 HN3 GLN A 158 5.991 1.761 59.050 1.00 0.00 H ATOM 2482 HN2 GLN A 158 7.042 0.803 59.979 1.00 0.00 H ATOM 2483 HN1 GLN A 158 5.362 0.681 60.201 1.00 0.00 H ATOM 2484 N ALA A 159 8.409 -0.177 57.874 1.00 32.49 N ATOM 2485 CA ALA A 159 9.551 0.094 57.001 1.00 31.80 C ATOM 2486 C ALA A 159 9.671 -0.892 55.835 1.00 28.21 C ATOM 2487 O ALA A 159 9.994 -0.500 54.714 1.00 25.43 O ATOM 2488 CB ALA A 159 10.839 0.130 57.810 1.00 32.21 C ATOM 2489 HA ALA A 159 9.376 1.073 56.555 1.00 0.00 H ATOM 2490 HB1 ALA A 159 10.772 0.916 58.563 1.00 0.00 H ATOM 2491 HB2 ALA A 159 10.986 -0.833 58.300 1.00 0.00 H ATOM 2492 HB3 ALA A 159 11.679 0.333 57.145 1.00 0.00 H ATOM 2493 H ALA A 159 8.578 -0.507 58.846 1.00 0.00 H ATOM 2494 N GLY A 160 9.426 -2.172 56.097 1.00 28.71 N ATOM 2495 CA GLY A 160 9.466 -3.172 55.040 1.00 27.04 C ATOM 2496 C GLY A 160 8.440 -2.887 53.954 1.00 25.47 C ATOM 2497 O GLY A 160 8.734 -2.946 52.759 1.00 23.67 O ATOM 2498 HA3 GLY A 160 9.260 -4.151 55.472 1.00 0.00 H ATOM 2499 HA2 GLY A 160 10.461 -3.175 54.594 1.00 0.00 H ATOM 2500 H GLY A 160 9.203 -2.463 57.070 1.00 0.00 H ATOM 2501 N LEU A 161 7.217 -2.589 54.376 1.00 26.76 N ATOM 2502 CA LEU A 161 6.148 -2.226 53.451 1.00 25.11 C ATOM 2503 C LEU A 161 6.556 -1.007 52.618 1.00 23.99 C ATOM 2504 O LEU A 161 6.382 -0.981 51.401 1.00 21.86 O ATOM 2505 CB LEU A 161 4.869 -1.920 54.241 1.00 26.13 C ATOM 2506 CG LEU A 161 3.650 -1.378 53.489 1.00 26.62 C ATOM 2507 CD1 LEU A 161 3.137 -2.384 52.469 1.00 26.53 C ATOM 2508 CD2 LEU A 161 2.545 -1.008 54.472 1.00 30.09 C ATOM 2509 HA LEU A 161 5.963 -3.061 52.775 1.00 0.00 H ATOM 2510 HB2 LEU A 161 4.561 -2.847 54.725 1.00 0.00 H ATOM 2511 HB3 LEU A 161 5.130 -1.184 55.001 1.00 0.00 H ATOM 2512 HG LEU A 161 3.958 -0.483 52.949 1.00 0.00 H ATOM 2513 HD21 LEU A 161 2.252 -1.893 55.037 1.00 0.00 H ATOM 2514 HD22 LEU A 161 2.911 -0.243 55.157 1.00 0.00 H ATOM 2515 HD23 LEU A 161 1.685 -0.624 53.923 1.00 0.00 H ATOM 2516 HD11 LEU A 161 3.924 -2.600 51.746 1.00 0.00 H ATOM 2517 HD12 LEU A 161 2.850 -3.303 52.980 1.00 0.00 H ATOM 2518 HD13 LEU A 161 2.272 -1.968 51.953 1.00 0.00 H ATOM 2519 H LEU A 161 7.015 -2.615 55.396 1.00 0.00 H ATOM 2520 N GLY A 162 7.107 0.003 53.283 1.00 23.97 N ATOM 2521 CA GLY A 162 7.507 1.219 52.599 1.00 24.15 C ATOM 2522 C GLY A 162 8.591 0.987 51.562 1.00 22.77 C ATOM 2523 O GLY A 162 8.546 1.546 50.470 1.00 22.45 O ATOM 2524 HA3 GLY A 162 7.880 1.928 53.339 1.00 0.00 H ATOM 2525 HA2 GLY A 162 6.634 1.641 52.101 1.00 0.00 H ATOM 2526 H GLY A 162 7.254 -0.079 54.309 1.00 0.00 H ATOM 2527 N GLU A 163 9.570 0.153 51.897 1.00 21.33 N ATOM 2528 CA GLU A 163 10.654 -0.131 50.963 1.00 20.37 C ATOM 2529 C GLU A 163 10.151 -0.869 49.725 1.00 20.75 C ATOM 2530 O GLU A 163 10.578 -0.593 48.596 1.00 17.95 O ATOM 2531 CB GLU A 163 11.761 -0.933 51.653 1.00 22.63 C ATOM 2532 CG GLU A 163 13.046 -0.976 50.842 1.00 24.40 C ATOM 2533 CD GLU A 163 14.227 -1.421 51.667 1.00 23.90 C ATOM 2534 OE1 GLU A 163 14.007 -1.986 52.763 1.00 25.02 O ATOM 2535 OE2 GLU A 163 15.372 -1.215 51.215 1.00 23.21 O ATOM 2536 HA GLU A 163 11.065 0.824 50.634 1.00 0.00 H ATOM 2537 HB2 GLU A 163 11.973 -0.475 52.619 1.00 0.00 H ATOM 2538 HB3 GLU A 163 11.410 -1.954 51.805 1.00 0.00 H ATOM 2539 HG2 GLU A 163 12.915 -1.671 50.013 1.00 0.00 H ATOM 2540 HG3 GLU A 163 13.247 0.021 50.450 1.00 0.00 H ATOM 2541 H GLU A 163 9.563 -0.301 52.833 1.00 0.00 H ATOM 2542 N TYR A 164 9.232 -1.805 49.933 1.00 19.51 N ATOM 2543 CA TYR A 164 8.626 -2.535 48.821 1.00 18.27 C ATOM 2544 C TYR A 164 7.844 -1.593 47.911 1.00 17.51 C ATOM 2545 O TYR A 164 8.023 -1.591 46.701 1.00 18.02 O ATOM 2546 CB TYR A 164 7.709 -3.638 49.353 1.00 17.45 C ATOM 2547 CG TYR A 164 6.943 -4.394 48.280 1.00 20.45 C ATOM 2548 CD1 TYR A 164 7.585 -5.321 47.467 1.00 20.70 C ATOM 2549 CD2 TYR A 164 5.568 -4.205 48.103 1.00 18.65 C ATOM 2550 CE1 TYR A 164 6.895 -6.023 46.488 1.00 19.59 C ATOM 2551 CE2 TYR A 164 4.869 -4.906 47.122 1.00 16.51 C ATOM 2552 CZ TYR A 164 5.545 -5.814 46.320 1.00 19.38 C ATOM 2553 OH TYR A 164 4.887 -6.529 45.345 1.00 19.92 O ATOM 2554 HA TYR A 164 9.425 -2.989 48.235 1.00 0.00 H ATOM 2555 HB3 TYR A 164 6.987 -3.183 50.031 1.00 0.00 H ATOM 2556 HB2 TYR A 164 8.320 -4.353 49.903 1.00 0.00 H ATOM 2557 HD2 TYR A 164 5.036 -3.500 48.741 1.00 0.00 H ATOM 2558 HE2 TYR A 164 3.800 -4.742 46.986 1.00 0.00 H ATOM 2559 HE1 TYR A 164 7.421 -6.737 45.854 1.00 0.00 H ATOM 2560 HD1 TYR A 164 8.652 -5.500 47.601 1.00 0.00 H ATOM 2561 HH TYR A 164 5.530 -7.121 44.881 1.00 0.00 H ATOM 2562 H TYR A 164 8.938 -2.023 50.906 1.00 0.00 H ATOM 2563 N LEU A 165 6.970 -0.789 48.504 1.00 20.01 N ATOM 2564 CA LEU A 165 6.142 0.123 47.727 1.00 19.24 C ATOM 2565 C LEU A 165 6.962 1.137 46.939 1.00 18.44 C ATOM 2566 O LEU A 165 6.612 1.483 45.816 1.00 18.51 O ATOM 2567 CB LEU A 165 5.141 0.844 48.632 1.00 20.61 C ATOM 2568 CG LEU A 165 3.973 -0.039 49.083 1.00 20.54 C ATOM 2569 CD1 LEU A 165 3.105 0.677 50.116 1.00 23.77 C ATOM 2570 CD2 LEU A 165 3.146 -0.478 47.878 1.00 22.60 C ATOM 2571 HA LEU A 165 5.602 -0.486 47.002 1.00 0.00 H ATOM 2572 HB2 LEU A 165 5.669 1.196 49.518 1.00 0.00 H ATOM 2573 HB3 LEU A 165 4.737 1.698 48.088 1.00 0.00 H ATOM 2574 HG LEU A 165 4.382 -0.929 49.562 1.00 0.00 H ATOM 2575 HD21 LEU A 165 2.752 0.402 47.369 1.00 0.00 H ATOM 2576 HD22 LEU A 165 3.777 -1.044 47.193 1.00 0.00 H ATOM 2577 HD23 LEU A 165 2.320 -1.105 48.215 1.00 0.00 H ATOM 2578 HD11 LEU A 165 3.710 0.925 50.988 1.00 0.00 H ATOM 2579 HD12 LEU A 165 2.702 1.591 49.679 1.00 0.00 H ATOM 2580 HD13 LEU A 165 2.285 0.024 50.415 1.00 0.00 H ATOM 2581 H LEU A 165 6.875 -0.811 49.539 1.00 0.00 H ATOM 2582 N PHE A 166 8.039 1.641 47.529 1.00 17.37 N ATOM 2583 CA PHE A 166 8.835 2.627 46.801 1.00 20.20 C ATOM 2584 C PHE A 166 9.464 1.977 45.577 1.00 20.46 C ATOM 2585 O PHE A 166 9.465 2.544 44.474 1.00 17.37 O ATOM 2586 CB PHE A 166 9.906 3.266 47.692 1.00 19.09 C ATOM 2587 CG PHE A 166 10.743 4.294 46.980 1.00 20.20 C ATOM 2588 CD1 PHE A 166 10.260 5.574 46.764 1.00 20.78 C ATOM 2589 CD2 PHE A 166 12.015 3.975 46.515 1.00 21.02 C ATOM 2590 CE1 PHE A 166 11.042 6.533 46.092 1.00 18.33 C ATOM 2591 CE2 PHE A 166 12.787 4.913 45.855 1.00 22.61 C ATOM 2592 CZ PHE A 166 12.294 6.198 45.636 1.00 20.78 C ATOM 2593 HA PHE A 166 8.171 3.429 46.479 1.00 0.00 H ATOM 2594 HB2 PHE A 166 9.411 3.747 48.536 1.00 0.00 H ATOM 2595 HB3 PHE A 166 10.564 2.479 48.059 1.00 0.00 H ATOM 2596 HD2 PHE A 166 12.409 2.971 46.673 1.00 0.00 H ATOM 2597 HE2 PHE A 166 13.784 4.647 45.505 1.00 0.00 H ATOM 2598 HZ PHE A 166 12.899 6.934 45.106 1.00 0.00 H ATOM 2599 HE1 PHE A 166 10.655 7.540 45.934 1.00 0.00 H ATOM 2600 HD1 PHE A 166 9.264 5.842 47.118 1.00 0.00 H ATOM 2601 H PHE A 166 8.310 1.341 48.487 1.00 0.00 H ATOM 2602 N GLU A 167 9.996 0.773 45.769 1.00 17.79 N ATOM 2603 CA GLU A 167 10.643 0.074 44.670 1.00 18.49 C ATOM 2604 C GLU A 167 9.634 -0.266 43.574 1.00 20.49 C ATOM 2605 O GLU A 167 9.934 -0.144 42.377 1.00 18.17 O ATOM 2606 CB GLU A 167 11.361 -1.183 45.174 1.00 19.43 C ATOM 2607 CG GLU A 167 12.075 -1.968 44.080 1.00 18.54 C ATOM 2608 CD GLU A 167 11.200 -3.050 43.501 1.00 20.34 C ATOM 2609 OE1 GLU A 167 10.243 -3.480 44.197 1.00 22.77 O ATOM 2610 OE2 GLU A 167 11.471 -3.468 42.362 1.00 19.23 O ATOM 2611 HA GLU A 167 11.393 0.736 44.237 1.00 0.00 H ATOM 2612 HB2 GLU A 167 12.099 -0.882 45.918 1.00 0.00 H ATOM 2613 HB3 GLU A 167 10.623 -1.836 45.640 1.00 0.00 H ATOM 2614 HG2 GLU A 167 12.361 -1.282 43.283 1.00 0.00 H ATOM 2615 HG3 GLU A 167 12.970 -2.426 44.502 1.00 0.00 H ATOM 2616 H GLU A 167 9.949 0.330 46.709 1.00 0.00 H ATOM 2617 N ARG A 168 8.433 -0.674 43.985 1.00 19.65 N ATOM 2618 CA ARG A 168 7.378 -1.044 43.038 1.00 19.84 C ATOM 2619 C ARG A 168 6.784 0.149 42.284 1.00 20.98 C ATOM 2620 O ARG A 168 6.562 0.061 41.085 1.00 18.89 O ATOM 2621 CB ARG A 168 6.236 -1.784 43.746 1.00 18.99 C ATOM 2622 CG ARG A 168 6.563 -3.192 44.233 1.00 19.90 C ATOM 2623 CD ARG A 168 6.632 -4.185 43.083 1.00 20.93 C ATOM 2624 NE ARG A 168 8.003 -4.383 42.629 1.00 20.98 N ATOM 2625 CZ ARG A 168 8.368 -5.214 41.660 1.00 23.32 C ATOM 2626 NH1 ARG A 168 7.458 -5.935 41.020 1.00 21.92 N ATOM 2627 NH2 ARG A 168 9.652 -5.317 41.327 1.00 24.28 N ATOM 2628 HA ARG A 168 7.865 -1.693 42.311 1.00 0.00 H ATOM 2629 HB2 ARG A 168 5.937 -1.191 44.610 1.00 0.00 H ATOM 2630 HB3 ARG A 168 5.400 -1.856 43.050 1.00 0.00 H ATOM 2631 HG2 ARG A 168 7.526 -3.175 44.743 1.00 0.00 H ATOM 2632 HG3 ARG A 168 5.790 -3.513 44.931 1.00 0.00 H ATOM 2633 HD2 ARG A 168 6.035 -3.808 42.253 1.00 0.00 H ATOM 2634 HD3 ARG A 168 6.227 -5.141 43.415 1.00 0.00 H ATOM 2635 HE ARG A 168 8.750 -3.833 43.099 1.00 0.00 H ATOM 2636 HH12 ARG A 168 7.749 -6.585 40.262 1.00 0.00 H ATOM 2637 HH11 ARG A 168 6.454 -5.851 41.276 1.00 0.00 H ATOM 2638 HH22 ARG A 168 9.942 -5.967 40.569 1.00 0.00 H ATOM 2639 HH21 ARG A 168 10.366 -4.748 41.825 1.00 0.00 H ATOM 2640 H ARG A 168 8.240 -0.731 45.005 1.00 0.00 H ATOM 2641 N LEU A 169 6.537 1.256 42.986 1.00 19.67 N ATOM 2642 CA LEU A 169 5.716 2.341 42.434 1.00 21.38 C ATOM 2643 C LEU A 169 6.506 3.572 41.983 1.00 21.89 C ATOM 2644 O LEU A 169 5.987 4.409 41.251 1.00 20.12 O ATOM 2645 CB LEU A 169 4.622 2.745 43.436 1.00 19.97 C ATOM 2646 CG LEU A 169 3.629 1.637 43.822 1.00 20.59 C ATOM 2647 CD1 LEU A 169 2.624 2.128 44.848 1.00 22.06 C ATOM 2648 CD2 LEU A 169 2.915 1.083 42.590 1.00 19.97 C ATOM 2649 HA LEU A 169 5.266 1.935 41.528 1.00 0.00 H ATOM 2650 HB2 LEU A 169 5.112 3.088 44.347 1.00 0.00 H ATOM 2651 HB3 LEU A 169 4.054 3.567 42.999 1.00 0.00 H ATOM 2652 HG LEU A 169 4.203 0.828 44.275 1.00 0.00 H ATOM 2653 HD21 LEU A 169 2.367 1.886 42.097 1.00 0.00 H ATOM 2654 HD22 LEU A 169 3.651 0.668 41.901 1.00 0.00 H ATOM 2655 HD23 LEU A 169 2.220 0.301 42.896 1.00 0.00 H ATOM 2656 HD11 LEU A 169 3.151 2.450 45.746 1.00 0.00 H ATOM 2657 HD12 LEU A 169 2.064 2.967 44.434 1.00 0.00 H ATOM 2658 HD13 LEU A 169 1.937 1.319 45.098 1.00 0.00 H ATOM 2659 H LEU A 169 6.934 1.352 43.943 1.00 0.00 H ATOM 2660 N THR A 170 7.757 3.685 42.417 1.00 20.63 N ATOM 2661 CA THR A 170 8.608 4.780 41.959 1.00 19.51 C ATOM 2662 C THR A 170 9.745 4.286 41.067 1.00 21.63 C ATOM 2663 O THR A 170 9.955 4.825 39.987 1.00 19.91 O ATOM 2664 CB THR A 170 9.156 5.606 43.134 1.00 20.17 C ATOM 2665 OG1 THR A 170 8.066 6.265 43.787 1.00 19.12 O ATOM 2666 CG2 THR A 170 10.169 6.662 42.645 1.00 20.40 C ATOM 2667 HA THR A 170 7.976 5.433 41.357 1.00 0.00 H ATOM 2668 HB THR A 170 9.666 4.935 43.825 1.00 0.00 H ATOM 2669 HG1 THR A 170 8.412 6.799 44.545 1.00 0.00 H ATOM 2670 HG23 THR A 170 11.000 6.163 42.147 1.00 0.00 H ATOM 2671 HG21 THR A 170 9.678 7.338 41.945 1.00 0.00 H ATOM 2672 HG22 THR A 170 10.542 7.228 43.498 1.00 0.00 H ATOM 2673 H THR A 170 8.134 2.987 43.089 1.00 0.00 H ATOM 2674 N LEU A 171 10.471 3.255 41.501 1.00 18.95 N ATOM 2675 CA LEU A 171 11.649 2.829 40.740 1.00 22.96 C ATOM 2676 C LEU A 171 11.315 1.803 39.654 1.00 31.45 C ATOM 2677 O LEU A 171 10.283 1.127 39.695 1.00 32.01 O ATOM 2678 CB LEU A 171 12.758 2.307 41.667 1.00 23.00 C ATOM 2679 CG LEU A 171 13.293 3.292 42.710 1.00 22.92 C ATOM 2680 CD1 LEU A 171 14.393 2.651 43.542 1.00 22.95 C ATOM 2681 CD2 LEU A 171 13.796 4.578 42.053 1.00 22.04 C ATOM 2682 HA LEU A 171 12.020 3.718 40.230 1.00 0.00 H ATOM 2683 HB2 LEU A 171 12.365 1.441 42.199 1.00 0.00 H ATOM 2684 HB3 LEU A 171 13.596 1.998 41.041 1.00 0.00 H ATOM 2685 HG LEU A 171 12.468 3.555 43.372 1.00 0.00 H ATOM 2686 HD21 LEU A 171 14.600 4.338 41.357 1.00 0.00 H ATOM 2687 HD22 LEU A 171 12.977 5.054 41.514 1.00 0.00 H ATOM 2688 HD23 LEU A 171 14.169 5.255 42.821 1.00 0.00 H ATOM 2689 HD11 LEU A 171 13.995 1.776 44.055 1.00 0.00 H ATOM 2690 HD12 LEU A 171 15.212 2.350 42.889 1.00 0.00 H ATOM 2691 HD13 LEU A 171 14.757 3.370 44.276 1.00 0.00 H ATOM 2692 H LEU A 171 10.203 2.757 42.374 1.00 0.00 H TER 2693 LEU A 171 HETATM 2694 O HOH 11 49.111 28.101 24.511 1.00 28.54 O HETATM 2695 O HOH 12 30.131 -3.161 54.427 1.00 26.25 O HETATM 2696 O HOH 13 42.876 8.926 35.639 1.00 15.99 O HETATM 2697 O HOH 14 44.428 22.343 23.679 1.00 17.20 O HETATM 2698 O HOH 15 49.354 13.802 31.847 1.00 21.93 O HETATM 2699 O HOH 16 43.964 25.349 31.158 1.00 20.99 O HETATM 2700 O HOH 17 31.775 -2.817 47.415 1.00 15.88 O HETATM 2701 O HOH 18 42.876 24.937 22.455 1.00 17.72 O HETATM 2702 O HOH 19 45.976 14.082 21.791 1.00 16.65 O HETATM 2703 O HOH 20 34.151 8.780 43.529 1.00 20.36 O HETATM 2704 O HOH 21 29.943 -6.154 47.852 1.00 16.26 O HETATM 2705 O HOH 22 42.705 20.580 19.768 1.00 17.28 O HETATM 2706 O HOH 23 10.485 -6.221 45.060 1.00 18.93 O HETATM 2707 O HOH 24 49.596 -1.727 40.224 1.00 20.86 O HETATM 2708 O HOH 25 37.152 -6.655 42.505 1.00 16.22 O HETATM 2709 O HOH 26 49.010 24.895 26.435 1.00 22.06 O HETATM 2710 O HOH 27 27.066 -7.582 49.616 1.00 17.96 O HETATM 2711 O HOH 28 35.170 2.732 44.407 1.00 19.60 O HETATM 2712 O HOH 29 32.494 -5.414 48.116 1.00 17.79 O HETATM 2713 O HOH 30 26.740 21.511 39.038 1.00 22.00 O HETATM 2714 O HOH 31 12.966 0.902 48.074 1.00 21.34 O HETATM 2715 O HOH 32 12.418 -6.939 43.095 1.00 17.51 O HETATM 2716 O HOH 33 32.332 4.174 47.649 1.00 19.49 O HETATM 2717 O HOH 34 8.415 8.853 44.305 1.00 21.36 O HETATM 2718 O HOH 35 43.757 22.640 21.014 1.00 21.06 O HETATM 2719 O HOH 36 15.808 16.052 38.561 1.00 24.11 O HETATM 2720 O HOH 37 35.592 4.819 45.917 1.00 24.23 O HETATM 2721 O HOH 38 27.811 -5.778 45.763 1.00 18.81 O HETATM 2722 O HOH 39 46.020 20.351 39.243 1.00 24.59 O HETATM 2723 O HOH 40 44.801 27.681 30.317 1.00 22.89 O HETATM 2724 O HOH 41 19.367 5.592 37.449 1.00 20.71 O HETATM 2725 O HOH 42 38.438 18.884 40.644 1.00 22.07 O HETATM 2726 O HOH 43 43.474 5.614 47.554 1.00 26.05 O HETATM 2727 O HOH 44 39.900 12.593 21.659 1.00 21.40 O HETATM 2728 O HOH 45 24.257 5.801 54.054 1.00 27.35 O HETATM 2729 O HOH 46 17.411 -3.333 51.447 1.00 27.10 O HETATM 2730 O HOH 47 51.100 23.106 20.511 1.00 25.95 O HETATM 2731 O HOH 48 29.840 14.588 49.594 1.00 20.90 O HETATM 2732 O HOH 49 28.934 7.725 49.585 1.00 20.17 O HETATM 2733 O HOH 50 34.227 -2.319 50.884 1.00 23.88 O HETATM 2734 O HOH 51 39.844 24.873 42.109 1.00 26.37 O HETATM 2735 O HOH 52 10.731 10.244 44.108 1.00 21.17 O HETATM 2736 O HOH 53 50.162 9.058 28.977 1.00 25.91 O HETATM 2737 O HOH 54 36.104 4.020 48.377 1.00 26.56 O HETATM 2738 O HOH 55 48.053 4.318 41.266 1.00 21.92 O HETATM 2739 O HOH 56 38.619 30.568 40.081 1.00 27.39 O HETATM 2740 O HOH 57 33.215 26.759 40.263 1.00 24.44 O HETATM 2741 O HOH 58 33.369 6.286 44.917 1.00 22.82 O HETATM 2742 O HOH 59 17.203 2.645 57.037 1.00 27.54 O HETATM 2743 O HOH 60 47.010 1.906 45.442 1.00 23.46 O HETATM 2744 O HOH 61 44.794 5.886 43.023 1.00 23.76 O HETATM 2745 O HOH 62 26.457 -7.663 46.825 1.00 17.34 O HETATM 2746 O HOH 63 9.919 12.823 54.019 1.00 26.01 O HETATM 2747 O HOH 64 39.990 16.627 39.886 1.00 21.58 O HETATM 2748 O HOH 65 40.466 9.248 43.294 1.00 28.05 O HETATM 2749 O HOH 66 40.756 26.206 23.702 1.00 23.31 O HETATM 2750 O HOH 67 50.605 24.911 32.231 1.00 29.81 O HETATM 2751 O HOH 68 13.697 15.350 40.089 1.00 25.45 O HETATM 2752 O HOH 69 47.960 12.950 36.331 1.00 30.95 O HETATM 2753 O HOH 70 46.258 10.282 26.394 1.00 23.88 O HETATM 2754 O HOH 71 28.285 13.958 36.201 1.00 30.81 O HETATM 2755 O HOH 72 28.331 11.155 34.409 1.00 29.48 O HETATM 2756 O HOH 73 49.760 17.698 34.166 1.00 25.34 O HETATM 2757 O HOH 74 25.785 8.078 53.801 1.00 28.62 O HETATM 2758 O HOH 75 28.670 7.501 52.375 1.00 30.13 O HETATM 2759 O HOH 76 12.954 2.673 50.732 1.00 23.73 O HETATM 2760 O HOH 77 31.229 16.708 48.830 1.00 31.79 O HETATM 2761 O HOH 78 30.273 5.246 49.172 1.00 28.13 O HETATM 2762 O HOH 79 51.396 15.980 29.125 1.00 25.70 O HETATM 2763 O HOH 80 37.549 15.123 18.329 1.00 35.43 O HETATM 2764 O HOH 81 48.848 14.946 34.392 1.00 29.02 O HETATM 2765 O HOH 82 20.457 0.241 57.908 1.00 32.81 O HETATM 2766 O HOH 83 19.195 -15.925 51.597 1.00 25.44 O HETATM 2767 O HOH 84 14.577 1.909 52.716 1.00 22.21 O HETATM 2768 O HOH 85 45.512 31.196 29.895 1.00 29.15 O HETATM 2769 O HOH 86 35.006 16.161 45.710 1.00 26.08 O HETATM 2770 O HOH 87 36.557 13.947 46.463 1.00 37.87 O HETATM 2771 O HOH 88 17.347 -7.364 53.152 1.00 32.31 O HETATM 2772 O HOH 89 36.006 -4.806 53.069 1.00 32.58 O HETATM 2773 O HOH 90 35.822 -5.649 49.855 1.00 26.83 O HETATM 2774 O HOH 91 43.581 4.477 44.905 1.00 25.86 O HETATM 2775 O HOH 92 14.562 7.496 39.297 1.00 29.30 O HETATM 2776 O HOH 93 11.113 -7.963 40.694 1.00 36.60 O HETATM 2777 O HOH 94 50.919 17.479 25.814 1.00 29.65 O HETATM 2778 O HOH 95 21.233 13.868 35.501 1.00 26.13 O HETATM 2779 O HOH 96 25.331 18.513 32.019 1.00 34.63 O HETATM 2780 O HOH 97 33.984 10.465 45.773 1.00 28.96 O HETATM 2781 O HOH 98 16.743 -10.704 54.133 1.00 30.96 O HETATM 2782 O HOH 99 46.794 10.418 37.268 1.00 27.76 O HETATM 2783 O HOH 100 51.787 28.418 35.082 1.00 41.99 O HETATM 2784 O HOH 101 42.255 18.506 41.281 1.00 37.43 O HETATM 2785 O HOH 102 35.224 25.238 43.842 1.00 31.27 O HETATM 2786 O HOH 103 21.452 -14.744 52.466 1.00 30.32 O HETATM 2787 O HOH 104 23.293 11.518 52.616 1.00 24.67 O HETATM 2788 O HOH 105 31.135 9.055 48.796 1.00 26.05 O HETATM 2789 O HOH 106 38.276 11.158 47.285 1.00 40.76 O HETATM 2790 O HOH 107 10.601 3.615 51.775 1.00 29.28 O HETATM 2791 O HOH 108 36.110 18.469 24.153 1.00 33.64 O HETATM 2792 O HOH 109 51.773 17.783 32.427 1.00 31.83 O HETATM 2793 O HOH 110 41.523 27.210 41.365 1.00 33.77 O HETATM 2794 O HOH 111 48.718 18.403 40.151 1.00 38.59 O HETATM 2795 O HOH 112 14.795 1.850 38.465 1.00 27.79 O HETATM 2796 O HOH 113 30.929 9.058 27.043 1.00 29.44 O HETATM 2797 O HOH 114 5.225 2.218 55.231 1.00 35.66 O HETATM 2798 O HOH 115 29.774 4.966 52.672 1.00 27.78 O HETATM 2799 O HOH 116 40.534 20.908 40.397 1.00 29.23 O HETATM 2800 O HOH 117 32.443 25.654 45.144 1.00 34.77 O HETATM 2801 O HOH 118 25.538 11.072 36.182 1.00 28.82 O HETATM 2802 O HOH 119 38.646 18.437 43.364 1.00 29.21 O HETATM 2803 O HOH 120 10.919 13.622 41.218 1.00 29.53 O HETATM 2804 O HOH 121 14.525 2.517 57.266 1.00 35.44 O HETATM 2805 O HOH 122 42.655 32.566 27.470 1.00 27.08 O HETATM 2806 O HOH 123 53.130 14.196 29.266 1.00 34.61 O HETATM 2807 O HOH 124 38.281 16.054 44.245 1.00 34.90 O HETATM 2808 O HOH 125 34.001 22.954 25.078 1.00 28.27 O HETATM 2809 O HOH 126 13.279 1.898 55.015 1.00 35.37 O HETATM 2810 O HOH 127 34.324 14.615 25.291 1.00 32.41 O HETATM 2811 O HOH 128 3.841 4.174 39.787 1.00 30.12 O HETATM 2812 O HOH 129 41.135 5.525 43.673 1.00 19.32 O HETATM 2813 O HOH 130 40.608 27.343 26.231 1.00 20.71 O HETATM 2814 O HOH 131 17.327 -15.161 53.443 1.00 28.44 O HETATM 2815 O HOH 132 24.524 22.847 30.442 1.00 32.37 O HETATM 2816 O HOH 133 29.309 29.309 29.309 1.00 35.64 O HETATM 2817 O HOH 134 40.928 11.511 42.182 1.00 27.31 O HETATM 2818 O HOH 135 33.794 16.859 48.564 1.00 36.48 O HETATM 2819 O HOH 136 7.214 4.120 60.575 1.00 45.05 O HETATM 2820 O HOH 137 9.076 14.642 43.173 1.00 28.33 O HETATM 2821 O HOH 138 10.863 2.239 54.378 1.00 32.10 O HETATM 2822 O HOH 139 51.792 12.616 31.340 1.00 36.26 O HETATM 2823 O HOH 140 36.621 -7.860 51.282 1.00 33.90 O HETATM 2824 O HOH 141 13.620 15.290 52.839 1.00 26.89 O HETATM 2825 O HOH 142 45.315 27.998 39.465 1.00 37.71 O HETATM 2826 O HOH 143 36.803 20.519 47.310 1.00 36.28 O HETATM 2827 O HOH 144 36.119 30.705 40.974 1.00 35.05 O HETATM 2828 O HOH 145 10.289 0.528 36.940 1.00 38.24 O HETATM 2829 O HOH 146 47.858 30.071 27.774 1.00 36.05 O HETATM 2830 O HOH 147 11.923 14.491 54.593 1.00 34.94 O HETATM 2831 O HOH 148 27.369 15.258 51.818 1.00 40.88 O HETATM 2832 O HOH 149 13.142 -0.806 55.230 1.00 34.71 O HETATM 2833 O HOH 150 47.430 27.704 30.299 1.00 31.71 O HETATM 2834 O HOH 151 10.179 -1.778 39.733 1.00 32.09 O HETATM 2835 O HOH 152 42.844 10.582 27.193 1.00 26.65 O HETATM 2836 O HOH 153 47.465 14.110 39.956 1.00 36.48 O HETATM 2837 O HOH 154 14.545 4.699 38.222 1.00 34.63 O HETATM 2838 O HOH 155 16.643 9.186 57.920 1.00 40.68 O HETATM 2839 O HOH 156 21.115 2.965 59.004 1.00 38.66 O HETATM 2840 O HOH 157 9.357 12.215 56.558 1.00 40.64 O HETATM 2841 O HOH 158 22.749 5.554 56.421 1.00 38.09 O HETATM 2842 O HOH 159 34.741 -1.749 53.359 1.00 35.85 O HETATM 2843 O HOH 160 51.217 18.165 36.619 1.00 35.42 O HETATM 2844 O HOH 161 6.401 -3.636 56.851 1.00 35.80 O HETATM 2845 O HOH 162 40.758 13.717 43.794 1.00 33.82 O HETATM 2846 O HOH 163 24.662 1.984 53.407 1.00 30.73 O HETATM 2847 O HOH 164 20.051 -2.723 57.454 1.00 38.71 O HETATM 2848 O HOH 165 41.483 22.847 41.855 1.00 35.36 O HETATM 2849 O HOH 166 50.614 20.977 37.274 1.00 36.07 O HETATM 2850 O HOH 167 28.759 18.181 52.045 1.00 41.95 O HETATM 2851 O HOH 168 52.999 13.407 24.850 1.00 33.57 O HETATM 2852 O HOH 169 45.923 22.692 40.687 1.00 40.17 O HETATM 2853 O HOH 170 47.917 30.378 30.485 1.00 41.34 O HETATM 2854 O HOH 171 37.370 0.983 50.977 1.00 32.00 O HETATM 2855 O HOH 172 24.283 10.489 55.004 1.00 35.56 O HETATM 2856 O HOH 173 34.737 14.518 18.143 1.00 46.30 O HETATM 2857 O HOH 174 52.072 10.331 29.908 1.00 37.80 O HETATM 2858 O HOH 175 7.779 8.183 58.015 1.00 38.41 O HETATM 2859 O HOH 176 8.955 -3.616 58.483 1.00 40.97 O HETATM 2860 O HOH 177 26.991 26.997 27.000 1.00 34.72 O HETATM 2861 O HOH 178 38.879 21.463 27.809 1.00 23.43 O HETATM 2862 O HOH 179 34.626 6.068 48.014 1.00 32.05 O HETATM 2863 O HOH 180 31.029 3.800 26.060 1.00 29.00 O HETATM 2864 S SDS A 181 34.485 0.767 29.402 1.00 -0.07 S HETATM 2865 O1S SDS A 181 35.335 0.219 28.376 1.00 -0.46 O HETATM 2866 O2S SDS A 181 34.707 0.103 30.694 1.00 -0.27 O HETATM 2867 C1 SDS A 181 35.886 0.344 31.373 1.00 0.07 C HETATM 2868 C12 SDS A 181 35.744 -0.048 32.807 1.00 -0.03 C HETATM 2869 C11 SDS A 181 37.031 0.171 33.531 1.00 -0.05 C HETATM 2870 C10 SDS A 181 36.977 -0.481 34.874 1.00 -0.05 C HETATM 2871 C9 SDS A 181 36.276 0.410 35.847 1.00 -0.05 C HETATM 2872 C8 SDS A 181 35.559 -0.412 36.863 1.00 -0.05 C HETATM 2873 C7 SDS A 181 34.308 0.284 37.288 1.00 -0.05 C HETATM 2874 C6 SDS A 181 33.112 -0.548 36.961 1.00 -0.05 C HETATM 2875 C5 SDS A 181 32.465 -0.047 35.714 1.00 -0.05 C HETATM 2876 C4 SDS A 181 31.046 -0.508 35.647 1.00 -0.05 C HETATM 2877 C3 SDS A 181 30.306 0.325 34.652 1.00 -0.06 C HETATM 2878 C2 SDS A 181 28.942 -0.236 34.422 1.00 -0.07 C HETATM 2879 H3 SDS A 181 28.409 0.386 33.688 1.00 0.02 H HETATM 2880 H4 SDS A 181 28.384 -0.244 35.370 1.00 0.02 H HETATM 2881 H5 SDS A 181 29.028 -1.263 34.038 1.00 0.02 H HETATM 2882 H6 SDS A 181 30.216 1.353 35.034 1.00 0.03 H HETATM 2883 H7 SDS A 181 30.860 0.334 33.702 1.00 0.03 H HETATM 2884 H8 SDS A 181 31.016 -1.563 35.338 1.00 0.03 H HETATM 2885 H9 SDS A 181 30.578 -0.402 36.637 1.00 0.03 H HETATM 2886 H10 SDS A 181 32.490 1.053 35.708 1.00 0.03 H HETATM 2887 H11 SDS A 181 33.013 -0.431 34.841 1.00 0.03 H HETATM 2888 H12 SDS A 181 33.424 -1.593 36.815 1.00 0.03 H HETATM 2889 H13 SDS A 181 32.393 -0.493 37.791 1.00 0.03 H HETATM 2890 H14 SDS A 181 34.342 0.459 38.373 1.00 0.03 H HETATM 2891 H15 SDS A 181 34.233 1.248 36.763 1.00 0.03 H HETATM 2892 H16 SDS A 181 35.303 -1.389 36.427 1.00 0.03 H HETATM 2893 H17 SDS A 181 36.209 -0.560 37.738 1.00 0.03 H HETATM 2894 H18 SDS A 181 37.014 1.051 36.351 1.00 0.03 H HETATM 2895 H19 SDS A 181 35.551 1.039 35.309 1.00 0.03 H HETATM 2896 H20 SDS A 181 36.433 -1.433 34.795 1.00 0.03 H HETATM 2897 H21 SDS A 181 38.001 -0.672 35.227 1.00 0.03 H HETATM 2898 H22 SDS A 181 37.856 -0.264 32.948 1.00 0.03 H HETATM 2899 H23 SDS A 181 37.200 1.251 33.656 1.00 0.03 H HETATM 2900 H24 SDS A 181 35.469 -1.111 32.868 1.00 0.03 H HETATM 2901 H25 SDS A 181 34.956 0.561 33.274 1.00 0.03 H HETATM 2902 H1 SDS A 181 36.129 1.415 31.311 1.00 0.06 H HETATM 2903 H2 SDS A 181 36.696 -0.242 30.915 1.00 0.06 H HETATM 2904 O3S SDS A 181 34.757 2.176 29.545 1.00 -0.46 O HETATM 2905 O4 SDS A 181 33.080 0.527 29.042 1.00 -0.46 O CONECT 1 2 11 12 13 CONECT 11 1 CONECT 12 1 CONECT 13 1 CONECT 2465 2466 2481 2482 2483 CONECT 2481 2465 CONECT 2482 2465 CONECT 2483 2465 CONECT 2864 2865 2866 2904 2905 CONECT 2865 2864 CONECT 2866 2864 2867 CONECT 2867 2866 2868 2902 2903 CONECT 2868 2867 2869 2900 2901 CONECT 2869 2868 2870 2898 2899 CONECT 2870 2869 2871 2896 2897 CONECT 2871 2870 2872 2894 2895 CONECT 2872 2871 2873 2892 2893 CONECT 2873 2872 2874 2890 2891 CONECT 2874 2873 2875 2888 2889 CONECT 2875 2874 2876 2886 2887 CONECT 2876 2875 2877 2884 2885 CONECT 2877 2876 2878 2882 2883 CONECT 2878 2877 2879 2880 2881 CONECT 2879 2878 CONECT 2880 2878 CONECT 2881 2878 CONECT 2882 2877 CONECT 2883 2877 CONECT 2884 2876 CONECT 2885 2876 CONECT 2886 2875 CONECT 2887 2875 CONECT 2888 2874 CONECT 2889 2874 CONECT 2890 2873 CONECT 2891 2873 CONECT 2892 2872 CONECT 2893 2872 CONECT 2894 2871 CONECT 2895 2871 CONECT 2896 2870 CONECT 2897 2870 CONECT 2898 2869 CONECT 2899 2869 CONECT 2900 2868 CONECT 2901 2868 CONECT 2902 2867 CONECT 2903 2867 CONECT 2904 2864 CONECT 2905 2864 MASTER 0 0 0 0 0 0 0 0 2903 2 50 14 END
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Structure:
Ligand 2D
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Protein
Pocket-Ligand
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Related entries of code: 3u90
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
3f33
RCSB PDB
PDBbind
174aa, >3F33_1|Chain... *
3f34
RCSB PDB
PDBbind
174aa, >3F34_1|Chain... at 100%
3f35
RCSB PDB
PDBbind
174aa, >3F35_1|Chain... at 100%
3f36
RCSB PDB
PDBbind
174aa, >3F36_1|Chain... at 100%
3f37
RCSB PDB
PDBbind
174aa, >3F37_1|Chain... at 100%
3f38
RCSB PDB
PDBbind
174aa, >3F38_1|Chain... at 100%
3f39
RCSB PDB
PDBbind
174aa, >3F39_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
4gny
RCSB PDB
PDBbind
SDS
4qip
RCSB PDB
PDBbind
SDS
Entry Information
PDB ID
3u90
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
apoferritin
Ligand Name
SDS
EC.Number
E.C.-.-.-.-
Resolution
1.9(Å)
Affinity (Kd/Ki/IC50)
Kd=24uM
Release Year
2012
Protein/NA Sequence
Check fasta file
Primary Reference
(2012) Acta Crystallogr.,Sect.D Vol. 68: pp. 497-504
Ligand Properties
Formula
C
1
2
H
2
8
O
4
S
Molecular Weight
268.413
Exact Mass
268.171
No. of atoms
45
No. of bonds
44
Polar Surface Area
95.22
LOGP Value
4.82 (
Computed with XLOGP3
)
5.06 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 11
No. of Nitrogen and Oxygen Atoms: 4
No. of Rings: 0
Canonical SMILES
CCCCCCCCCCCCOS(O)(O)O
InChI String
InChI=1S/C12H28O4S/c1-2-3-4-5-6-7-8-9-10-11-12-16-17(13,14)15/h13-15H,2-12H2,1H3
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P02791
Entrez Gene ID
NCBI Entrez Gene ID:
100051593
ASD
Information of known allosteric effects of PDB entries
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times since Nov 2007.
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