Browse entries in the PDBbind-CN Database
HEADER 4WET_COMPLEX COMPND 4WET_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 187 GLN TYR GLU ASP GLY LYS GLN TYR THR THR LEU GLU LYS SEQRES 2 A 187 PRO VAL ALA GLY ALA PRO GLN VAL LEU GLU PHE PHE SER SEQRES 3 A 187 PHE PHE CYS PRO HIS CYS TYR GLN PHE GLU GLU VAL LEU SEQRES 4 A 187 HIS ILE SER ASP ASN VAL LYS LYS LYS LEU PRO GLU GLY SEQRES 5 A 187 VAL LYS MET THR LYS TYR HIS VAL ASN PHE MET GLY GLY SEQRES 6 A 187 ASP LEU GLY LYS ASP LEU THR GLN ALA TRP ALA VAL ALA SEQRES 7 A 187 MET ALA LEU GLY VAL GLU ASP LYS VAL THR VAL PRO LEU SEQRES 8 A 187 PHE GLU GLY VAL GLN LYS THR GLN THR ILE ARG SER ALA SEQRES 9 A 187 SER ASP ILE ARG ASP VAL PHE ILE ASN ALA GLY ILE LYS SEQRES 10 A 187 GLY GLU GLU TYR ASP ALA ALA TRP ASN SER PHE VAL VAL SEQRES 11 A 187 LYS SER LEU VAL ALA GLN GLN GLU LYS ALA ALA ALA ASP SEQRES 12 A 187 VAL GLN LEU ARG GLY VAL PRO ALA MET PHE VAL ASN GLY SEQRES 13 A 187 LYS TYR GLN LEU ASN PRO GLN GLY MET ASP THR SER ASN SEQRES 14 A 187 MET ASP VAL PHE VAL GLN GLN TYR ALA ASP THR VAL LYS SEQRES 15 A 187 TYR LEU SER GLU LYS SEQRES 1 B 188 ALA GLN TYR GLU ASP GLY LYS GLN TYR THR THR LEU GLU SEQRES 2 B 188 LYS PRO VAL ALA GLY ALA PRO GLN VAL LEU GLU PHE PHE SEQRES 3 B 188 SER PHE PHE CYS PRO HIS CYS TYR GLN PHE GLU GLU VAL SEQRES 4 B 188 LEU HIS ILE SER ASP ASN VAL LYS LYS LYS LEU PRO GLU SEQRES 5 B 188 GLY VAL LYS MET THR LYS TYR HIS VAL ASN PHE MET GLY SEQRES 6 B 188 GLY ASP LEU GLY LYS ASP LEU THR GLN ALA TRP ALA VAL SEQRES 7 B 188 ALA MET ALA LEU GLY VAL GLU ASP LYS VAL THR VAL PRO SEQRES 8 B 188 LEU PHE GLU GLY VAL GLN LYS THR GLN THR ILE ARG SER SEQRES 9 B 188 ALA SER ASP ILE ARG ASP VAL PHE ILE ASN ALA GLY ILE SEQRES 10 B 188 LYS GLY GLU GLU TYR ASP ALA ALA TRP ASN SER PHE VAL SEQRES 11 B 188 VAL LYS SER LEU VAL ALA GLN GLN GLU LYS ALA ALA ALA SEQRES 12 B 188 ASP VAL GLN LEU ARG GLY VAL PRO ALA MET PHE VAL ASN SEQRES 13 B 188 GLY LYS TYR GLN LEU ASN PRO GLN GLY MET ASP THR SER SEQRES 14 B 188 ASN MET ASP VAL PHE VAL GLN GLN TYR ALA ASP THR VAL SEQRES 15 B 188 LYS TYR LEU SER GLU LYS HET NA A 1 1 HET WEF A 833 47 SSBOND 1 CYS A 30 CYS A 33 SSBOND 2 CYS B 30 CYS B 33 ATOM 1 N GLN A 2 12.879 47.885 -9.811 1.00 46.91 N ATOM 2 CA GLN A 2 12.899 47.925 -8.351 1.00 45.23 C ATOM 3 C GLN A 2 13.452 46.621 -7.790 1.00 41.07 C ATOM 4 O GLN A 2 12.712 45.802 -7.240 1.00 41.44 O ATOM 5 CB GLN A 2 11.498 48.185 -7.797 1.00 50.11 C ATOM 6 HN3 GLN A 2 12.277 47.098 -10.127 1.00 0.00 H ATOM 7 HN2 GLN A 2 13.847 47.747 -10.166 1.00 0.00 H ATOM 8 HN1 GLN A 2 12.499 48.782 -10.176 1.00 0.00 H ATOM 9 N TYR A 3 14.758 46.431 -7.938 1.00 35.61 N ATOM 10 CA TYR A 3 15.402 45.200 -7.489 1.00 33.75 C ATOM 11 C TYR A 3 15.670 45.223 -5.990 1.00 36.42 C ATOM 12 O TYR A 3 16.169 46.208 -5.443 1.00 39.41 O ATOM 13 CB TYR A 3 16.698 44.963 -8.269 1.00 32.22 C ATOM 14 CG TYR A 3 16.424 44.562 -9.696 1.00 30.67 C ATOM 15 CD1 TYR A 3 15.982 43.278 -9.999 1.00 31.02 C ATOM 16 CD2 TYR A 3 16.568 45.473 -10.738 1.00 31.72 C ATOM 17 CE1 TYR A 3 15.709 42.905 -11.297 1.00 28.79 C ATOM 18 CE2 TYR A 3 16.295 45.109 -12.045 1.00 30.13 C ATOM 19 CZ TYR A 3 15.865 43.822 -12.318 1.00 31.97 C ATOM 20 OH TYR A 3 15.587 43.444 -13.611 1.00 28.20 O ATOM 21 HH TYR A 3 14.866 44.017 -13.973 1.00 0.00 H ATOM 22 H TYR A 3 15.334 47.174 -8.383 1.00 0.00 H ATOM 23 N GLU A 4 15.315 44.131 -5.329 1.00 35.03 N ATOM 24 CA GLU A 4 15.522 44.007 -3.901 1.00 37.29 C ATOM 25 C GLU A 4 15.978 42.600 -3.570 1.00 32.14 C ATOM 26 O GLU A 4 15.452 41.622 -4.110 1.00 32.16 O ATOM 27 CB GLU A 4 14.243 44.346 -3.134 1.00 43.40 C ATOM 28 H GLU A 4 14.877 43.344 -5.848 1.00 0.00 H ATOM 29 N ASP A 5 16.969 42.509 -2.691 1.00 34.31 N ATOM 30 CA ASP A 5 17.410 41.225 -2.176 1.00 33.39 C ATOM 31 C ASP A 5 16.264 40.582 -1.409 1.00 35.32 C ATOM 32 O ASP A 5 15.633 41.223 -0.557 1.00 37.84 O ATOM 33 CB ASP A 5 18.637 41.391 -1.280 1.00 39.74 C ATOM 34 CG ASP A 5 19.180 40.064 -0.793 1.00 43.47 C ATOM 35 OD1 ASP A 5 19.871 39.385 -1.575 1.00 44.46 O ATOM 36 OD2 ASP A 5 18.917 39.698 0.370 1.00 46.65 O ATOM 37 H ASP A 5 17.440 43.377 -2.364 1.00 0.00 H ATOM 38 N GLY A 6 15.989 39.322 -1.722 1.00 32.21 N ATOM 39 CA GLY A 6 14.862 38.625 -1.139 1.00 32.61 C ATOM 40 C GLY A 6 13.681 38.591 -2.091 1.00 37.70 C ATOM 41 O GLY A 6 12.770 37.782 -1.928 1.00 42.49 O ATOM 42 H GLY A 6 16.598 38.823 -2.402 1.00 0.00 H ATOM 43 N LYS A 7 13.696 39.464 -3.095 1.00 34.80 N ATOM 44 CA LYS A 7 12.578 39.550 -4.028 1.00 32.34 C ATOM 45 C LYS A 7 12.863 38.805 -5.331 1.00 30.63 C ATOM 46 O LYS A 7 12.448 37.655 -5.489 1.00 29.88 O ATOM 47 CB LYS A 7 12.232 41.015 -4.311 1.00 37.11 C ATOM 48 CG LYS A 7 10.915 41.201 -5.054 1.00 39.12 C ATOM 49 CD LYS A 7 10.552 42.673 -5.177 1.00 42.02 C ATOM 50 CE LYS A 7 9.331 42.863 -6.068 1.00 47.78 C ATOM 51 NZ LYS A 7 9.040 44.305 -6.320 1.00 56.17 N ATOM 52 HZ1 LYS A 7 8.859 44.784 -5.415 1.00 0.00 H ATOM 53 HZ2 LYS A 7 9.857 44.745 -6.790 1.00 0.00 H ATOM 54 HZ3 LYS A 7 8.202 44.387 -6.930 1.00 0.00 H ATOM 55 H LYS A 7 14.515 40.093 -3.216 1.00 0.00 H ATOM 56 N GLN A 8 13.566 39.451 -6.261 1.00 29.20 N ATOM 57 CA GLN A 8 13.877 38.829 -7.553 1.00 24.41 C ATOM 58 C GLN A 8 15.068 37.884 -7.460 1.00 23.35 C ATOM 59 O GLN A 8 15.292 37.069 -8.353 1.00 23.75 O ATOM 60 CB GLN A 8 14.166 39.885 -8.627 1.00 24.49 C ATOM 61 CG GLN A 8 13.033 40.874 -8.873 1.00 27.66 C ATOM 62 CD GLN A 8 13.113 42.094 -7.970 1.00 29.21 C ATOM 63 OE1 GLN A 8 13.835 42.102 -6.975 1.00 30.12 O ATOM 64 NE2 GLN A 8 12.373 43.138 -8.320 1.00 30.04 N ATOM 65 HE22 GLN A 8 11.775 43.090 -9.170 1.00 0.00 H ATOM 66 HE21 GLN A 8 12.391 44.004 -7.745 1.00 0.00 H ATOM 67 H GLN A 8 13.901 40.416 -6.067 1.00 0.00 H ATOM 68 N TYR A 9 15.835 38.012 -6.382 1.00 25.65 N ATOM 69 CA TYR A 9 17.034 37.210 -6.192 1.00 22.98 C ATOM 70 C TYR A 9 17.399 37.165 -4.714 1.00 27.16 C ATOM 71 O TYR A 9 16.893 37.961 -3.921 1.00 25.87 O ATOM 72 CB TYR A 9 18.196 37.788 -6.999 1.00 22.25 C ATOM 73 CG TYR A 9 18.709 39.103 -6.451 1.00 27.81 C ATOM 74 CD1 TYR A 9 18.079 40.306 -6.761 1.00 29.83 C ATOM 75 CD2 TYR A 9 19.820 39.145 -5.614 1.00 29.72 C ATOM 76 CE1 TYR A 9 18.544 41.512 -6.251 1.00 32.79 C ATOM 77 CE2 TYR A 9 20.293 40.347 -5.103 1.00 33.04 C ATOM 78 CZ TYR A 9 19.651 41.524 -5.427 1.00 36.26 C ATOM 79 OH TYR A 9 20.118 42.716 -4.921 1.00 42.13 O ATOM 80 HH TYR A 9 19.549 43.457 -5.248 1.00 0.00 H ATOM 81 H TYR A 9 15.570 38.705 -5.653 1.00 0.00 H ATOM 82 N THR A 10 18.272 36.233 -4.349 1.00 27.76 N ATOM 83 CA THR A 10 18.863 36.216 -3.018 1.00 29.41 C ATOM 84 C THR A 10 20.377 36.250 -3.146 1.00 29.59 C ATOM 85 O THR A 10 20.923 36.043 -4.229 1.00 30.75 O ATOM 86 CB THR A 10 18.440 34.978 -2.200 1.00 26.88 C ATOM 87 OG1 THR A 10 18.792 33.786 -2.909 1.00 27.48 O ATOM 88 CG2 THR A 10 16.937 34.989 -1.948 1.00 29.92 C ATOM 89 HG1 THR A 10 18.329 33.775 -3.784 1.00 0.00 H ATOM 90 H THR A 10 18.541 35.496 -5.032 1.00 0.00 H ATOM 91 N THR A 11 21.054 36.516 -2.037 1.00 27.11 N ATOM 92 CA THR A 11 22.506 36.651 -2.048 1.00 33.11 C ATOM 93 C THR A 11 23.152 35.558 -1.204 1.00 34.57 C ATOM 94 O THR A 11 22.810 35.386 -0.036 1.00 34.62 O ATOM 95 CB THR A 11 22.940 38.038 -1.529 1.00 37.61 C ATOM 96 OG1 THR A 11 22.332 39.061 -2.330 1.00 36.35 O ATOM 97 CG2 THR A 11 24.457 38.191 -1.581 1.00 36.71 C ATOM 98 HG1 THR A 11 21.347 38.981 -2.274 1.00 0.00 H ATOM 99 H THR A 11 20.539 36.631 -1.141 1.00 0.00 H ATOM 100 N LEU A 12 24.077 34.812 -1.802 1.00 33.38 N ATOM 101 CA LEU A 12 24.734 33.714 -1.099 1.00 35.60 C ATOM 102 C LEU A 12 25.572 34.221 0.066 1.00 38.88 C ATOM 103 O LEU A 12 26.195 35.279 -0.017 1.00 41.59 O ATOM 104 CB LEU A 12 25.610 32.900 -2.055 1.00 33.80 C ATOM 105 CG LEU A 12 24.889 32.106 -3.150 1.00 34.62 C ATOM 106 CD1 LEU A 12 25.859 31.156 -3.835 1.00 32.49 C ATOM 107 CD2 LEU A 12 23.703 31.343 -2.582 1.00 41.17 C ATOM 108 H LEU A 12 24.337 35.015 -2.788 1.00 0.00 H ATOM 109 N GLU A 13 25.576 33.457 1.154 1.00 41.21 N ATOM 110 CA GLU A 13 26.300 33.833 2.361 1.00 43.37 C ATOM 111 C GLU A 13 27.807 33.770 2.130 1.00 47.44 C ATOM 112 O GLU A 13 28.555 34.637 2.592 1.00 49.43 O ATOM 113 CB GLU A 13 25.897 32.921 3.525 1.00 44.78 C ATOM 114 CG GLU A 13 26.051 33.544 4.907 1.00 53.25 C ATOM 115 CD GLU A 13 24.891 34.454 5.267 1.00 57.33 C ATOM 116 OE1 GLU A 13 24.030 34.701 4.393 1.00 58.18 O ATOM 117 OE2 GLU A 13 24.833 34.914 6.427 1.00 60.70 O ATOM 118 H GLU A 13 25.045 32.563 1.143 1.00 0.00 H ATOM 119 N LYS A 14 28.246 32.741 1.409 1.00 48.22 N ATOM 120 CA LYS A 14 29.660 32.569 1.094 1.00 52.30 C ATOM 121 C LYS A 14 29.858 32.338 -0.402 1.00 50.05 C ATOM 122 O LYS A 14 29.783 31.204 -0.873 1.00 52.54 O ATOM 123 CB LYS A 14 30.251 31.406 1.892 1.00 57.32 C ATOM 124 H LYS A 14 27.562 32.040 1.060 1.00 0.00 H ATOM 125 N PRO A 15 30.107 33.424 -1.151 1.00 45.37 N ATOM 126 CA PRO A 15 30.280 33.414 -2.609 1.00 45.39 C ATOM 127 C PRO A 15 31.331 32.413 -3.079 1.00 47.03 C ATOM 128 O PRO A 15 32.375 32.277 -2.449 1.00 51.38 O ATOM 129 CB PRO A 15 30.723 34.846 -2.918 1.00 46.69 C ATOM 130 CG PRO A 15 30.163 35.657 -1.806 1.00 46.06 C ATOM 131 CD PRO A 15 30.231 34.782 -0.593 1.00 45.50 C ATOM 132 N VAL A 16 31.046 31.727 -4.181 1.00 47.76 N ATOM 133 CA VAL A 16 31.952 30.720 -4.727 1.00 53.24 C ATOM 134 C VAL A 16 32.997 31.346 -5.650 1.00 55.81 C ATOM 135 O VAL A 16 32.654 32.046 -6.605 1.00 55.91 O ATOM 136 CB VAL A 16 31.176 29.634 -5.506 1.00 50.96 C ATOM 137 CG1 VAL A 16 32.130 28.572 -6.032 1.00 52.12 C ATOM 138 CG2 VAL A 16 30.099 29.010 -4.625 1.00 47.81 C ATOM 139 H VAL A 16 30.148 31.913 -4.671 1.00 0.00 H ATOM 140 N ALA A 17 34.270 31.089 -5.362 1.00 57.31 N ATOM 141 CA ALA A 17 35.364 31.626 -6.167 1.00 55.80 C ATOM 142 C ALA A 17 35.496 30.888 -7.499 1.00 53.23 C ATOM 143 O ALA A 17 35.351 29.664 -7.563 1.00 52.86 O ATOM 144 CB ALA A 17 36.669 31.559 -5.396 1.00 60.13 C ATOM 145 H ALA A 17 34.492 30.490 -4.542 1.00 0.00 H ATOM 146 N GLY A 18 35.762 31.642 -8.562 1.00 52.25 N ATOM 147 CA GLY A 18 35.941 31.066 -9.883 1.00 52.97 C ATOM 148 C GLY A 18 34.707 30.372 -10.431 1.00 51.05 C ATOM 149 O GLY A 18 34.807 29.485 -11.281 1.00 51.66 O ATOM 150 H GLY A 18 35.844 32.672 -8.444 1.00 0.00 H ATOM 151 N ALA A 19 33.537 30.776 -9.946 1.00 51.20 N ATOM 152 CA ALA A 19 32.280 30.196 -10.407 1.00 48.02 C ATOM 153 C ALA A 19 31.943 30.674 -11.817 1.00 40.53 C ATOM 154 O ALA A 19 32.351 31.768 -12.216 1.00 37.48 O ATOM 155 CB ALA A 19 31.151 30.545 -9.444 1.00 49.28 C ATOM 156 H ALA A 19 33.517 31.522 -9.222 1.00 0.00 H ATOM 157 N PRO A 20 31.202 29.850 -12.581 1.00 40.64 N ATOM 158 CA PRO A 20 30.701 30.270 -13.896 1.00 37.01 C ATOM 159 C PRO A 20 29.864 31.538 -13.772 1.00 34.94 C ATOM 160 O PRO A 20 29.243 31.749 -12.729 1.00 38.26 O ATOM 161 CB PRO A 20 29.842 29.084 -14.349 1.00 33.78 C ATOM 162 CG PRO A 20 30.370 27.921 -13.580 1.00 34.39 C ATOM 163 CD PRO A 20 30.805 28.468 -12.255 1.00 39.54 C ATOM 164 N GLN A 21 29.849 32.369 -14.808 1.00 31.96 N ATOM 165 CA GLN A 21 29.129 33.633 -14.744 1.00 32.32 C ATOM 166 C GLN A 21 27.636 33.389 -14.588 1.00 25.01 C ATOM 167 O GLN A 21 26.975 34.021 -13.767 1.00 26.22 O ATOM 168 CB GLN A 21 29.400 34.475 -15.988 1.00 38.54 C ATOM 169 CG GLN A 21 30.851 34.884 -16.158 1.00 45.69 C ATOM 170 CD GLN A 21 31.357 34.607 -17.558 1.00 54.38 C ATOM 171 OE1 GLN A 21 31.876 33.524 -17.839 1.00 62.33 O ATOM 172 NE2 GLN A 21 31.193 35.577 -18.450 1.00 52.82 N ATOM 173 HE22 GLN A 21 30.750 36.474 -18.167 1.00 0.00 H ATOM 174 HE21 GLN A 21 31.508 35.439 -19.432 1.00 0.00 H ATOM 175 H GLN A 21 30.359 32.113 -15.678 1.00 0.00 H ATOM 176 N VAL A 22 27.110 32.472 -15.394 1.00 23.32 N ATOM 177 CA VAL A 22 25.713 32.061 -15.288 1.00 22.40 C ATOM 178 C VAL A 22 25.667 30.544 -15.193 1.00 24.72 C ATOM 179 O VAL A 22 26.136 29.851 -16.097 1.00 24.93 O ATOM 180 CB VAL A 22 24.871 32.546 -16.489 1.00 22.60 C ATOM 181 CG1 VAL A 22 23.436 32.040 -16.376 1.00 22.21 C ATOM 182 CG2 VAL A 22 24.886 34.069 -16.560 1.00 23.62 C ATOM 183 H VAL A 22 27.711 32.035 -16.121 1.00 0.00 H ATOM 184 N LEU A 23 25.130 30.040 -14.084 1.00 18.03 N ATOM 185 CA LEU A 23 25.118 28.604 -13.811 1.00 20.74 C ATOM 186 C LEU A 23 23.711 28.136 -13.476 1.00 19.69 C ATOM 187 O LEU A 23 23.112 28.586 -12.494 1.00 17.27 O ATOM 188 CB LEU A 23 26.083 28.262 -12.662 1.00 20.10 C ATOM 189 CG LEU A 23 26.140 26.797 -12.207 1.00 23.61 C ATOM 190 CD1 LEU A 23 26.487 25.852 -13.355 1.00 21.24 C ATOM 191 CD2 LEU A 23 27.141 26.638 -11.064 1.00 25.23 C ATOM 192 H LEU A 23 24.706 30.688 -13.390 1.00 0.00 H ATOM 193 N GLU A 24 23.181 27.243 -14.309 1.00 18.52 N ATOM 194 CA GLU A 24 21.850 26.677 -14.106 1.00 18.59 C ATOM 195 C GLU A 24 21.932 25.234 -13.645 1.00 19.09 C ATOM 196 O GLU A 24 22.744 24.471 -14.156 1.00 18.41 O ATOM 197 CB GLU A 24 21.035 26.730 -15.393 1.00 19.54 C ATOM 198 CG GLU A 24 20.516 28.084 -15.740 1.00 25.16 C ATOM 199 CD GLU A 24 19.613 28.054 -16.952 1.00 28.19 C ATOM 200 OE1 GLU A 24 20.138 27.919 -18.077 1.00 24.48 O ATOM 201 OE2 GLU A 24 18.380 28.169 -16.770 1.00 31.11 O ATOM 202 H GLU A 24 23.735 26.937 -15.134 1.00 0.00 H ATOM 203 N PHE A 25 21.092 24.863 -12.682 1.00 13.80 N ATOM 204 CA PHE A 25 20.955 23.458 -12.318 1.00 13.94 C ATOM 205 C PHE A 25 19.546 22.995 -12.628 1.00 14.17 C ATOM 206 O PHE A 25 18.586 23.744 -12.459 1.00 16.13 O ATOM 207 CB PHE A 25 21.255 23.219 -10.833 1.00 14.86 C ATOM 208 CG PHE A 25 22.663 23.519 -10.420 1.00 16.07 C ATOM 209 CD1 PHE A 25 23.638 22.530 -10.455 1.00 17.13 C ATOM 210 CD2 PHE A 25 23.003 24.775 -9.936 1.00 19.11 C ATOM 211 CE1 PHE A 25 24.934 22.793 -10.039 1.00 18.64 C ATOM 212 CE2 PHE A 25 24.292 25.048 -9.521 1.00 20.35 C ATOM 213 CZ PHE A 25 25.263 24.054 -9.568 1.00 19.04 C ATOM 214 H PHE A 25 20.528 25.582 -12.185 1.00 0.00 H ATOM 215 N PHE A 26 19.425 21.752 -13.082 1.00 14.00 N ATOM 216 CA PHE A 26 18.124 21.170 -13.366 1.00 14.52 C ATOM 217 C PHE A 26 18.165 19.667 -13.161 1.00 13.38 C ATOM 218 O PHE A 26 19.228 19.091 -12.973 1.00 14.09 O ATOM 219 CB PHE A 26 17.690 21.481 -14.796 1.00 14.83 C ATOM 220 CG PHE A 26 18.366 20.626 -15.822 1.00 16.89 C ATOM 221 CD1 PHE A 26 19.704 20.795 -16.105 1.00 15.24 C ATOM 222 CD2 PHE A 26 17.659 19.643 -16.495 1.00 12.78 C ATOM 223 CE1 PHE A 26 20.333 19.998 -17.048 1.00 14.56 C ATOM 224 CE2 PHE A 26 18.273 18.841 -17.438 1.00 13.18 C ATOM 225 CZ PHE A 26 19.617 19.023 -17.725 1.00 14.38 C ATOM 226 H PHE A 26 20.281 21.182 -13.238 1.00 0.00 H ATOM 227 N SER A 27 16.997 19.041 -13.216 1.00 14.82 N ATOM 228 CA SER A 27 16.893 17.586 -13.271 1.00 14.05 C ATOM 229 C SER A 27 15.852 17.271 -14.311 1.00 13.76 C ATOM 230 O SER A 27 14.883 18.009 -14.441 1.00 13.35 O ATOM 231 CB SER A 27 16.470 16.998 -11.934 1.00 15.24 C ATOM 232 OG SER A 27 16.139 15.619 -12.045 1.00 18.45 O ATOM 233 HG SER A 27 16.927 15.117 -12.371 1.00 0.00 H ATOM 234 H SER A 27 16.124 19.607 -13.220 1.00 0.00 H ATOM 235 N PHE A 28 16.032 16.172 -15.021 1.00 14.27 N ATOM 236 CA PHE A 28 15.034 15.733 -15.979 1.00 14.36 C ATOM 237 C PHE A 28 13.798 15.195 -15.266 1.00 15.00 C ATOM 238 O PHE A 28 12.777 14.962 -15.909 1.00 15.30 O ATOM 239 CB PHE A 28 15.623 14.683 -16.921 1.00 15.03 C ATOM 240 CG PHE A 28 16.525 15.265 -17.985 1.00 15.55 C ATOM 241 CD1 PHE A 28 15.999 16.090 -18.979 1.00 14.31 C ATOM 242 CD2 PHE A 28 17.888 14.990 -17.989 1.00 16.11 C ATOM 243 CE1 PHE A 28 16.822 16.634 -19.952 1.00 14.40 C ATOM 244 CE2 PHE A 28 18.713 15.520 -18.961 1.00 17.38 C ATOM 245 CZ PHE A 28 18.186 16.342 -19.945 1.00 14.95 C ATOM 246 H PHE A 28 16.900 15.614 -14.892 1.00 0.00 H ATOM 247 N PHE A 29 13.884 15.032 -13.943 1.00 15.50 N ATOM 248 CA PHE A 29 12.720 14.636 -13.137 1.00 16.45 C ATOM 249 C PHE A 29 11.954 15.829 -12.570 1.00 19.58 C ATOM 250 O PHE A 29 10.861 15.676 -12.023 1.00 21.24 O ATOM 251 CB PHE A 29 13.147 13.735 -11.982 1.00 17.70 C ATOM 252 CG PHE A 29 13.293 12.298 -12.359 1.00 18.78 C ATOM 253 CD1 PHE A 29 12.199 11.450 -12.325 1.00 20.01 C ATOM 254 CD2 PHE A 29 14.520 11.787 -12.747 1.00 20.12 C ATOM 255 CE1 PHE A 29 12.318 10.120 -12.672 1.00 22.89 C ATOM 256 CE2 PHE A 29 14.645 10.453 -13.097 1.00 22.92 C ATOM 257 CZ PHE A 29 13.541 9.619 -13.058 1.00 24.28 C ATOM 258 H PHE A 29 14.797 15.189 -13.471 1.00 0.00 H ATOM 259 N CYS A 30 12.546 17.005 -12.696 1.00 15.77 N ATOM 260 CA CYS A 30 12.035 18.233 -12.086 1.00 18.48 C ATOM 261 C CYS A 30 10.902 18.873 -12.917 1.00 15.58 C ATOM 262 O CYS A 30 11.127 19.307 -14.051 1.00 16.69 O ATOM 263 CB CYS A 30 13.230 19.176 -11.897 1.00 16.45 C ATOM 264 SG CYS A 30 12.946 20.938 -11.706 1.00 17.43 S ATOM 265 H CYS A 30 13.420 17.060 -13.258 1.00 0.00 H ATOM 266 N PRO A 31 9.676 18.930 -12.352 1.00 16.75 N ATOM 267 CA PRO A 31 8.527 19.431 -13.119 1.00 16.44 C ATOM 268 C PRO A 31 8.680 20.895 -13.536 1.00 19.45 C ATOM 269 O PRO A 31 8.422 21.221 -14.699 1.00 17.23 O ATOM 270 CB PRO A 31 7.351 19.245 -12.154 1.00 17.99 C ATOM 271 CG PRO A 31 7.795 18.176 -11.223 1.00 28.19 C ATOM 272 CD PRO A 31 9.270 18.388 -11.048 1.00 19.69 C ATOM 273 N HIS A 32 9.101 21.771 -12.631 1.00 18.63 N ATOM 274 CA HIS A 32 9.322 23.158 -13.037 1.00 19.71 C ATOM 275 C HIS A 32 10.420 23.264 -14.096 1.00 17.46 C ATOM 276 O HIS A 32 10.393 24.164 -14.935 1.00 18.53 O ATOM 277 CB HIS A 32 9.675 24.042 -11.833 1.00 20.62 C ATOM 278 CG HIS A 32 8.495 24.461 -11.010 1.00 22.32 C ATOM 279 ND1 HIS A 32 7.450 25.205 -11.520 1.00 24.44 N ATOM 280 CD2 HIS A 32 8.210 24.262 -9.702 1.00 20.84 C ATOM 281 CE1 HIS A 32 6.567 25.436 -10.564 1.00 25.32 C ATOM 282 NE2 HIS A 32 7.003 24.871 -9.451 1.00 25.56 N ATOM 283 H HIS A 32 9.271 21.475 -11.649 1.00 0.00 H ATOM 284 N CYS A 33 11.383 22.340 -14.071 1.00 15.36 N ATOM 285 CA CYS A 33 12.464 22.339 -15.052 1.00 13.88 C ATOM 286 C CYS A 33 11.928 22.001 -16.442 1.00 13.29 C ATOM 287 O CYS A 33 12.387 22.540 -17.445 1.00 13.39 O ATOM 288 CB CYS A 33 13.573 21.352 -14.660 1.00 12.36 C ATOM 289 SG CYS A 33 14.324 21.658 -13.029 1.00 16.76 S ATOM 290 H CYS A 33 11.363 21.604 -13.336 1.00 0.00 H ATOM 291 N TYR A 34 10.951 21.096 -16.490 1.00 14.46 N ATOM 292 CA TYR A 34 10.270 20.769 -17.738 1.00 13.92 C ATOM 293 C TYR A 34 9.590 22.024 -18.273 1.00 15.07 C ATOM 294 O TYR A 34 9.704 22.348 -19.445 1.00 17.42 O ATOM 295 CB TYR A 34 9.242 19.653 -17.500 1.00 18.10 C ATOM 296 CG TYR A 34 8.584 19.088 -18.735 1.00 16.52 C ATOM 297 CD1 TYR A 34 7.600 19.801 -19.416 1.00 16.64 C ATOM 298 CD2 TYR A 34 8.922 17.822 -19.205 1.00 15.99 C ATOM 299 CE1 TYR A 34 6.987 19.276 -20.539 1.00 17.76 C ATOM 300 CE2 TYR A 34 8.313 17.290 -20.327 1.00 17.04 C ATOM 301 CZ TYR A 34 7.341 18.020 -20.989 1.00 17.93 C ATOM 302 OH TYR A 34 6.729 17.494 -22.099 1.00 19.27 O ATOM 303 HH TYR A 34 6.065 18.141 -22.446 1.00 0.00 H ATOM 304 H TYR A 34 10.667 20.610 -15.615 1.00 0.00 H ATOM 305 N GLN A 35 8.873 22.723 -17.400 1.00 16.86 N ATOM 306 CA GLN A 35 8.205 23.953 -17.802 1.00 18.93 C ATOM 307 C GLN A 35 9.220 24.989 -18.275 1.00 19.50 C ATOM 308 O GLN A 35 9.035 25.626 -19.316 1.00 19.28 O ATOM 309 CB GLN A 35 7.377 24.501 -16.647 1.00 18.26 C ATOM 310 CG GLN A 35 6.257 23.577 -16.237 1.00 20.92 C ATOM 311 CD GLN A 35 5.235 23.392 -17.341 1.00 26.97 C ATOM 312 OE1 GLN A 35 4.881 24.343 -18.034 1.00 31.22 O ATOM 313 NE2 GLN A 35 4.764 22.168 -17.514 1.00 19.35 N ATOM 314 HE22 GLN A 35 5.093 21.393 -16.903 1.00 0.00 H ATOM 315 HE21 GLN A 35 4.065 21.981 -18.261 1.00 0.00 H ATOM 316 H GLN A 35 8.788 22.388 -16.419 1.00 0.00 H ATOM 317 N PHE A 36 10.294 25.150 -17.507 1.00 18.42 N ATOM 318 CA PHE A 36 11.338 26.117 -17.868 1.00 17.29 C ATOM 319 C PHE A 36 11.965 25.866 -19.235 1.00 20.71 C ATOM 320 O PHE A 36 12.308 26.808 -19.939 1.00 23.38 O ATOM 321 CB PHE A 36 12.458 26.131 -16.812 1.00 19.35 C ATOM 322 CG PHE A 36 12.188 27.025 -15.632 1.00 23.01 C ATOM 323 CD1 PHE A 36 10.895 27.296 -15.216 1.00 24.74 C ATOM 324 CD2 PHE A 36 13.248 27.591 -14.928 1.00 23.09 C ATOM 325 CE1 PHE A 36 10.656 28.123 -14.122 1.00 28.95 C ATOM 326 CE2 PHE A 36 13.015 28.423 -13.833 1.00 23.84 C ATOM 327 CZ PHE A 36 11.725 28.680 -13.432 1.00 25.65 C ATOM 328 H PHE A 36 10.395 24.584 -16.640 1.00 0.00 H ATOM 329 N GLU A 37 12.134 24.596 -19.606 1.00 14.41 N ATOM 330 CA GLU A 37 12.710 24.251 -20.908 1.00 19.09 C ATOM 331 C GLU A 37 11.729 24.249 -22.083 1.00 21.74 C ATOM 332 O GLU A 37 11.976 24.902 -23.091 1.00 22.34 O ATOM 333 CB GLU A 37 13.386 22.878 -20.825 1.00 24.49 C ATOM 334 CG GLU A 37 13.680 22.234 -22.179 1.00 27.09 C ATOM 335 CD GLU A 37 14.751 22.961 -22.980 1.00 27.33 C ATOM 336 OE1 GLU A 37 15.711 23.477 -22.368 1.00 25.95 O ATOM 337 OE2 GLU A 37 14.629 23.008 -24.225 1.00 28.48 O ATOM 338 H GLU A 37 11.851 23.834 -18.957 1.00 0.00 H ATOM 339 N GLU A 38 10.613 23.537 -21.938 1.00 23.22 N ATOM 340 CA GLU A 38 9.697 23.290 -23.056 1.00 26.79 C ATOM 341 C GLU A 38 8.667 24.398 -23.309 1.00 27.04 C ATOM 342 O GLU A 38 8.268 24.630 -24.453 1.00 29.28 O ATOM 343 CB GLU A 38 8.959 21.967 -22.831 1.00 30.19 C ATOM 344 CG GLU A 38 9.848 20.830 -22.353 1.00 29.19 C ATOM 345 CD GLU A 38 10.746 20.286 -23.448 1.00 31.35 C ATOM 346 OE1 GLU A 38 10.315 20.262 -24.619 1.00 37.65 O ATOM 347 OE2 GLU A 38 11.884 19.886 -23.138 1.00 29.75 O ATOM 348 H GLU A 38 10.384 23.144 -21.003 1.00 0.00 H ATOM 349 N VAL A 39 8.232 25.071 -22.245 1.00 22.28 N ATOM 350 CA VAL A 39 7.167 26.059 -22.331 1.00 25.71 C ATOM 351 C VAL A 39 7.698 27.486 -22.277 1.00 24.65 C ATOM 352 O VAL A 39 7.301 28.340 -23.069 1.00 30.22 O ATOM 353 CB VAL A 39 6.140 25.843 -21.200 1.00 28.16 C ATOM 354 CG1 VAL A 39 4.954 26.761 -21.380 1.00 27.28 C ATOM 355 CG2 VAL A 39 5.697 24.378 -21.163 1.00 33.30 C ATOM 356 H VAL A 39 8.669 24.884 -21.320 1.00 0.00 H ATOM 357 N LEU A 40 8.603 27.738 -21.339 1.00 17.98 N ATOM 358 CA LEU A 40 9.101 29.090 -21.105 1.00 23.01 C ATOM 359 C LEU A 40 10.392 29.399 -21.853 1.00 21.27 C ATOM 360 O LEU A 40 10.672 30.561 -22.147 1.00 25.16 O ATOM 361 CB LEU A 40 9.328 29.309 -19.612 1.00 22.14 C ATOM 362 CG LEU A 40 8.091 29.173 -18.733 1.00 20.42 C ATOM 363 CD1 LEU A 40 8.506 29.309 -17.262 1.00 20.40 C ATOM 364 CD2 LEU A 40 7.017 30.196 -19.127 1.00 23.61 C ATOM 365 H LEU A 40 8.965 26.955 -20.758 1.00 0.00 H ATOM 366 N HIS A 41 11.179 28.359 -22.133 1.00 19.31 N ATOM 367 CA HIS A 41 12.487 28.507 -22.786 1.00 19.56 C ATOM 368 C HIS A 41 13.387 29.514 -22.062 1.00 19.94 C ATOM 369 O HIS A 41 13.983 30.394 -22.684 1.00 21.68 O ATOM 370 CB HIS A 41 12.298 28.917 -24.249 1.00 23.62 C ATOM 371 CG HIS A 41 11.383 28.007 -25.005 1.00 25.56 C ATOM 372 ND1 HIS A 41 11.710 26.700 -25.290 1.00 24.03 N ATOM 373 CD2 HIS A 41 10.142 28.205 -25.509 1.00 29.53 C ATOM 374 CE1 HIS A 41 10.717 26.135 -25.953 1.00 25.56 C ATOM 375 NE2 HIS A 41 9.751 27.025 -26.095 1.00 28.15 N ATOM 376 H HIS A 41 10.854 27.405 -21.879 1.00 0.00 H ATOM 377 N ILE A 42 13.478 29.363 -20.744 1.00 19.97 N ATOM 378 CA ILE A 42 14.234 30.284 -19.894 1.00 20.66 C ATOM 379 C ILE A 42 15.695 30.463 -20.333 1.00 22.40 C ATOM 380 O ILE A 42 16.153 31.593 -20.514 1.00 21.79 O ATOM 381 CB ILE A 42 14.204 29.820 -18.421 1.00 18.29 C ATOM 382 CG1 ILE A 42 12.824 30.071 -17.815 1.00 18.34 C ATOM 383 CG2 ILE A 42 15.275 30.537 -17.597 1.00 20.07 C ATOM 384 CD1 ILE A 42 12.472 31.544 -17.711 1.00 22.82 C ATOM 385 H ILE A 42 12.992 28.558 -20.299 1.00 0.00 H ATOM 386 N SER A 43 16.422 29.362 -20.510 1.00 24.07 N ATOM 387 CA SER A 43 17.827 29.465 -20.902 1.00 21.87 C ATOM 388 C SER A 43 18.008 30.258 -22.191 1.00 21.76 C ATOM 389 O SER A 43 18.845 31.156 -22.257 1.00 21.91 O ATOM 390 CB SER A 43 18.454 28.082 -21.063 1.00 21.56 C ATOM 391 OG SER A 43 18.387 27.362 -19.856 1.00 24.12 O ATOM 392 HG SER A 43 18.876 27.856 -19.151 1.00 0.00 H ATOM 393 H SER A 43 15.990 28.427 -20.369 1.00 0.00 H ATOM 394 N ASP A 44 17.214 29.947 -23.213 1.00 20.48 N ATOM 395 CA ASP A 44 17.318 30.660 -24.482 1.00 20.97 C ATOM 396 C ASP A 44 17.046 32.151 -24.325 1.00 23.30 C ATOM 397 O ASP A 44 17.698 32.978 -24.945 1.00 24.30 O ATOM 398 CB ASP A 44 16.347 30.086 -25.519 1.00 23.94 C ATOM 399 CG ASP A 44 16.785 28.734 -26.056 1.00 31.10 C ATOM 400 OD1 ASP A 44 17.881 28.255 -25.690 1.00 31.06 O ATOM 401 OD2 ASP A 44 16.027 28.151 -26.857 1.00 30.88 O ATOM 402 H ASP A 44 16.512 29.187 -23.106 1.00 0.00 H ATOM 403 N ASN A 45 16.076 32.497 -23.490 1.00 22.96 N ATOM 404 CA ASN A 45 15.728 33.897 -23.351 1.00 22.60 C ATOM 405 C ASN A 45 16.725 34.656 -22.482 1.00 22.24 C ATOM 406 O ASN A 45 16.960 35.846 -22.694 1.00 23.90 O ATOM 407 CB ASN A 45 14.309 34.032 -22.803 1.00 21.26 C ATOM 408 CG ASN A 45 13.264 33.818 -23.877 1.00 24.27 C ATOM 409 OD1 ASN A 45 12.966 34.728 -24.654 1.00 29.10 O ATOM 410 ND2 ASN A 45 12.715 32.612 -23.940 1.00 25.42 N ATOM 411 HD22 ASN A 45 12.998 31.876 -23.262 1.00 0.00 H ATOM 412 HD21 ASN A 45 12.001 32.403 -24.667 1.00 0.00 H ATOM 413 H ASN A 45 15.571 31.772 -22.941 1.00 0.00 H ATOM 414 N VAL A 46 17.322 33.972 -21.516 1.00 22.02 N ATOM 415 CA VAL A 46 18.394 34.581 -20.737 1.00 20.67 C ATOM 416 C VAL A 46 19.611 34.828 -21.633 1.00 25.64 C ATOM 417 O VAL A 46 20.231 35.891 -21.597 1.00 26.03 O ATOM 418 CB VAL A 46 18.792 33.703 -19.544 1.00 21.78 C ATOM 419 CG1 VAL A 46 20.055 34.239 -18.892 1.00 20.13 C ATOM 420 CG2 VAL A 46 17.653 33.640 -18.538 1.00 20.74 C ATOM 421 H VAL A 46 17.024 32.996 -21.313 1.00 0.00 H ATOM 422 N LYS A 47 19.935 33.836 -22.450 1.00 22.75 N ATOM 423 CA LYS A 47 21.030 33.951 -23.406 1.00 26.87 C ATOM 424 C LYS A 47 20.862 35.136 -24.358 1.00 30.52 C ATOM 425 O LYS A 47 21.812 35.866 -24.637 1.00 30.47 O ATOM 426 CB LYS A 47 21.148 32.652 -24.201 1.00 26.94 C ATOM 427 CG LYS A 47 22.187 32.687 -25.300 1.00 32.38 C ATOM 428 CD LYS A 47 22.224 31.356 -26.029 1.00 33.19 C ATOM 429 CE LYS A 47 20.900 31.073 -26.726 1.00 34.43 C ATOM 430 NZ LYS A 47 20.959 29.827 -27.542 1.00 33.36 N ATOM 431 HZ1 LYS A 47 21.697 29.924 -28.269 1.00 0.00 H ATOM 432 HZ2 LYS A 47 21.183 29.020 -26.925 1.00 0.00 H ATOM 433 HZ3 LYS A 47 20.038 29.670 -28.000 1.00 0.00 H ATOM 434 H LYS A 47 19.392 32.950 -22.408 1.00 0.00 H ATOM 435 N LYS A 48 19.643 35.326 -24.844 1.00 28.75 N ATOM 436 CA LYS A 48 19.348 36.378 -25.802 1.00 32.96 C ATOM 437 C LYS A 48 19.507 37.763 -25.172 1.00 32.19 C ATOM 438 O LYS A 48 19.832 38.733 -25.858 1.00 35.65 O ATOM 439 CB LYS A 48 17.932 36.185 -26.352 1.00 33.12 C ATOM 440 CG LYS A 48 17.559 37.049 -27.545 1.00 43.55 C ATOM 441 CD LYS A 48 16.384 36.427 -28.291 1.00 47.90 C ATOM 442 CE LYS A 48 15.350 35.868 -27.313 1.00 50.12 C ATOM 443 NZ LYS A 48 14.269 35.083 -27.979 1.00 53.76 N ATOM 444 HZ1 LYS A 48 13.765 35.693 -28.653 1.00 0.00 H ATOM 445 HZ2 LYS A 48 14.689 34.277 -28.485 1.00 0.00 H ATOM 446 HZ3 LYS A 48 13.603 34.734 -27.261 1.00 0.00 H ATOM 447 H LYS A 48 18.873 34.702 -24.529 1.00 0.00 H ATOM 448 N LYS A 49 19.292 37.847 -23.861 1.00 28.52 N ATOM 449 CA LYS A 49 19.330 39.129 -23.169 1.00 32.28 C ATOM 450 C LYS A 49 20.723 39.479 -22.676 1.00 33.29 C ATOM 451 O LYS A 49 21.031 40.646 -22.439 1.00 40.50 O ATOM 452 CB LYS A 49 18.349 39.133 -21.998 1.00 35.48 C ATOM 453 CG LYS A 49 16.897 39.192 -22.439 1.00 44.52 C ATOM 454 CD LYS A 49 16.139 40.284 -21.703 1.00 47.14 C ATOM 455 CE LYS A 49 14.804 40.575 -22.369 1.00 47.31 C ATOM 456 NZ LYS A 49 13.983 41.515 -21.564 1.00 47.20 N ATOM 457 HZ1 LYS A 49 13.799 41.099 -20.628 1.00 0.00 H ATOM 458 HZ2 LYS A 49 14.496 42.413 -21.451 1.00 0.00 H ATOM 459 HZ3 LYS A 49 13.080 41.689 -22.050 1.00 0.00 H ATOM 460 H LYS A 49 19.093 36.981 -23.320 1.00 0.00 H ATOM 461 N LEU A 50 21.565 38.469 -22.530 1.00 30.90 N ATOM 462 CA LEU A 50 22.930 38.676 -22.071 1.00 35.53 C ATOM 463 C LEU A 50 23.852 39.049 -23.228 1.00 39.97 C ATOM 464 O LEU A 50 23.532 38.779 -24.385 1.00 39.75 O ATOM 465 CB LEU A 50 23.440 37.420 -21.370 1.00 33.41 C ATOM 466 CG LEU A 50 22.790 37.171 -20.007 1.00 34.08 C ATOM 467 CD1 LEU A 50 23.346 35.905 -19.375 1.00 32.92 C ATOM 468 CD2 LEU A 50 22.998 38.372 -19.098 1.00 35.50 C ATOM 469 H LEU A 50 21.244 37.504 -22.748 1.00 0.00 H ATOM 470 N PRO A 51 24.993 39.685 -22.919 1.00 43.19 N ATOM 471 CA PRO A 51 26.006 39.948 -23.948 1.00 46.24 C ATOM 472 C PRO A 51 26.551 38.653 -24.549 1.00 49.51 C ATOM 473 O PRO A 51 26.348 37.578 -23.980 1.00 45.89 O ATOM 474 CB PRO A 51 27.103 40.695 -23.184 1.00 45.32 C ATOM 475 CG PRO A 51 26.406 41.286 -22.000 1.00 46.28 C ATOM 476 CD PRO A 51 25.349 40.296 -21.625 1.00 43.23 C ATOM 477 N GLU A 52 27.231 38.759 -25.687 1.00 55.34 N ATOM 478 CA GLU A 52 27.837 37.595 -26.325 1.00 58.06 C ATOM 479 C GLU A 52 28.922 36.981 -25.440 1.00 62.05 C ATOM 480 O GLU A 52 29.065 35.757 -25.369 1.00 62.51 O ATOM 481 CB GLU A 52 28.421 37.977 -27.686 1.00 59.73 C ATOM 482 H GLU A 52 27.333 39.693 -26.133 1.00 0.00 H ATOM 483 N GLY A 53 29.669 37.844 -24.754 1.00 63.06 N ATOM 484 CA GLY A 53 30.798 37.427 -23.941 1.00 61.82 C ATOM 485 C GLY A 53 30.481 36.571 -22.725 1.00 57.33 C ATOM 486 O GLY A 53 31.367 35.907 -22.191 1.00 58.97 O ATOM 487 H GLY A 53 29.435 38.856 -24.802 1.00 0.00 H ATOM 488 N VAL A 54 29.228 36.578 -22.280 1.00 52.02 N ATOM 489 CA VAL A 54 28.856 35.837 -21.076 1.00 49.24 C ATOM 490 C VAL A 54 28.643 34.350 -21.361 1.00 46.31 C ATOM 491 O VAL A 54 27.929 33.977 -22.294 1.00 45.33 O ATOM 492 CB VAL A 54 27.584 36.412 -20.432 1.00 51.70 C ATOM 493 CG1 VAL A 54 27.311 35.732 -19.097 1.00 49.10 C ATOM 494 CG2 VAL A 54 27.728 37.912 -20.240 1.00 56.22 C ATOM 495 H VAL A 54 28.503 37.118 -22.795 1.00 0.00 H ATOM 496 N LYS A 55 29.272 33.506 -20.550 1.00 44.10 N ATOM 497 CA LYS A 55 29.147 32.061 -20.698 1.00 41.58 C ATOM 498 C LYS A 55 28.047 31.500 -19.802 1.00 33.28 C ATOM 499 O LYS A 55 27.993 31.803 -18.606 1.00 29.36 O ATOM 500 CB LYS A 55 30.481 31.381 -20.379 1.00 47.29 C ATOM 501 CG LYS A 55 30.396 29.873 -20.212 1.00 48.86 C ATOM 502 CD LYS A 55 31.672 29.208 -20.702 1.00 51.87 C ATOM 503 CE LYS A 55 31.919 27.880 -20.007 1.00 52.82 C ATOM 504 NZ LYS A 55 33.166 27.229 -20.503 1.00 56.46 N ATOM 505 HZ1 LYS A 55 33.083 27.056 -21.525 1.00 0.00 H ATOM 506 HZ2 LYS A 55 33.978 27.853 -20.321 1.00 0.00 H ATOM 507 HZ3 LYS A 55 33.304 26.325 -20.008 1.00 0.00 H ATOM 508 H LYS A 55 29.870 33.887 -19.789 1.00 0.00 H ATOM 509 N MET A 56 27.170 30.686 -20.383 1.00 31.34 N ATOM 510 CA MET A 56 26.143 29.998 -19.608 1.00 27.14 C ATOM 511 C MET A 56 26.439 28.508 -19.480 1.00 24.75 C ATOM 512 O MET A 56 26.770 27.838 -20.456 1.00 26.31 O ATOM 513 CB MET A 56 24.763 30.210 -20.228 1.00 26.49 C ATOM 514 CG MET A 56 24.321 31.658 -20.178 1.00 28.00 C ATOM 515 SD MET A 56 22.750 31.954 -21.015 1.00 36.35 S ATOM 516 CE MET A 56 21.615 31.055 -19.965 1.00 26.20 C ATOM 517 H MET A 56 27.217 30.537 -21.411 1.00 0.00 H ATOM 518 N THR A 57 26.323 28.010 -18.255 1.00 20.45 N ATOM 519 CA THR A 57 26.622 26.622 -17.948 1.00 19.37 C ATOM 520 C THR A 57 25.352 25.998 -17.374 1.00 20.05 C ATOM 521 O THR A 57 24.606 26.659 -16.653 1.00 20.65 O ATOM 522 CB THR A 57 27.812 26.523 -16.962 1.00 20.73 C ATOM 523 OG1 THR A 57 28.956 27.166 -17.544 1.00 28.10 O ATOM 524 CG2 THR A 57 28.160 25.070 -16.650 1.00 21.08 C ATOM 525 HG1 THR A 57 28.745 28.117 -17.719 1.00 0.00 H ATOM 526 H THR A 57 26.007 28.636 -17.487 1.00 0.00 H ATOM 527 N LYS A 58 25.078 24.749 -17.733 1.00 17.20 N ATOM 528 CA LYS A 58 23.893 24.062 -17.225 1.00 15.81 C ATOM 529 C LYS A 58 24.272 22.656 -16.772 1.00 16.25 C ATOM 530 O LYS A 58 24.790 21.853 -17.556 1.00 17.09 O ATOM 531 CB LYS A 58 22.780 24.017 -18.283 1.00 16.00 C ATOM 532 CG LYS A 58 21.536 23.264 -17.828 1.00 18.53 C ATOM 533 CD LYS A 58 20.449 23.215 -18.919 1.00 21.42 C ATOM 534 CE LYS A 58 19.744 24.540 -19.091 1.00 26.67 C ATOM 535 NZ LYS A 58 18.700 24.444 -20.160 1.00 23.03 N ATOM 536 HZ1 LYS A 58 19.150 24.181 -21.060 1.00 0.00 H ATOM 537 HZ2 LYS A 58 18.001 23.721 -19.896 1.00 0.00 H ATOM 538 HZ3 LYS A 58 18.226 25.364 -20.264 1.00 0.00 H ATOM 539 H LYS A 58 25.717 24.252 -18.386 1.00 0.00 H ATOM 540 N TYR A 59 24.021 22.372 -15.497 1.00 15.98 N ATOM 541 CA TYR A 59 24.396 21.084 -14.916 1.00 16.74 C ATOM 542 C TYR A 59 23.163 20.332 -14.432 1.00 15.84 C ATOM 543 O TYR A 59 22.188 20.943 -13.985 1.00 14.90 O ATOM 544 CB TYR A 59 25.364 21.280 -13.747 1.00 17.98 C ATOM 545 CG TYR A 59 26.769 21.684 -14.107 1.00 19.57 C ATOM 546 CD1 TYR A 59 27.299 21.433 -15.369 1.00 20.25 C ATOM 547 CD2 TYR A 59 27.587 22.296 -13.160 1.00 20.76 C ATOM 548 CE1 TYR A 59 28.611 21.783 -15.670 1.00 22.29 C ATOM 549 CE2 TYR A 59 28.885 22.646 -13.451 1.00 23.69 C ATOM 550 CZ TYR A 59 29.392 22.397 -14.707 1.00 24.44 C ATOM 551 OH TYR A 59 30.686 22.761 -14.982 1.00 25.47 O ATOM 552 HH TYR A 59 30.904 22.519 -15.917 1.00 0.00 H ATOM 553 H TYR A 59 23.548 23.081 -14.901 1.00 0.00 H ATOM 554 N HIS A 60 23.225 19.008 -14.515 1.00 16.45 N ATOM 555 CA HIS A 60 22.188 18.124 -13.995 1.00 16.12 C ATOM 556 C HIS A 60 22.501 17.763 -12.538 1.00 17.12 C ATOM 557 O HIS A 60 23.664 17.775 -12.120 1.00 19.51 O ATOM 558 CB HIS A 60 22.106 16.859 -14.857 1.00 16.61 C ATOM 559 CG HIS A 60 20.850 16.065 -14.670 1.00 16.25 C ATOM 560 ND1 HIS A 60 20.757 15.013 -13.784 1.00 17.25 N ATOM 561 CD2 HIS A 60 19.647 16.143 -15.290 1.00 17.92 C ATOM 562 CE1 HIS A 60 19.540 14.498 -13.845 1.00 18.38 C ATOM 563 NE2 HIS A 60 18.851 15.160 -14.757 1.00 15.78 N ATOM 564 H HIS A 60 24.054 18.580 -14.974 1.00 0.00 H ATOM 565 N VAL A 61 21.468 17.449 -11.762 1.00 16.88 N ATOM 566 CA VAL A 61 21.670 17.089 -10.365 1.00 18.14 C ATOM 567 C VAL A 61 21.186 15.679 -10.070 1.00 25.49 C ATOM 568 O VAL A 61 20.392 15.110 -10.828 1.00 24.58 O ATOM 569 CB VAL A 61 20.959 18.071 -9.428 1.00 20.42 C ATOM 570 CG1 VAL A 61 21.493 19.469 -9.638 1.00 23.25 C ATOM 571 CG2 VAL A 61 19.450 18.037 -9.659 1.00 19.39 C ATOM 572 H VAL A 61 20.506 17.461 -12.156 1.00 0.00 H ATOM 573 N ASN A 62 21.687 15.129 -8.963 1.00 30.99 N ATOM 574 CA ASN A 62 21.455 13.742 -8.583 1.00 34.35 C ATOM 575 C ASN A 62 20.216 13.483 -7.734 1.00 36.77 C ATOM 576 O ASN A 62 19.719 12.358 -7.705 1.00 42.28 O ATOM 577 CB ASN A 62 22.670 13.210 -7.819 1.00 38.94 C ATOM 578 CG ASN A 62 23.855 12.977 -8.712 1.00 39.05 C ATOM 579 OD1 ASN A 62 23.700 12.777 -9.916 1.00 35.91 O ATOM 580 ND2 ASN A 62 25.051 12.981 -8.130 1.00 40.62 N ATOM 581 HD22 ASN A 62 25.131 13.155 -7.108 1.00 0.00 H ATOM 582 HD21 ASN A 62 25.906 12.810 -8.697 1.00 0.00 H ATOM 583 H ASN A 62 22.273 15.720 -8.340 1.00 0.00 H ATOM 584 N PHE A 63 19.722 14.504 -7.037 1.00 37.05 N ATOM 585 CA PHE A 63 18.817 14.243 -5.921 1.00 44.50 C ATOM 586 C PHE A 63 17.338 14.132 -6.294 1.00 44.28 C ATOM 587 O PHE A 63 16.471 14.197 -5.423 1.00 50.12 O ATOM 588 CB PHE A 63 18.997 15.308 -4.833 1.00 47.03 C ATOM 589 CG PHE A 63 18.893 16.721 -5.328 1.00 40.84 C ATOM 590 CD1 PHE A 63 17.656 17.322 -5.504 1.00 36.19 C ATOM 591 CD2 PHE A 63 20.036 17.460 -5.590 1.00 38.04 C ATOM 592 CE1 PHE A 63 17.560 18.627 -5.950 1.00 32.02 C ATOM 593 CE2 PHE A 63 19.944 18.771 -6.034 1.00 36.31 C ATOM 594 CZ PHE A 63 18.698 19.353 -6.215 1.00 30.90 C ATOM 595 H PHE A 63 19.979 15.481 -7.286 1.00 0.00 H ATOM 596 N MET A 64 17.054 13.952 -7.579 1.00 35.03 N ATOM 597 CA MET A 64 15.719 13.553 -8.010 1.00 29.89 C ATOM 598 C MET A 64 15.827 12.233 -8.778 1.00 30.66 C ATOM 599 O MET A 64 16.788 12.016 -9.510 1.00 30.39 O ATOM 600 CB MET A 64 15.057 14.656 -8.867 1.00 21.07 C ATOM 601 CG MET A 64 15.107 16.008 -8.212 1.00 29.96 C ATOM 602 SD MET A 64 13.894 17.183 -8.823 1.00 31.43 S ATOM 603 CE MET A 64 12.355 16.319 -8.512 1.00 24.52 C ATOM 604 H MET A 64 17.798 14.098 -8.291 1.00 0.00 H ATOM 605 N GLY A 65 14.872 11.330 -8.578 1.00 28.27 N ATOM 606 CA GLY A 65 14.743 10.171 -9.444 1.00 26.35 C ATOM 607 C GLY A 65 15.538 8.914 -9.134 1.00 25.53 C ATOM 608 O GLY A 65 15.682 8.050 -9.998 1.00 25.84 O ATOM 609 H GLY A 65 14.207 11.455 -7.789 1.00 0.00 H ATOM 610 N GLY A 66 16.042 8.783 -7.911 1.00 25.76 N ATOM 611 CA GLY A 66 16.756 7.577 -7.515 1.00 30.72 C ATOM 612 C GLY A 66 17.923 7.175 -8.405 1.00 30.94 C ATOM 613 O GLY A 66 18.681 8.023 -8.871 1.00 32.46 O ATOM 614 H GLY A 66 15.924 9.555 -7.225 1.00 0.00 H ATOM 615 N ASP A 67 18.065 5.873 -8.644 1.00 29.38 N ATOM 616 CA ASP A 67 19.148 5.351 -9.483 1.00 32.69 C ATOM 617 C ASP A 67 19.182 5.984 -10.869 1.00 30.43 C ATOM 618 O ASP A 67 20.250 6.280 -11.406 1.00 30.48 O ATOM 619 CB ASP A 67 19.025 3.831 -9.627 1.00 42.00 C ATOM 620 CG ASP A 67 19.853 3.080 -8.608 1.00 53.97 C ATOM 621 OD1 ASP A 67 20.900 3.612 -8.182 1.00 60.82 O ATOM 622 OD2 ASP A 67 19.463 1.950 -8.240 1.00 56.94 O ATOM 623 H ASP A 67 17.387 5.206 -8.223 1.00 0.00 H ATOM 624 N LEU A 68 18.008 6.184 -11.453 1.00 27.64 N ATOM 625 CA LEU A 68 17.925 6.758 -12.784 1.00 26.49 C ATOM 626 C LEU A 68 18.425 8.199 -12.765 1.00 23.52 C ATOM 627 O LEU A 68 18.969 8.689 -13.752 1.00 20.25 O ATOM 628 CB LEU A 68 16.494 6.684 -13.306 1.00 28.27 C ATOM 629 CG LEU A 68 16.327 6.703 -14.818 1.00 28.54 C ATOM 630 CD1 LEU A 68 17.256 5.670 -15.453 1.00 29.01 C ATOM 631 CD2 LEU A 68 14.877 6.417 -15.167 1.00 28.29 C ATOM 632 H LEU A 68 17.135 5.926 -10.950 1.00 0.00 H ATOM 633 N GLY A 69 18.238 8.870 -11.628 1.00 26.07 N ATOM 634 CA GLY A 69 18.720 10.229 -11.439 1.00 24.50 C ATOM 635 C GLY A 69 20.220 10.350 -11.632 1.00 22.50 C ATOM 636 O GLY A 69 20.683 11.267 -12.311 1.00 21.51 O ATOM 637 H GLY A 69 17.730 8.405 -10.849 1.00 0.00 H ATOM 638 N LYS A 70 20.977 9.419 -11.047 1.00 22.62 N ATOM 639 CA LYS A 70 22.431 9.388 -11.214 1.00 21.66 C ATOM 640 C LYS A 70 22.789 9.105 -12.666 1.00 20.08 C ATOM 641 O LYS A 70 23.707 9.719 -13.216 1.00 19.87 O ATOM 642 CB LYS A 70 23.074 8.334 -10.298 1.00 30.30 C ATOM 643 CG LYS A 70 23.271 8.800 -8.866 1.00 36.23 C ATOM 644 H LYS A 70 20.521 8.695 -10.456 1.00 0.00 H ATOM 645 N ASP A 71 22.049 8.188 -13.286 1.00 19.28 N ATOM 646 CA ASP A 71 22.293 7.824 -14.675 1.00 17.52 C ATOM 647 C ASP A 71 22.108 9.040 -15.578 1.00 18.62 C ATOM 648 O ASP A 71 22.879 9.253 -16.510 1.00 15.88 O ATOM 649 CB ASP A 71 21.361 6.688 -15.125 1.00 21.55 C ATOM 650 CG ASP A 71 21.743 5.336 -14.541 1.00 26.84 C ATOM 651 OD1 ASP A 71 22.927 5.131 -14.204 1.00 24.59 O ATOM 652 OD2 ASP A 71 20.851 4.466 -14.438 1.00 27.56 O ATOM 653 H ASP A 71 21.279 7.721 -12.766 1.00 0.00 H ATOM 654 N LEU A 72 21.082 9.840 -15.292 1.00 17.61 N ATOM 655 CA LEU A 72 20.807 11.027 -16.090 1.00 14.95 C ATOM 656 C LEU A 72 21.877 12.097 -15.912 1.00 12.83 C ATOM 657 O LEU A 72 22.196 12.822 -16.840 1.00 14.22 O ATOM 658 CB LEU A 72 19.428 11.591 -15.736 1.00 15.10 C ATOM 659 CG LEU A 72 18.320 10.729 -16.329 1.00 14.87 C ATOM 660 CD1 LEU A 72 17.001 10.958 -15.578 1.00 16.82 C ATOM 661 CD2 LEU A 72 18.179 11.027 -17.826 1.00 18.75 C ATOM 662 H LEU A 72 20.467 9.613 -14.485 1.00 0.00 H ATOM 663 N THR A 73 22.449 12.194 -14.722 1.00 13.86 N ATOM 664 CA THR A 73 23.576 13.101 -14.535 1.00 13.64 C ATOM 665 C THR A 73 24.788 12.657 -15.361 1.00 15.27 C ATOM 666 O THR A 73 25.502 13.483 -15.928 1.00 14.32 O ATOM 667 CB THR A 73 23.964 13.199 -13.052 1.00 17.21 C ATOM 668 OG1 THR A 73 22.851 13.730 -12.314 1.00 17.18 O ATOM 669 CG2 THR A 73 25.201 14.092 -12.866 1.00 16.71 C ATOM 670 HG1 THR A 73 23.093 13.796 -11.356 1.00 0.00 H ATOM 671 H THR A 73 22.097 11.627 -13.925 1.00 0.00 H ATOM 672 N GLN A 74 25.014 11.347 -15.433 1.00 16.79 N ATOM 673 CA GLN A 74 26.095 10.821 -16.259 1.00 15.06 C ATOM 674 C GLN A 74 25.774 11.022 -17.738 1.00 14.60 C ATOM 675 O GLN A 74 26.649 11.345 -18.536 1.00 15.36 O ATOM 676 CB GLN A 74 26.336 9.339 -15.951 1.00 16.14 C ATOM 677 CG GLN A 74 27.534 8.720 -16.680 1.00 16.99 C ATOM 678 CD GLN A 74 27.997 7.436 -16.029 1.00 21.23 C ATOM 679 OE1 GLN A 74 27.576 7.104 -14.917 1.00 20.09 O ATOM 680 NE2 GLN A 74 28.877 6.705 -16.712 1.00 23.99 N ATOM 681 HE22 GLN A 74 29.204 7.024 -17.646 1.00 0.00 H ATOM 682 HE21 GLN A 74 29.237 5.815 -16.311 1.00 0.00 H ATOM 683 H GLN A 74 24.413 10.691 -14.894 1.00 0.00 H ATOM 684 N ALA A 75 24.513 10.831 -18.099 1.00 14.15 N ATOM 685 CA ALA A 75 24.076 11.060 -19.464 1.00 13.86 C ATOM 686 C ALA A 75 24.238 12.532 -19.849 1.00 13.62 C ATOM 687 O ALA A 75 24.614 12.840 -20.976 1.00 14.25 O ATOM 688 CB ALA A 75 22.637 10.619 -19.632 1.00 16.76 C ATOM 689 H ALA A 75 23.823 10.511 -17.390 1.00 0.00 H ATOM 690 N TRP A 76 23.946 13.441 -18.921 1.00 12.68 N ATOM 691 CA TRP A 76 24.121 14.858 -19.229 1.00 13.37 C ATOM 692 C TRP A 76 25.600 15.176 -19.424 1.00 15.74 C ATOM 693 O TRP A 76 25.957 15.998 -20.277 1.00 15.03 O ATOM 694 CB TRP A 76 23.512 15.744 -18.139 1.00 15.24 C ATOM 695 CG TRP A 76 23.471 17.196 -18.509 1.00 12.75 C ATOM 696 CD1 TRP A 76 24.172 18.203 -17.933 1.00 12.48 C ATOM 697 CD2 TRP A 76 22.696 17.792 -19.557 1.00 11.52 C ATOM 698 NE1 TRP A 76 23.878 19.399 -18.543 1.00 14.01 N ATOM 699 CE2 TRP A 76 22.986 19.171 -19.558 1.00 14.35 C ATOM 700 CE3 TRP A 76 21.808 17.286 -20.513 1.00 13.45 C ATOM 701 CZ2 TRP A 76 22.383 20.063 -20.448 1.00 14.95 C ATOM 702 CZ3 TRP A 76 21.218 18.167 -21.404 1.00 14.77 C ATOM 703 CH2 TRP A 76 21.521 19.542 -21.372 1.00 11.89 C ATOM 704 HE1 TRP A 76 24.269 20.326 -18.278 1.00 0.00 H ATOM 705 H TRP A 76 23.597 13.145 -17.987 1.00 0.00 H ATOM 706 N ALA A 77 26.462 14.524 -18.642 1.00 14.16 N ATOM 707 CA ALA A 77 27.906 14.640 -18.851 1.00 16.14 C ATOM 708 C ALA A 77 28.283 14.192 -20.260 1.00 15.69 C ATOM 709 O ALA A 77 29.081 14.845 -20.933 1.00 14.98 O ATOM 710 CB ALA A 77 28.680 13.824 -17.803 1.00 16.03 C ATOM 711 H ALA A 77 26.103 13.924 -17.872 1.00 0.00 H ATOM 712 N VAL A 78 27.711 13.079 -20.710 1.00 16.38 N ATOM 713 CA VAL A 78 27.940 12.626 -22.079 1.00 15.27 C ATOM 714 C VAL A 78 27.491 13.693 -23.080 1.00 16.20 C ATOM 715 O VAL A 78 28.203 14.018 -24.033 1.00 16.65 O ATOM 716 CB VAL A 78 27.194 11.310 -22.379 1.00 16.08 C ATOM 717 CG1 VAL A 78 27.265 10.980 -23.863 1.00 16.28 C ATOM 718 CG2 VAL A 78 27.772 10.159 -21.554 1.00 17.22 C ATOM 719 H VAL A 78 27.095 12.526 -20.081 1.00 0.00 H ATOM 720 N ALA A 79 26.303 14.246 -22.854 1.00 15.67 N ATOM 721 CA ALA A 79 25.783 15.279 -23.758 1.00 13.88 C ATOM 722 C ALA A 79 26.705 16.508 -23.812 1.00 15.77 C ATOM 723 O ALA A 79 26.959 17.034 -24.890 1.00 15.62 O ATOM 724 CB ALA A 79 24.372 15.684 -23.353 1.00 13.03 C ATOM 725 H ALA A 79 25.740 13.945 -22.033 1.00 0.00 H ATOM 726 N MET A 80 27.217 16.954 -22.663 1.00 14.50 N ATOM 727 CA MET A 80 28.169 18.071 -22.638 1.00 15.00 C ATOM 728 C MET A 80 29.477 17.723 -23.352 1.00 18.15 C ATOM 729 O MET A 80 30.016 18.524 -24.115 1.00 18.83 O ATOM 730 CB MET A 80 28.453 18.498 -21.199 1.00 15.49 C ATOM 731 CG MET A 80 27.250 19.153 -20.522 1.00 14.82 C ATOM 732 SD MET A 80 27.659 19.834 -18.907 1.00 18.60 S ATOM 733 CE MET A 80 27.978 18.346 -17.971 1.00 17.57 C ATOM 734 H MET A 80 26.936 16.502 -21.769 1.00 0.00 H ATOM 735 N ALA A 81 29.983 16.521 -23.100 1.00 17.41 N ATOM 736 CA ALA A 81 31.225 16.065 -23.725 1.00 17.91 C ATOM 737 C ALA A 81 31.123 15.963 -25.252 1.00 20.39 C ATOM 738 O ALA A 81 32.080 16.275 -25.965 1.00 21.25 O ATOM 739 CB ALA A 81 31.634 14.718 -23.138 1.00 18.40 C ATOM 740 H ALA A 81 29.484 15.888 -22.442 1.00 0.00 H ATOM 741 N LEU A 82 29.971 15.512 -25.744 1.00 19.01 N ATOM 742 CA LEU A 82 29.762 15.344 -27.174 1.00 20.94 C ATOM 743 C LEU A 82 29.196 16.611 -27.813 1.00 22.32 C ATOM 744 O LEU A 82 29.167 16.745 -29.040 1.00 24.39 O ATOM 745 CB LEU A 82 28.830 14.164 -27.438 1.00 21.87 C ATOM 746 CG LEU A 82 29.343 12.790 -27.004 1.00 22.44 C ATOM 747 CD1 LEU A 82 28.356 11.712 -27.427 1.00 26.80 C ATOM 748 CD2 LEU A 82 30.744 12.515 -27.565 1.00 30.10 C ATOM 749 H LEU A 82 29.200 15.273 -25.088 1.00 0.00 H ATOM 750 N GLY A 83 28.761 17.542 -26.975 1.00 19.37 N ATOM 751 CA GLY A 83 28.176 18.779 -27.453 1.00 23.16 C ATOM 752 C GLY A 83 26.827 18.583 -28.121 1.00 22.96 C ATOM 753 O GLY A 83 26.518 19.235 -29.118 1.00 23.22 O ATOM 754 H GLY A 83 28.841 17.381 -25.951 1.00 0.00 H ATOM 755 N VAL A 84 26.010 17.700 -27.561 1.00 21.06 N ATOM 756 CA VAL A 84 24.712 17.397 -28.148 1.00 20.34 C ATOM 757 C VAL A 84 23.556 17.690 -27.196 1.00 16.78 C ATOM 758 O VAL A 84 22.480 17.094 -27.327 1.00 16.36 O ATOM 759 CB VAL A 84 24.642 15.920 -28.593 1.00 18.42 C ATOM 760 CG1 VAL A 84 25.637 15.662 -29.719 1.00 18.45 C ATOM 761 CG2 VAL A 84 24.912 14.995 -27.405 1.00 18.47 C ATOM 762 H VAL A 84 26.302 17.216 -26.688 1.00 0.00 H ATOM 763 N GLU A 85 23.782 18.590 -26.237 1.00 15.36 N ATOM 764 CA GLU A 85 22.745 19.009 -25.295 1.00 16.81 C ATOM 765 C GLU A 85 21.435 19.325 -26.010 1.00 18.57 C ATOM 766 O GLU A 85 20.372 18.859 -25.597 1.00 16.84 O ATOM 767 CB GLU A 85 23.193 20.235 -24.487 1.00 20.18 C ATOM 768 CG GLU A 85 24.440 20.013 -23.638 1.00 17.85 C ATOM 769 CD GLU A 85 25.718 20.503 -24.308 1.00 22.03 C ATOM 770 OE1 GLU A 85 25.844 20.405 -25.553 1.00 20.93 O ATOM 771 OE2 GLU A 85 26.607 20.995 -23.579 1.00 22.16 O ATOM 772 H GLU A 85 24.731 19.009 -26.157 1.00 0.00 H ATOM 773 N ASP A 86 21.511 20.097 -27.088 1.00 19.14 N ATOM 774 CA ASP A 86 20.299 20.543 -27.766 1.00 18.66 C ATOM 775 C ASP A 86 19.591 19.431 -28.518 1.00 18.86 C ATOM 776 O ASP A 86 18.442 19.594 -28.936 1.00 23.65 O ATOM 777 CB ASP A 86 20.614 21.685 -28.729 1.00 24.05 C ATOM 778 CG ASP A 86 21.061 22.931 -28.010 1.00 28.88 C ATOM 779 OD1 ASP A 86 20.832 23.016 -26.780 1.00 28.28 O ATOM 780 OD2 ASP A 86 21.640 23.818 -28.674 1.00 34.20 O ATOM 781 H ASP A 86 22.442 20.386 -27.451 1.00 0.00 H ATOM 782 N LYS A 87 20.273 18.309 -28.716 1.00 18.46 N ATOM 783 CA LYS A 87 19.656 17.183 -29.401 1.00 17.58 C ATOM 784 C LYS A 87 18.873 16.288 -28.449 1.00 17.46 C ATOM 785 O LYS A 87 17.928 15.617 -28.864 1.00 19.69 O ATOM 786 CB LYS A 87 20.708 16.332 -30.119 1.00 21.61 C ATOM 787 CG LYS A 87 21.413 17.000 -31.273 1.00 27.00 C ATOM 788 CD LYS A 87 22.420 16.039 -31.903 1.00 31.28 C ATOM 789 CE LYS A 87 23.216 16.702 -33.011 1.00 42.55 C ATOM 790 NZ LYS A 87 22.343 17.055 -34.156 1.00 54.32 N ATOM 791 HZ1 LYS A 87 21.902 16.192 -34.533 1.00 0.00 H ATOM 792 HZ2 LYS A 87 21.604 17.713 -33.837 1.00 0.00 H ATOM 793 HZ3 LYS A 87 22.914 17.507 -34.899 1.00 0.00 H ATOM 794 H LYS A 87 21.254 18.234 -28.379 1.00 0.00 H ATOM 795 N VAL A 88 19.282 16.247 -27.182 1.00 14.89 N ATOM 796 CA VAL A 88 18.703 15.266 -26.271 1.00 13.62 C ATOM 797 C VAL A 88 17.837 15.856 -25.160 1.00 14.89 C ATOM 798 O VAL A 88 17.109 15.117 -24.502 1.00 15.47 O ATOM 799 CB VAL A 88 19.805 14.380 -25.621 1.00 14.57 C ATOM 800 CG1 VAL A 88 20.552 13.622 -26.703 1.00 16.25 C ATOM 801 CG2 VAL A 88 20.767 15.210 -24.778 1.00 16.23 C ATOM 802 H VAL A 88 20.009 16.910 -26.845 1.00 0.00 H ATOM 803 N THR A 89 17.891 17.169 -24.952 1.00 14.11 N ATOM 804 CA THR A 89 17.119 17.757 -23.847 1.00 13.01 C ATOM 805 C THR A 89 15.618 17.455 -23.939 1.00 13.89 C ATOM 806 O THR A 89 15.017 17.004 -22.952 1.00 14.54 O ATOM 807 CB THR A 89 17.314 19.274 -23.753 1.00 16.50 C ATOM 808 OG1 THR A 89 18.660 19.543 -23.363 1.00 16.42 O ATOM 809 CG2 THR A 89 16.389 19.848 -22.689 1.00 18.51 C ATOM 810 HG1 THR A 89 19.279 19.166 -24.037 1.00 0.00 H ATOM 811 H THR A 89 18.474 17.774 -25.565 1.00 0.00 H ATOM 812 N VAL A 90 15.014 17.677 -25.106 1.00 12.52 N ATOM 813 CA VAL A 90 13.580 17.435 -25.230 1.00 14.48 C ATOM 814 C VAL A 90 13.216 15.948 -25.084 1.00 13.10 C ATOM 815 O VAL A 90 12.354 15.623 -24.258 1.00 14.47 O ATOM 816 CB VAL A 90 13.006 17.989 -26.558 1.00 16.84 C ATOM 817 CG1 VAL A 90 11.632 17.394 -26.831 1.00 14.18 C ATOM 818 CG2 VAL A 90 12.943 19.506 -26.506 1.00 16.81 C ATOM 819 H VAL A 90 15.560 18.020 -25.922 1.00 0.00 H ATOM 820 N PRO A 91 13.868 15.040 -25.835 1.00 13.60 N ATOM 821 CA PRO A 91 13.427 13.644 -25.671 1.00 14.50 C ATOM 822 C PRO A 91 13.735 13.065 -24.274 1.00 13.49 C ATOM 823 O PRO A 91 13.028 12.161 -23.841 1.00 14.92 O ATOM 824 CB PRO A 91 14.195 12.892 -26.768 1.00 17.76 C ATOM 825 CG PRO A 91 15.364 13.780 -27.110 1.00 18.55 C ATOM 826 CD PRO A 91 14.824 15.181 -26.951 1.00 14.53 C ATOM 827 N LEU A 92 14.742 13.575 -23.580 1.00 12.02 N ATOM 828 CA LEU A 92 14.966 13.132 -22.209 1.00 11.59 C ATOM 829 C LEU A 92 13.865 13.663 -21.281 1.00 12.23 C ATOM 830 O LEU A 92 13.308 12.901 -20.493 1.00 14.56 O ATOM 831 CB LEU A 92 16.349 13.565 -21.706 1.00 12.37 C ATOM 832 CG LEU A 92 17.509 12.791 -22.350 1.00 13.16 C ATOM 833 CD1 LEU A 92 18.854 13.356 -21.932 1.00 12.72 C ATOM 834 CD2 LEU A 92 17.460 11.300 -22.011 1.00 15.82 C ATOM 835 H LEU A 92 15.368 14.286 -24.010 1.00 0.00 H ATOM 836 N PHE A 93 13.541 14.948 -21.381 1.00 12.42 N ATOM 837 CA PHE A 93 12.436 15.484 -20.573 1.00 12.15 C ATOM 838 C PHE A 93 11.118 14.744 -20.821 1.00 11.96 C ATOM 839 O PHE A 93 10.399 14.388 -19.874 1.00 12.79 O ATOM 840 CB PHE A 93 12.234 16.985 -20.843 1.00 11.88 C ATOM 841 CG PHE A 93 12.938 17.883 -19.860 1.00 14.17 C ATOM 842 CD1 PHE A 93 12.636 17.815 -18.498 1.00 14.62 C ATOM 843 CD2 PHE A 93 13.869 18.824 -20.292 1.00 12.23 C ATOM 844 CE1 PHE A 93 13.288 18.638 -17.575 1.00 13.08 C ATOM 845 CE2 PHE A 93 14.510 19.651 -19.384 1.00 10.41 C ATOM 846 CZ PHE A 93 14.210 19.566 -18.021 1.00 10.03 C ATOM 847 H PHE A 93 14.066 15.571 -22.027 1.00 0.00 H ATOM 848 N GLU A 94 10.785 14.537 -22.089 1.00 11.73 N ATOM 849 CA GLU A 94 9.524 13.901 -22.423 1.00 12.77 C ATOM 850 C GLU A 94 9.549 12.416 -22.053 1.00 12.53 C ATOM 851 O GLU A 94 8.558 11.886 -21.536 1.00 13.50 O ATOM 852 CB GLU A 94 9.198 14.124 -23.902 1.00 13.19 C ATOM 853 CG GLU A 94 9.054 15.622 -24.211 1.00 16.56 C ATOM 854 CD GLU A 94 8.395 15.917 -25.545 1.00 24.62 C ATOM 855 OE1 GLU A 94 8.243 14.992 -26.373 1.00 25.52 O ATOM 856 OE2 GLU A 94 8.022 17.092 -25.772 1.00 19.83 O ATOM 857 H GLU A 94 11.432 14.832 -22.848 1.00 0.00 H ATOM 858 N GLY A 95 10.686 11.759 -22.265 1.00 13.19 N ATOM 859 CA GLY A 95 10.829 10.358 -21.899 1.00 14.70 C ATOM 860 C GLY A 95 10.645 10.124 -20.402 1.00 15.61 C ATOM 861 O GLY A 95 10.050 9.129 -19.986 1.00 15.70 O ATOM 862 H GLY A 95 11.489 12.256 -22.701 1.00 0.00 H ATOM 863 N VAL A 96 11.150 11.039 -19.586 1.00 12.56 N ATOM 864 CA VAL A 96 10.970 10.928 -18.146 1.00 13.10 C ATOM 865 C VAL A 96 9.574 11.356 -17.679 1.00 14.11 C ATOM 866 O VAL A 96 8.895 10.599 -16.984 1.00 15.34 O ATOM 867 CB VAL A 96 12.036 11.745 -17.400 1.00 13.04 C ATOM 868 CG1 VAL A 96 11.777 11.707 -15.887 1.00 15.44 C ATOM 869 CG2 VAL A 96 13.418 11.157 -17.706 1.00 12.71 C ATOM 870 H VAL A 96 11.680 11.843 -19.979 1.00 0.00 H ATOM 871 N GLN A 97 9.128 12.542 -18.080 1.00 12.05 N ATOM 872 CA GLN A 97 7.930 13.114 -17.464 1.00 12.57 C ATOM 873 C GLN A 97 6.646 12.986 -18.282 1.00 13.53 C ATOM 874 O GLN A 97 5.553 12.960 -17.718 1.00 16.75 O ATOM 875 CB GLN A 97 8.163 14.590 -17.146 1.00 12.50 C ATOM 876 CG GLN A 97 9.232 14.834 -16.091 1.00 11.60 C ATOM 877 CD GLN A 97 9.307 16.281 -15.675 1.00 13.17 C ATOM 878 OE1 GLN A 97 8.280 16.909 -15.388 1.00 17.19 O ATOM 879 NE2 GLN A 97 10.522 16.818 -15.610 1.00 13.57 N ATOM 880 HE22 GLN A 97 11.356 16.250 -15.862 1.00 0.00 H ATOM 881 HE21 GLN A 97 10.638 17.806 -15.308 1.00 0.00 H ATOM 882 H GLN A 97 9.629 13.062 -18.829 1.00 0.00 H ATOM 883 N LYS A 98 6.758 12.957 -19.602 1.00 14.70 N ATOM 884 CA LYS A 98 5.548 12.932 -20.422 1.00 14.99 C ATOM 885 C LYS A 98 5.083 11.507 -20.721 1.00 14.75 C ATOM 886 O LYS A 98 3.973 11.129 -20.369 1.00 14.92 O ATOM 887 CB LYS A 98 5.772 13.707 -21.722 1.00 13.99 C ATOM 888 CG LYS A 98 4.519 13.788 -22.598 1.00 15.45 C ATOM 889 CD LYS A 98 4.824 14.531 -23.887 1.00 22.18 C ATOM 890 CE LYS A 98 3.608 14.553 -24.804 1.00 24.34 C ATOM 891 NZ LYS A 98 3.931 15.170 -26.127 1.00 30.28 N ATOM 892 HZ1 LYS A 98 4.253 16.148 -25.983 1.00 0.00 H ATOM 893 HZ2 LYS A 98 4.683 14.621 -26.590 1.00 0.00 H ATOM 894 HZ3 LYS A 98 3.081 15.168 -26.726 1.00 0.00 H ATOM 895 H LYS A 98 7.697 12.952 -20.050 1.00 0.00 H ATOM 896 N THR A 99 5.935 10.714 -21.368 1.00 14.57 N ATOM 897 CA THR A 99 5.569 9.359 -21.761 1.00 16.09 C ATOM 898 C THR A 99 5.981 8.314 -20.723 1.00 18.70 C ATOM 899 O THR A 99 5.455 7.203 -20.730 1.00 19.31 O ATOM 900 CB THR A 99 6.210 8.969 -23.110 1.00 17.74 C ATOM 901 OG1 THR A 99 7.633 9.038 -22.991 1.00 17.81 O ATOM 902 CG2 THR A 99 5.749 9.909 -24.218 1.00 20.85 C ATOM 903 HG1 THR A 99 8.048 8.788 -23.855 1.00 0.00 H ATOM 904 H THR A 99 6.885 11.070 -21.598 1.00 0.00 H ATOM 905 N GLN A 100 6.916 8.691 -19.844 1.00 17.96 N ATOM 906 CA GLN A 100 7.457 7.805 -18.805 1.00 19.81 C ATOM 907 C GLN A 100 8.018 6.521 -19.423 1.00 22.11 C ATOM 908 O GLN A 100 7.835 5.426 -18.896 1.00 27.15 O ATOM 909 CB GLN A 100 6.392 7.477 -17.744 1.00 18.82 C ATOM 910 CG GLN A 100 5.826 8.722 -17.079 1.00 19.58 C ATOM 911 CD GLN A 100 4.890 8.408 -15.929 1.00 24.67 C ATOM 912 OE1 GLN A 100 4.344 7.309 -15.830 1.00 31.42 O ATOM 913 NE2 GLN A 100 4.704 9.383 -15.053 1.00 26.64 N ATOM 914 HE22 GLN A 100 5.188 10.295 -15.179 1.00 0.00 H ATOM 915 HE21 GLN A 100 4.074 9.237 -14.238 1.00 0.00 H ATOM 916 H GLN A 100 7.279 9.664 -19.899 1.00 0.00 H ATOM 917 N THR A 101 8.696 6.667 -20.557 1.00 16.77 N ATOM 918 CA THR A 101 9.297 5.522 -21.230 1.00 21.29 C ATOM 919 C THR A 101 10.768 5.357 -20.872 1.00 25.32 C ATOM 920 O THR A 101 11.407 4.378 -21.263 1.00 26.44 O ATOM 921 CB THR A 101 9.164 5.631 -22.757 1.00 21.56 C ATOM 922 OG1 THR A 101 9.534 6.948 -23.175 1.00 23.04 O ATOM 923 CG2 THR A 101 7.737 5.352 -23.185 1.00 23.20 C ATOM 924 HG1 THR A 101 8.938 7.610 -22.743 1.00 0.00 H ATOM 925 H THR A 101 8.800 7.615 -20.972 1.00 0.00 H ATOM 926 N ILE A 102 11.308 6.314 -20.132 1.00 19.72 N ATOM 927 CA ILE A 102 12.687 6.210 -19.691 1.00 20.25 C ATOM 928 C ILE A 102 12.707 5.611 -18.285 1.00 22.30 C ATOM 929 O ILE A 102 12.323 6.255 -17.310 1.00 22.20 O ATOM 930 CB ILE A 102 13.398 7.574 -19.735 1.00 17.82 C ATOM 931 CG1 ILE A 102 13.527 8.031 -21.197 1.00 21.30 C ATOM 932 CG2 ILE A 102 14.762 7.493 -19.049 1.00 19.29 C ATOM 933 CD1 ILE A 102 14.247 9.361 -21.398 1.00 19.28 C ATOM 934 H ILE A 102 10.741 7.144 -19.866 1.00 0.00 H ATOM 935 N ARG A 103 13.133 4.354 -18.201 1.00 22.49 N ATOM 936 CA ARG A 103 13.099 3.612 -16.944 1.00 26.56 C ATOM 937 C ARG A 103 14.466 3.039 -16.578 1.00 29.10 C ATOM 938 O ARG A 103 14.696 2.650 -15.434 1.00 33.09 O ATOM 939 CB ARG A 103 12.049 2.491 -17.032 1.00 28.56 C ATOM 940 CG ARG A 103 10.689 3.008 -17.499 1.00 34.91 C ATOM 941 CD ARG A 103 9.603 1.960 -17.434 1.00 45.60 C ATOM 942 NE ARG A 103 8.283 2.585 -17.496 1.00 52.78 N ATOM 943 CZ ARG A 103 7.422 2.615 -16.482 1.00 58.02 C ATOM 944 NH1 ARG A 103 7.735 2.043 -15.325 1.00 59.42 N ATOM 945 NH2 ARG A 103 6.245 3.213 -16.626 1.00 58.62 N ATOM 946 HE ARG A 103 7.999 3.035 -18.390 1.00 0.00 H ATOM 947 HH12 ARG A 103 7.061 2.067 -14.534 1.00 0.00 H ATOM 948 HH11 ARG A 103 8.654 1.571 -15.210 1.00 0.00 H ATOM 949 HH22 ARG A 103 5.573 3.236 -15.833 1.00 0.00 H ATOM 950 HH21 ARG A 103 5.995 3.658 -17.532 1.00 0.00 H ATOM 951 H ARG A 103 13.501 3.887 -19.054 1.00 0.00 H ATOM 952 N SER A 104 15.377 3.000 -17.547 1.00 26.96 N ATOM 953 CA SER A 104 16.707 2.440 -17.314 1.00 28.68 C ATOM 954 C SER A 104 17.767 3.168 -18.129 1.00 21.66 C ATOM 955 O SER A 104 17.442 3.953 -19.021 1.00 19.59 O ATOM 956 CB SER A 104 16.738 0.951 -17.661 1.00 30.18 C ATOM 957 OG SER A 104 16.664 0.771 -19.065 1.00 32.03 O ATOM 958 HG SER A 104 15.821 1.165 -19.403 1.00 0.00 H ATOM 959 H SER A 104 15.138 3.375 -18.487 1.00 0.00 H ATOM 960 N ALA A 105 19.030 2.882 -17.830 1.00 23.20 N ATOM 961 CA ALA A 105 20.155 3.443 -18.572 1.00 19.14 C ATOM 962 C ALA A 105 20.045 3.122 -20.065 1.00 21.20 C ATOM 963 O ALA A 105 20.400 3.948 -20.909 1.00 21.62 O ATOM 964 CB ALA A 105 21.476 2.924 -18.006 1.00 24.53 C ATOM 965 H ALA A 105 19.224 2.235 -17.039 1.00 0.00 H ATOM 966 N SER A 106 19.563 1.924 -20.378 1.00 22.59 N ATOM 967 CA SER A 106 19.368 1.514 -21.765 1.00 24.77 C ATOM 968 C SER A 106 18.388 2.445 -22.476 1.00 22.35 C ATOM 969 O SER A 106 18.594 2.809 -23.637 1.00 23.62 O ATOM 970 CB SER A 106 18.871 0.065 -21.831 1.00 27.88 C ATOM 971 OG SER A 106 18.690 -0.361 -23.170 1.00 29.81 O ATOM 972 HG SER A 106 18.022 0.221 -23.613 1.00 0.00 H ATOM 973 H SER A 106 19.318 1.261 -19.615 1.00 0.00 H ATOM 974 N ASP A 107 17.325 2.833 -21.778 1.00 20.57 N ATOM 975 CA ASP A 107 16.323 3.729 -22.356 1.00 18.61 C ATOM 976 C ASP A 107 16.939 5.093 -22.635 1.00 18.26 C ATOM 977 O ASP A 107 16.582 5.768 -23.603 1.00 20.66 O ATOM 978 CB ASP A 107 15.117 3.891 -21.430 1.00 20.83 C ATOM 979 CG ASP A 107 14.343 2.603 -21.256 1.00 25.41 C ATOM 980 OD1 ASP A 107 14.351 1.765 -22.190 1.00 28.04 O ATOM 981 OD2 ASP A 107 13.741 2.428 -20.181 1.00 25.73 O ATOM 982 H ASP A 107 17.203 2.493 -20.803 1.00 0.00 H ATOM 983 N ILE A 108 17.855 5.500 -21.764 1.00 18.44 N ATOM 984 CA ILE A 108 18.569 6.757 -21.954 1.00 18.67 C ATOM 985 C ILE A 108 19.456 6.640 -23.186 1.00 19.77 C ATOM 986 O ILE A 108 19.482 7.533 -24.027 1.00 18.03 O ATOM 987 CB ILE A 108 19.403 7.118 -20.720 1.00 16.82 C ATOM 988 CG1 ILE A 108 18.488 7.334 -19.516 1.00 19.49 C ATOM 989 CG2 ILE A 108 20.254 8.360 -20.974 1.00 18.34 C ATOM 990 CD1 ILE A 108 19.254 7.522 -18.212 1.00 21.14 C ATOM 991 H ILE A 108 18.067 4.912 -20.932 1.00 0.00 H ATOM 992 N ARG A 109 20.163 5.517 -23.302 1.00 17.73 N ATOM 993 CA ARG A 109 20.987 5.263 -24.469 1.00 19.56 C ATOM 994 C ARG A 109 20.156 5.338 -25.749 1.00 22.86 C ATOM 995 O ARG A 109 20.577 5.955 -26.724 1.00 21.23 O ATOM 996 CB ARG A 109 21.670 3.901 -24.363 1.00 21.01 C ATOM 997 CG ARG A 109 22.695 3.625 -25.453 1.00 24.00 C ATOM 998 CD ARG A 109 23.455 2.338 -25.137 1.00 24.90 C ATOM 999 NE ARG A 109 24.464 1.990 -26.144 1.00 25.68 N ATOM 1000 CZ ARG A 109 24.197 1.343 -27.274 1.00 29.91 C ATOM 1001 NH1 ARG A 109 22.950 0.986 -27.552 1.00 32.99 N ATOM 1002 NH2 ARG A 109 25.171 1.062 -28.132 1.00 31.10 N ATOM 1003 HE ARG A 109 25.450 2.267 -25.962 1.00 0.00 H ATOM 1004 HH12 ARG A 109 22.739 0.480 -28.436 1.00 0.00 H ATOM 1005 HH11 ARG A 109 22.184 1.212 -26.886 1.00 0.00 H ATOM 1006 HH22 ARG A 109 24.956 0.556 -29.015 1.00 0.00 H ATOM 1007 HH21 ARG A 109 26.148 1.348 -27.921 1.00 0.00 H ATOM 1008 H ARG A 109 20.124 4.809 -22.542 1.00 0.00 H ATOM 1009 N ASP A 110 18.969 4.732 -25.733 1.00 23.29 N ATOM 1010 CA ASP A 110 18.090 4.741 -26.898 1.00 23.14 C ATOM 1011 C ASP A 110 17.761 6.156 -27.353 1.00 21.08 C ATOM 1012 O ASP A 110 17.676 6.424 -28.548 1.00 23.50 O ATOM 1013 CB ASP A 110 16.780 4.000 -26.610 1.00 22.23 C ATOM 1014 CG ASP A 110 16.972 2.510 -26.441 1.00 27.41 C ATOM 1015 OD1 ASP A 110 18.004 1.976 -26.903 1.00 32.19 O ATOM 1016 OD2 ASP A 110 16.078 1.872 -25.849 1.00 35.78 O ATOM 1017 H ASP A 110 18.662 4.241 -24.869 1.00 0.00 H ATOM 1018 N VAL A 111 17.565 7.056 -26.399 1.00 18.21 N ATOM 1019 CA VAL A 111 17.247 8.432 -26.739 1.00 16.83 C ATOM 1020 C VAL A 111 18.398 9.070 -27.510 1.00 17.99 C ATOM 1021 O VAL A 111 18.178 9.737 -28.519 1.00 19.27 O ATOM 1022 CB VAL A 111 16.922 9.267 -25.487 1.00 17.88 C ATOM 1023 CG1 VAL A 111 17.076 10.756 -25.772 1.00 21.37 C ATOM 1024 CG2 VAL A 111 15.509 8.946 -24.999 1.00 19.44 C ATOM 1025 H VAL A 111 17.639 6.775 -25.401 1.00 0.00 H ATOM 1026 N PHE A 112 19.628 8.851 -27.051 1.00 17.46 N ATOM 1027 CA PHE A 112 20.789 9.385 -27.760 1.00 20.83 C ATOM 1028 C PHE A 112 20.901 8.799 -29.177 1.00 22.09 C ATOM 1029 O PHE A 112 21.141 9.529 -30.141 1.00 22.83 O ATOM 1030 CB PHE A 112 22.073 9.122 -26.967 1.00 16.67 C ATOM 1031 CG PHE A 112 22.307 10.107 -25.845 1.00 16.54 C ATOM 1032 CD1 PHE A 112 21.499 10.103 -24.718 1.00 16.45 C ATOM 1033 CD2 PHE A 112 23.346 11.022 -25.919 1.00 18.59 C ATOM 1034 CE1 PHE A 112 21.715 11.002 -23.674 1.00 16.41 C ATOM 1035 CE2 PHE A 112 23.581 11.924 -24.884 1.00 17.50 C ATOM 1036 CZ PHE A 112 22.756 11.917 -23.758 1.00 15.26 C ATOM 1037 H PHE A 112 19.764 8.296 -26.182 1.00 0.00 H ATOM 1038 N ILE A 113 20.713 7.485 -29.297 1.00 18.97 N ATOM 1039 CA ILE A 113 20.716 6.815 -30.605 1.00 25.59 C ATOM 1040 C ILE A 113 19.708 7.455 -31.552 1.00 25.02 C ATOM 1041 O ILE A 113 20.031 7.782 -32.693 1.00 25.77 O ATOM 1042 CB ILE A 113 20.368 5.312 -30.492 1.00 30.81 C ATOM 1043 CG1 ILE A 113 21.251 4.623 -29.457 1.00 37.34 C ATOM 1044 CG2 ILE A 113 20.500 4.625 -31.852 1.00 29.76 C ATOM 1045 CD1 ILE A 113 22.678 4.569 -29.842 1.00 37.83 C ATOM 1046 H ILE A 113 20.560 6.917 -28.439 1.00 0.00 H ATOM 1047 N ASN A 114 18.489 7.644 -31.059 1.00 24.42 N ATOM 1048 CA ASN A 114 17.412 8.191 -31.879 1.00 26.84 C ATOM 1049 C ASN A 114 17.612 9.656 -32.236 1.00 29.11 C ATOM 1050 O ASN A 114 17.085 10.135 -33.240 1.00 31.83 O ATOM 1051 CB ASN A 114 16.075 8.002 -31.175 1.00 30.19 C ATOM 1052 CG ASN A 114 15.529 6.612 -31.365 1.00 36.85 C ATOM 1053 OD1 ASN A 114 15.531 6.086 -32.480 1.00 41.35 O ATOM 1054 ND2 ASN A 114 15.077 5.996 -30.281 1.00 37.92 N ATOM 1055 HD22 ASN A 114 15.096 6.481 -29.361 1.00 0.00 H ATOM 1056 HD21 ASN A 114 14.704 5.028 -30.351 1.00 0.00 H ATOM 1057 H ASN A 114 18.298 7.397 -30.067 1.00 0.00 H ATOM 1058 N ALA A 115 18.385 10.357 -31.416 1.00 23.57 N ATOM 1059 CA ALA A 115 18.720 11.751 -31.681 1.00 28.11 C ATOM 1060 C ALA A 115 19.917 11.874 -32.631 1.00 32.52 C ATOM 1061 O ALA A 115 20.381 12.979 -32.910 1.00 37.67 O ATOM 1062 CB ALA A 115 19.003 12.481 -30.381 1.00 24.96 C ATOM 1063 H ALA A 115 18.762 9.900 -30.561 1.00 0.00 H ATOM 1064 N GLY A 116 20.423 10.740 -33.113 1.00 27.90 N ATOM 1065 CA GLY A 116 21.473 10.746 -34.116 1.00 28.94 C ATOM 1066 C GLY A 116 22.880 10.478 -33.607 1.00 28.39 C ATOM 1067 O GLY A 116 23.834 10.459 -34.391 1.00 33.99 O ATOM 1068 H GLY A 116 20.058 9.831 -32.764 1.00 0.00 H ATOM 1069 N ILE A 117 23.025 10.270 -32.303 1.00 28.11 N ATOM 1070 CA ILE A 117 24.340 9.965 -31.746 1.00 25.60 C ATOM 1071 C ILE A 117 24.666 8.493 -32.005 1.00 29.57 C ATOM 1072 O ILE A 117 23.887 7.604 -31.651 1.00 31.88 O ATOM 1073 CB ILE A 117 24.419 10.270 -30.226 1.00 23.32 C ATOM 1074 CG1 ILE A 117 24.355 11.780 -29.956 1.00 24.04 C ATOM 1075 CG2 ILE A 117 25.689 9.684 -29.617 1.00 25.95 C ATOM 1076 CD1 ILE A 117 22.962 12.365 -29.973 1.00 28.55 C ATOM 1077 H ILE A 117 22.198 10.325 -31.675 1.00 0.00 H ATOM 1078 N LYS A 118 25.802 8.240 -32.647 1.00 28.97 N ATOM 1079 CA LYS A 118 26.238 6.875 -32.922 1.00 32.86 C ATOM 1080 C LYS A 118 26.420 6.096 -31.622 1.00 33.55 C ATOM 1081 O LYS A 118 27.011 6.604 -30.671 1.00 30.17 O ATOM 1082 CB LYS A 118 27.545 6.875 -33.721 1.00 38.17 C ATOM 1083 CG LYS A 118 27.476 7.628 -35.041 1.00 40.93 C ATOM 1084 CD LYS A 118 26.691 6.863 -36.090 1.00 47.16 C ATOM 1085 H LYS A 118 26.395 9.035 -32.961 1.00 0.00 H ATOM 1086 N GLY A 119 25.904 4.871 -31.592 1.00 30.61 N ATOM 1087 CA GLY A 119 25.994 4.014 -30.422 1.00 28.50 C ATOM 1088 C GLY A 119 27.397 3.852 -29.873 1.00 32.81 C ATOM 1089 O GLY A 119 27.613 3.960 -28.662 1.00 27.64 O ATOM 1090 H GLY A 119 25.417 4.512 -32.438 1.00 0.00 H ATOM 1091 N GLU A 120 28.352 3.599 -30.762 1.00 33.43 N ATOM 1092 CA GLU A 120 29.746 3.439 -30.359 1.00 32.38 C ATOM 1093 C GLU A 120 30.277 4.700 -29.684 1.00 31.65 C ATOM 1094 O GLU A 120 31.011 4.623 -28.695 1.00 31.59 O ATOM 1095 CB GLU A 120 30.619 3.081 -31.567 1.00 29.78 C ATOM 1096 H GLU A 120 28.101 3.513 -31.767 1.00 0.00 H ATOM 1097 N GLU A 121 29.893 5.861 -30.212 1.00 26.87 N ATOM 1098 CA GLU A 121 30.344 7.129 -29.659 1.00 24.90 C ATOM 1099 C GLU A 121 29.735 7.354 -28.281 1.00 25.88 C ATOM 1100 O GLU A 121 30.401 7.861 -27.377 1.00 24.32 O ATOM 1101 CB GLU A 121 29.994 8.290 -30.596 1.00 30.98 C ATOM 1102 CG GLU A 121 30.764 8.279 -31.918 1.00 36.58 C ATOM 1103 H GLU A 121 29.258 5.861 -31.036 1.00 0.00 H ATOM 1104 N TYR A 122 28.469 6.982 -28.125 1.00 26.30 N ATOM 1105 CA TYR A 122 27.795 7.142 -26.841 1.00 20.51 C ATOM 1106 C TYR A 122 28.454 6.284 -25.768 1.00 24.06 C ATOM 1107 O TYR A 122 28.734 6.752 -24.665 1.00 22.34 O ATOM 1108 CB TYR A 122 26.316 6.778 -26.942 1.00 20.76 C ATOM 1109 CG TYR A 122 25.589 6.923 -25.625 1.00 20.00 C ATOM 1110 CD1 TYR A 122 25.072 8.147 -25.231 1.00 18.18 C ATOM 1111 CD2 TYR A 122 25.422 5.835 -24.773 1.00 22.39 C ATOM 1112 CE1 TYR A 122 24.405 8.287 -24.029 1.00 18.67 C ATOM 1113 CE2 TYR A 122 24.764 5.962 -23.565 1.00 21.44 C ATOM 1114 CZ TYR A 122 24.256 7.189 -23.198 1.00 19.63 C ATOM 1115 OH TYR A 122 23.592 7.332 -22.009 1.00 19.44 O ATOM 1116 HH TYR A 122 22.802 6.735 -21.999 1.00 0.00 H ATOM 1117 H TYR A 122 27.952 6.571 -28.929 1.00 0.00 H ATOM 1118 N ASP A 123 28.686 5.020 -26.094 1.00 27.25 N ATOM 1119 CA ASP A 123 29.260 4.084 -25.135 1.00 26.31 C ATOM 1120 C ASP A 123 30.672 4.497 -24.721 1.00 24.54 C ATOM 1121 O ASP A 123 31.030 4.421 -23.542 1.00 24.31 O ATOM 1122 CB ASP A 123 29.267 2.667 -25.713 1.00 27.75 C ATOM 1123 CG ASP A 123 27.866 2.134 -25.973 1.00 25.53 C ATOM 1124 OD1 ASP A 123 26.902 2.665 -25.377 1.00 26.76 O ATOM 1125 OD2 ASP A 123 27.733 1.182 -26.774 1.00 31.29 O ATOM 1126 H ASP A 123 28.454 4.690 -27.053 1.00 0.00 H ATOM 1127 N ALA A 124 31.472 4.935 -25.690 1.00 24.35 N ATOM 1128 CA ALA A 124 32.828 5.382 -25.387 1.00 24.38 C ATOM 1129 C ALA A 124 32.795 6.578 -24.440 1.00 23.67 C ATOM 1130 O ALA A 124 33.563 6.641 -23.479 1.00 22.74 O ATOM 1131 CB ALA A 124 33.585 5.729 -26.667 1.00 26.96 C ATOM 1132 H ALA A 124 31.128 4.959 -26.671 1.00 0.00 H ATOM 1133 N ALA A 125 31.889 7.517 -24.704 1.00 21.21 N ATOM 1134 CA ALA A 125 31.726 8.680 -23.843 1.00 20.05 C ATOM 1135 C ALA A 125 31.260 8.263 -22.448 1.00 19.62 C ATOM 1136 O ALA A 125 31.823 8.688 -21.439 1.00 19.53 O ATOM 1137 CB ALA A 125 30.733 9.666 -24.461 1.00 23.95 C ATOM 1138 H ALA A 125 31.284 7.418 -25.544 1.00 0.00 H ATOM 1139 N TRP A 126 30.232 7.417 -22.409 1.00 20.16 N ATOM 1140 CA TRP A 126 29.615 6.982 -21.157 1.00 19.27 C ATOM 1141 C TRP A 126 30.646 6.429 -20.180 1.00 21.36 C ATOM 1142 O TRP A 126 30.564 6.676 -18.970 1.00 22.27 O ATOM 1143 CB TRP A 126 28.536 5.927 -21.442 1.00 22.00 C ATOM 1144 CG TRP A 126 27.894 5.358 -20.205 1.00 20.99 C ATOM 1145 CD1 TRP A 126 28.260 4.227 -19.538 1.00 23.75 C ATOM 1146 CD2 TRP A 126 26.768 5.894 -19.496 1.00 22.04 C ATOM 1147 NE1 TRP A 126 27.440 4.028 -18.453 1.00 23.23 N ATOM 1148 CE2 TRP A 126 26.518 5.040 -18.403 1.00 23.32 C ATOM 1149 CE3 TRP A 126 25.955 7.016 -19.673 1.00 17.29 C ATOM 1150 CZ2 TRP A 126 25.478 5.265 -17.499 1.00 22.03 C ATOM 1151 CZ3 TRP A 126 24.923 7.242 -18.772 1.00 19.09 C ATOM 1152 CH2 TRP A 126 24.700 6.369 -17.694 1.00 19.62 C ATOM 1153 HE1 TRP A 126 27.508 3.238 -17.780 1.00 0.00 H ATOM 1154 H TRP A 126 29.853 7.051 -23.306 1.00 0.00 H ATOM 1155 N ASN A 127 31.625 5.702 -20.722 1.00 21.90 N ATOM 1156 CA ASN A 127 32.626 5.022 -19.912 1.00 23.49 C ATOM 1157 C ASN A 127 33.921 5.800 -19.767 1.00 22.97 C ATOM 1158 O ASN A 127 34.887 5.292 -19.202 1.00 27.25 O ATOM 1159 CB ASN A 127 32.928 3.640 -20.499 1.00 24.93 C ATOM 1160 CG ASN A 127 31.729 2.711 -20.447 1.00 26.43 C ATOM 1161 OD1 ASN A 127 31.288 2.309 -19.368 1.00 29.42 O ATOM 1162 ND2 ASN A 127 31.192 2.369 -21.614 1.00 29.50 N ATOM 1163 HD22 ASN A 127 31.598 2.733 -22.500 1.00 0.00 H ATOM 1164 HD21 ASN A 127 30.366 1.738 -21.641 1.00 0.00 H ATOM 1165 H ASN A 127 31.675 5.618 -21.757 1.00 0.00 H ATOM 1166 N SER A 128 33.952 7.025 -20.284 1.00 22.07 N ATOM 1167 CA SER A 128 35.204 7.784 -20.336 1.00 22.54 C ATOM 1168 C SER A 128 35.500 8.501 -19.032 1.00 22.29 C ATOM 1169 O SER A 128 34.591 8.829 -18.265 1.00 21.37 O ATOM 1170 CB SER A 128 35.178 8.809 -21.470 1.00 21.99 C ATOM 1171 OG SER A 128 34.272 9.861 -21.189 1.00 21.12 O ATOM 1172 HG SER A 128 33.361 9.490 -21.077 1.00 0.00 H ATOM 1173 H SER A 128 33.078 7.449 -20.655 1.00 0.00 H ATOM 1174 N PHE A 129 36.778 8.769 -18.800 1.00 23.24 N ATOM 1175 CA PHE A 129 37.179 9.522 -17.625 1.00 23.26 C ATOM 1176 C PHE A 129 36.932 11.022 -17.814 1.00 25.13 C ATOM 1177 O PHE A 129 36.760 11.750 -16.836 1.00 21.88 O ATOM 1178 CB PHE A 129 38.632 9.218 -17.277 1.00 24.86 C ATOM 1179 CG PHE A 129 38.786 7.941 -16.506 1.00 25.95 C ATOM 1180 CD1 PHE A 129 38.726 6.712 -17.148 1.00 26.62 C ATOM 1181 CD2 PHE A 129 38.937 7.965 -15.128 1.00 26.44 C ATOM 1182 CE1 PHE A 129 38.835 5.534 -16.433 1.00 27.79 C ATOM 1183 CE2 PHE A 129 39.059 6.789 -14.409 1.00 28.08 C ATOM 1184 CZ PHE A 129 39.007 5.572 -15.062 1.00 28.32 C ATOM 1185 H PHE A 129 37.502 8.436 -19.468 1.00 0.00 H ATOM 1186 N VAL A 130 36.866 11.470 -19.066 1.00 21.92 N ATOM 1187 CA VAL A 130 36.378 12.823 -19.346 1.00 20.95 C ATOM 1188 C VAL A 130 34.965 12.986 -18.787 1.00 21.21 C ATOM 1189 O VAL A 130 34.668 13.975 -18.121 1.00 19.18 O ATOM 1190 CB VAL A 130 36.397 13.135 -20.859 1.00 20.99 C ATOM 1191 CG1 VAL A 130 35.481 14.310 -21.192 1.00 19.90 C ATOM 1192 CG2 VAL A 130 37.827 13.414 -21.313 1.00 22.32 C ATOM 1193 H VAL A 130 37.163 10.855 -19.851 1.00 0.00 H ATOM 1194 N VAL A 131 34.114 11.995 -19.014 1.00 19.32 N ATOM 1195 CA VAL A 131 32.738 12.077 -18.536 1.00 18.23 C ATOM 1196 C VAL A 131 32.702 11.911 -17.017 1.00 20.61 C ATOM 1197 O VAL A 131 31.960 12.612 -16.331 1.00 18.82 O ATOM 1198 CB VAL A 131 31.842 11.042 -19.248 1.00 18.04 C ATOM 1199 CG1 VAL A 131 30.608 10.678 -18.405 1.00 18.58 C ATOM 1200 CG2 VAL A 131 31.431 11.596 -20.613 1.00 17.59 C ATOM 1201 H VAL A 131 34.430 11.153 -19.537 1.00 0.00 H ATOM 1202 N LYS A 132 33.527 11.011 -16.491 1.00 19.54 N ATOM 1203 CA LYS A 132 33.629 10.839 -15.047 1.00 20.04 C ATOM 1204 C LYS A 132 33.979 12.172 -14.375 1.00 23.59 C ATOM 1205 O LYS A 132 33.439 12.510 -13.322 1.00 24.53 O ATOM 1206 CB LYS A 132 34.672 9.767 -14.716 1.00 21.57 C ATOM 1207 CG LYS A 132 34.706 9.349 -13.267 1.00 29.68 C ATOM 1208 CD LYS A 132 35.827 8.337 -13.036 1.00 31.06 C ATOM 1209 CE LYS A 132 35.653 7.108 -13.921 1.00 33.22 C ATOM 1210 NZ LYS A 132 34.449 6.313 -13.553 1.00 36.18 N ATOM 1211 HZ1 LYS A 132 34.535 5.992 -12.568 1.00 0.00 H ATOM 1212 HZ2 LYS A 132 33.600 6.905 -13.653 1.00 0.00 H ATOM 1213 HZ3 LYS A 132 34.374 5.489 -14.182 1.00 0.00 H ATOM 1214 H LYS A 132 34.109 10.421 -17.119 1.00 0.00 H ATOM 1215 N SER A 133 34.852 12.946 -15.008 1.00 20.11 N ATOM 1216 CA SER A 133 35.259 14.225 -14.450 1.00 20.20 C ATOM 1217 C SER A 133 34.128 15.256 -14.536 1.00 18.93 C ATOM 1218 O SER A 133 33.930 16.043 -13.614 1.00 21.15 O ATOM 1219 CB SER A 133 36.507 14.748 -15.165 1.00 24.55 C ATOM 1220 OG SER A 133 36.288 14.859 -16.560 1.00 22.40 O ATOM 1221 HG SER A 133 37.109 15.199 -16.996 1.00 0.00 H ATOM 1222 H SER A 133 35.250 12.633 -15.916 1.00 0.00 H ATOM 1223 N LEU A 134 33.394 15.246 -15.640 1.00 18.05 N ATOM 1224 CA LEU A 134 32.235 16.125 -15.769 1.00 16.93 C ATOM 1225 C LEU A 134 31.157 15.790 -14.734 1.00 21.67 C ATOM 1226 O LEU A 134 30.455 16.683 -14.260 1.00 19.76 O ATOM 1227 CB LEU A 134 31.656 16.047 -17.183 1.00 16.59 C ATOM 1228 CG LEU A 134 32.483 16.759 -18.255 1.00 19.86 C ATOM 1229 CD1 LEU A 134 31.981 16.406 -19.650 1.00 20.63 C ATOM 1230 CD2 LEU A 134 32.439 18.269 -18.040 1.00 25.51 C ATOM 1231 H LEU A 134 33.646 14.607 -16.421 1.00 0.00 H ATOM 1232 N VAL A 135 31.019 14.511 -14.386 1.00 19.32 N ATOM 1233 CA VAL A 135 30.051 14.133 -13.350 1.00 18.74 C ATOM 1234 C VAL A 135 30.509 14.725 -12.018 1.00 19.06 C ATOM 1235 O VAL A 135 29.707 15.309 -11.280 1.00 18.16 O ATOM 1236 CB VAL A 135 29.879 12.598 -13.238 1.00 17.33 C ATOM 1237 CG1 VAL A 135 29.078 12.225 -11.992 1.00 19.78 C ATOM 1238 CG2 VAL A 135 29.187 12.065 -14.474 1.00 17.14 C ATOM 1239 H VAL A 135 31.597 13.781 -14.849 1.00 0.00 H ATOM 1240 N ALA A 136 31.806 14.619 -11.745 1.00 21.02 N ATOM 1241 CA ALA A 136 32.396 15.196 -10.538 1.00 25.67 C ATOM 1242 C ALA A 136 32.230 16.716 -10.506 1.00 24.05 C ATOM 1243 O ALA A 136 31.930 17.288 -9.456 1.00 25.25 O ATOM 1244 CB ALA A 136 33.872 14.820 -10.432 1.00 24.96 C ATOM 1245 H ALA A 136 32.421 14.109 -12.411 1.00 0.00 H ATOM 1246 N GLN A 137 32.405 17.359 -11.657 1.00 20.77 N ATOM 1247 CA GLN A 137 32.289 18.812 -11.744 1.00 23.03 C ATOM 1248 C GLN A 137 30.866 19.278 -11.419 1.00 20.30 C ATOM 1249 O GLN A 137 30.683 20.273 -10.712 1.00 21.80 O ATOM 1250 CB GLN A 137 32.709 19.309 -13.132 1.00 29.20 C ATOM 1251 CG GLN A 137 34.200 19.151 -13.417 1.00 39.04 C ATOM 1252 CD GLN A 137 34.551 19.343 -14.884 1.00 41.59 C ATOM 1253 OE1 GLN A 137 35.209 18.491 -15.499 1.00 43.65 O ATOM 1254 NE2 GLN A 137 34.122 20.466 -15.453 1.00 36.15 N ATOM 1255 HE22 GLN A 137 33.573 21.153 -14.898 1.00 0.00 H ATOM 1256 HE21 GLN A 137 34.336 20.657 -16.453 1.00 0.00 H ATOM 1257 H GLN A 137 32.629 16.815 -12.514 1.00 0.00 H ATOM 1258 N GLN A 138 29.868 18.556 -11.929 1.00 17.29 N ATOM 1259 CA GLN A 138 28.461 18.899 -11.682 1.00 17.57 C ATOM 1260 C GLN A 138 28.127 18.755 -10.206 1.00 17.43 C ATOM 1261 O GLN A 138 27.467 19.615 -9.627 1.00 20.18 O ATOM 1262 CB GLN A 138 27.522 18.020 -12.514 1.00 14.46 C ATOM 1263 CG GLN A 138 27.653 18.207 -14.031 1.00 14.95 C ATOM 1264 CD GLN A 138 26.777 17.252 -14.812 1.00 18.53 C ATOM 1265 OE1 GLN A 138 25.622 17.554 -15.102 1.00 15.80 O ATOM 1266 NE2 GLN A 138 27.327 16.095 -15.170 1.00 14.80 N ATOM 1267 HE22 GLN A 138 28.309 15.881 -14.902 1.00 0.00 H ATOM 1268 HE21 GLN A 138 26.775 15.404 -15.717 1.00 0.00 H ATOM 1269 H GLN A 138 30.091 17.728 -12.517 1.00 0.00 H ATOM 1270 N GLU A 139 28.595 17.671 -9.595 1.00 16.67 N ATOM 1271 CA GLU A 139 28.345 17.421 -8.183 1.00 19.48 C ATOM 1272 C GLU A 139 29.015 18.469 -7.296 1.00 20.59 C ATOM 1273 O GLU A 139 28.407 18.964 -6.345 1.00 24.31 O ATOM 1274 CB GLU A 139 28.826 16.020 -7.803 1.00 24.39 C ATOM 1275 CG GLU A 139 28.025 14.913 -8.477 1.00 26.78 C ATOM 1276 CD GLU A 139 28.658 13.546 -8.317 1.00 34.54 C ATOM 1277 OE1 GLU A 139 29.843 13.481 -7.935 1.00 40.91 O ATOM 1278 OE2 GLU A 139 27.974 12.535 -8.579 1.00 33.25 O ATOM 1279 H GLU A 139 29.154 16.984 -10.140 1.00 0.00 H ATOM 1280 N LYS A 140 30.261 18.813 -7.616 1.00 19.72 N ATOM 1281 CA LYS A 140 31.009 19.777 -6.815 1.00 20.99 C ATOM 1282 C LYS A 140 30.385 21.167 -6.912 1.00 22.31 C ATOM 1283 O LYS A 140 30.293 21.876 -5.917 1.00 21.94 O ATOM 1284 CB LYS A 140 32.476 19.830 -7.249 1.00 24.14 C ATOM 1285 CG LYS A 140 33.336 20.710 -6.350 1.00 32.61 C ATOM 1286 CD LYS A 140 34.415 21.419 -7.145 1.00 42.18 C ATOM 1287 CE LYS A 140 35.177 22.408 -6.274 1.00 49.87 C ATOM 1288 NZ LYS A 140 36.067 23.271 -7.098 1.00 54.25 N ATOM 1289 HZ1 LYS A 140 36.753 22.676 -7.605 1.00 0.00 H ATOM 1290 HZ2 LYS A 140 35.494 23.803 -7.784 1.00 0.00 H ATOM 1291 HZ3 LYS A 140 36.574 23.935 -6.479 1.00 0.00 H ATOM 1292 H LYS A 140 30.709 18.387 -8.452 1.00 0.00 H ATOM 1293 N ALA A 141 29.954 21.541 -8.112 1.00 20.45 N ATOM 1294 CA ALA A 141 29.304 22.828 -8.335 1.00 18.29 C ATOM 1295 C ALA A 141 28.067 22.977 -7.456 1.00 22.41 C ATOM 1296 O ALA A 141 27.853 24.024 -6.843 1.00 21.96 O ATOM 1297 CB ALA A 141 28.932 22.978 -9.799 1.00 17.55 C ATOM 1298 H ALA A 141 30.084 20.896 -8.917 1.00 0.00 H ATOM 1299 N ALA A 142 27.245 21.931 -7.417 1.00 20.83 N ATOM 1300 CA ALA A 142 26.038 21.938 -6.595 1.00 17.67 C ATOM 1301 C ALA A 142 26.403 22.060 -5.126 1.00 24.07 C ATOM 1302 O ALA A 142 25.781 22.817 -4.380 1.00 23.94 O ATOM 1303 CB ALA A 142 25.212 20.680 -6.844 1.00 22.28 C ATOM 1304 H ALA A 142 27.467 21.089 -7.985 1.00 0.00 H ATOM 1305 N ALA A 143 27.426 21.322 -4.716 1.00 19.71 N ATOM 1306 CA ALA A 143 27.875 21.361 -3.334 1.00 21.98 C ATOM 1307 C ALA A 143 28.408 22.741 -2.963 1.00 25.85 C ATOM 1308 O ALA A 143 28.208 23.208 -1.844 1.00 28.97 O ATOM 1309 CB ALA A 143 28.935 20.297 -3.095 1.00 22.53 C ATOM 1310 H ALA A 143 27.915 20.705 -5.395 1.00 0.00 H ATOM 1311 N ASP A 144 29.079 23.393 -3.905 1.00 23.22 N ATOM 1312 CA ASP A 144 29.667 24.704 -3.646 1.00 26.46 C ATOM 1313 C ASP A 144 28.620 25.765 -3.309 1.00 27.82 C ATOM 1314 O ASP A 144 28.885 26.658 -2.514 1.00 30.00 O ATOM 1315 CB ASP A 144 30.492 25.173 -4.844 1.00 29.75 C ATOM 1316 CG ASP A 144 31.803 24.427 -4.980 1.00 33.99 C ATOM 1317 OD1 ASP A 144 32.239 23.785 -3.999 1.00 32.30 O ATOM 1318 OD2 ASP A 144 32.396 24.489 -6.076 1.00 38.55 O ATOM 1319 H ASP A 144 29.188 22.962 -4.845 1.00 0.00 H ATOM 1320 N VAL A 145 27.444 25.677 -3.922 1.00 25.67 N ATOM 1321 CA VAL A 145 26.389 26.654 -3.659 1.00 26.58 C ATOM 1322 C VAL A 145 25.348 26.105 -2.691 1.00 27.52 C ATOM 1323 O VAL A 145 24.277 26.695 -2.531 1.00 32.29 O ATOM 1324 CB VAL A 145 25.678 27.102 -4.953 1.00 24.27 C ATOM 1325 CG1 VAL A 145 26.644 27.820 -5.880 1.00 28.62 C ATOM 1326 CG2 VAL A 145 25.027 25.913 -5.656 1.00 22.12 C ATOM 1327 H VAL A 145 27.272 24.904 -4.596 1.00 0.00 H ATOM 1328 N GLN A 146 25.679 24.985 -2.048 1.00 28.22 N ATOM 1329 CA GLN A 146 24.775 24.293 -1.128 1.00 30.52 C ATOM 1330 C GLN A 146 23.391 24.112 -1.741 1.00 30.43 C ATOM 1331 O GLN A 146 22.380 24.501 -1.150 1.00 31.07 O ATOM 1332 CB GLN A 146 24.668 25.042 0.205 1.00 35.31 C ATOM 1333 CG GLN A 146 25.900 24.922 1.092 1.00 39.77 C ATOM 1334 CD GLN A 146 27.075 25.728 0.576 1.00 40.17 C ATOM 1335 OE1 GLN A 146 26.983 26.945 0.411 1.00 43.31 O ATOM 1336 NE2 GLN A 146 28.186 25.050 0.308 1.00 36.91 N ATOM 1337 HE22 GLN A 146 28.218 24.022 0.463 1.00 0.00 H ATOM 1338 HE21 GLN A 146 29.023 25.547 -0.057 1.00 0.00 H ATOM 1339 H GLN A 146 26.625 24.584 -2.208 1.00 0.00 H ATOM 1340 N LEU A 147 23.359 23.517 -2.929 1.00 24.84 N ATOM 1341 CA LEU A 147 22.125 23.376 -3.693 1.00 24.80 C ATOM 1342 C LEU A 147 21.111 22.453 -3.038 1.00 24.57 C ATOM 1343 O LEU A 147 21.417 21.306 -2.722 1.00 29.61 O ATOM 1344 CB LEU A 147 22.443 22.869 -5.095 1.00 20.38 C ATOM 1345 CG LEU A 147 21.258 22.897 -6.050 1.00 19.03 C ATOM 1346 CD1 LEU A 147 20.881 24.333 -6.356 1.00 24.04 C ATOM 1347 CD2 LEU A 147 21.617 22.151 -7.316 1.00 20.29 C ATOM 1348 H LEU A 147 24.243 23.140 -3.327 1.00 0.00 H ATOM 1349 N ARG A 148 19.891 22.955 -2.858 1.00 25.84 N ATOM 1350 CA ARG A 148 18.863 22.216 -2.136 1.00 29.82 C ATOM 1351 C ARG A 148 17.681 21.846 -3.029 1.00 27.05 C ATOM 1352 O ARG A 148 16.833 21.036 -2.656 1.00 31.54 O ATOM 1353 CB ARG A 148 18.387 23.030 -0.935 1.00 34.27 C ATOM 1354 CG ARG A 148 19.423 23.137 0.184 1.00 37.45 C ATOM 1355 CD ARG A 148 20.065 21.787 0.484 1.00 42.17 C ATOM 1356 NE ARG A 148 20.961 21.851 1.641 1.00 48.40 N ATOM 1357 CZ ARG A 148 22.289 21.874 1.565 1.00 54.38 C ATOM 1358 NH1 ARG A 148 22.890 21.804 0.387 1.00 54.76 N ATOM 1359 NH2 ARG A 148 23.020 21.943 2.671 1.00 60.92 N ATOM 1360 HE ARG A 148 20.529 21.880 2.587 1.00 0.00 H ATOM 1361 HH12 ARG A 148 23.928 21.822 0.331 1.00 0.00 H ATOM 1362 HH11 ARG A 148 22.324 21.731 -0.482 1.00 0.00 H ATOM 1363 HH22 ARG A 148 24.058 21.961 2.608 1.00 0.00 H ATOM 1364 HH21 ARG A 148 22.555 21.979 3.600 1.00 0.00 H ATOM 1365 H ARG A 148 19.667 23.895 -3.241 1.00 0.00 H ATOM 1366 N GLY A 149 17.623 22.437 -4.214 1.00 19.64 N ATOM 1367 CA GLY A 149 16.533 22.133 -5.124 1.00 17.52 C ATOM 1368 C GLY A 149 16.715 22.716 -6.500 1.00 19.78 C ATOM 1369 O GLY A 149 17.550 23.601 -6.710 1.00 19.61 O ATOM 1370 H GLY A 149 18.358 23.118 -4.492 1.00 0.00 H ATOM 1371 N VAL A 150 15.911 22.220 -7.437 1.00 18.26 N ATOM 1372 CA VAL A 150 15.899 22.719 -8.805 1.00 18.71 C ATOM 1373 C VAL A 150 14.475 23.113 -9.220 1.00 16.92 C ATOM 1374 O VAL A 150 13.502 22.651 -8.618 1.00 18.81 O ATOM 1375 CB VAL A 150 16.482 21.675 -9.784 1.00 16.71 C ATOM 1376 CG1 VAL A 150 18.004 21.638 -9.648 1.00 17.84 C ATOM 1377 CG2 VAL A 150 15.861 20.299 -9.543 1.00 19.18 C ATOM 1378 H VAL A 150 15.266 21.445 -7.182 1.00 0.00 H ATOM 1379 N PRO A 151 14.348 23.999 -10.218 1.00 14.81 N ATOM 1380 CA PRO A 151 15.435 24.660 -10.953 1.00 15.33 C ATOM 1381 C PRO A 151 16.135 25.690 -10.090 1.00 18.28 C ATOM 1382 O PRO A 151 15.576 26.135 -9.081 1.00 20.92 O ATOM 1383 CB PRO A 151 14.718 25.330 -12.127 1.00 18.11 C ATOM 1384 CG PRO A 151 13.355 25.586 -11.621 1.00 22.33 C ATOM 1385 CD PRO A 151 13.023 24.450 -10.690 1.00 19.78 C ATOM 1386 N ALA A 152 17.354 26.040 -10.482 1.00 14.69 N ATOM 1387 CA ALA A 152 18.131 27.052 -9.778 1.00 15.54 C ATOM 1388 C ALA A 152 19.077 27.708 -10.748 1.00 16.29 C ATOM 1389 O ALA A 152 19.621 27.044 -11.630 1.00 16.89 O ATOM 1390 CB ALA A 152 18.897 26.441 -8.633 1.00 15.45 C ATOM 1391 H ALA A 152 17.767 25.578 -11.317 1.00 0.00 H ATOM 1392 N MET A 153 19.277 29.012 -10.594 1.00 15.39 N ATOM 1393 CA MET A 153 20.275 29.705 -11.397 1.00 16.72 C ATOM 1394 C MET A 153 21.093 30.631 -10.519 1.00 19.33 C ATOM 1395 O MET A 153 20.557 31.342 -9.668 1.00 19.46 O ATOM 1396 CB MET A 153 19.646 30.499 -12.535 1.00 17.05 C ATOM 1397 CG MET A 153 20.702 31.040 -13.500 1.00 19.47 C ATOM 1398 SD MET A 153 20.040 32.247 -14.651 1.00 30.20 S ATOM 1399 CE MET A 153 19.189 31.201 -15.794 1.00 25.14 C ATOM 1400 H MET A 153 18.717 29.542 -9.895 1.00 0.00 H ATOM 1401 N PHE A 154 22.401 30.609 -10.747 1.00 17.04 N ATOM 1402 CA PHE A 154 23.349 31.394 -9.976 1.00 20.43 C ATOM 1403 C PHE A 154 24.147 32.307 -10.888 1.00 19.17 C ATOM 1404 O PHE A 154 24.536 31.910 -11.987 1.00 20.36 O ATOM 1405 CB PHE A 154 24.282 30.471 -9.189 1.00 20.26 C ATOM 1406 CG PHE A 154 23.567 29.640 -8.171 1.00 20.26 C ATOM 1407 CD1 PHE A 154 22.942 28.455 -8.539 1.00 23.25 C ATOM 1408 CD2 PHE A 154 23.482 30.059 -6.853 1.00 21.97 C ATOM 1409 CE1 PHE A 154 22.262 27.699 -7.602 1.00 21.47 C ATOM 1410 CE2 PHE A 154 22.809 29.307 -5.919 1.00 25.44 C ATOM 1411 CZ PHE A 154 22.197 28.122 -6.297 1.00 22.93 C ATOM 1412 H PHE A 154 22.762 30.003 -11.511 1.00 0.00 H ATOM 1413 N VAL A 155 24.378 33.532 -10.427 1.00 19.25 N ATOM 1414 CA VAL A 155 25.119 34.518 -11.202 1.00 23.48 C ATOM 1415 C VAL A 155 26.416 34.888 -10.496 1.00 25.47 C ATOM 1416 O VAL A 155 26.402 35.399 -9.371 1.00 25.35 O ATOM 1417 CB VAL A 155 24.282 35.795 -11.448 1.00 20.89 C ATOM 1418 CG1 VAL A 155 25.106 36.838 -12.196 1.00 27.07 C ATOM 1419 CG2 VAL A 155 23.008 35.453 -12.212 1.00 19.76 C ATOM 1420 H VAL A 155 24.020 33.794 -9.486 1.00 0.00 H ATOM 1421 N ASN A 156 27.535 34.621 -11.167 1.00 24.28 N ATOM 1422 CA ASN A 156 28.863 34.915 -10.631 1.00 27.15 C ATOM 1423 C ASN A 156 29.111 34.309 -9.249 1.00 28.83 C ATOM 1424 O ASN A 156 29.872 34.859 -8.444 1.00 32.84 O ATOM 1425 CB ASN A 156 29.088 36.430 -10.588 1.00 28.98 C ATOM 1426 CG ASN A 156 29.208 37.038 -11.973 1.00 32.09 C ATOM 1427 OD1 ASN A 156 29.788 36.434 -12.877 1.00 37.50 O ATOM 1428 ND2 ASN A 156 28.658 38.234 -12.148 1.00 32.09 N ATOM 1429 HD22 ASN A 156 28.178 38.707 -11.356 1.00 0.00 H ATOM 1430 HD21 ASN A 156 28.707 38.698 -13.077 1.00 0.00 H ATOM 1431 H ASN A 156 27.461 34.186 -12.109 1.00 0.00 H ATOM 1432 N GLY A 157 28.470 33.172 -8.983 1.00 27.70 N ATOM 1433 CA GLY A 157 28.630 32.476 -7.717 1.00 29.42 C ATOM 1434 C GLY A 157 28.226 33.287 -6.498 1.00 29.86 C ATOM 1435 O GLY A 157 28.589 32.941 -5.371 1.00 32.33 O ATOM 1436 H GLY A 157 27.836 32.770 -9.703 1.00 0.00 H ATOM 1437 N LYS A 158 27.466 34.360 -6.717 1.00 31.50 N ATOM 1438 CA LYS A 158 27.130 35.294 -5.647 1.00 29.86 C ATOM 1439 C LYS A 158 25.628 35.473 -5.436 1.00 32.78 C ATOM 1440 O LYS A 158 25.176 35.675 -4.307 1.00 35.06 O ATOM 1441 CB LYS A 158 27.764 36.661 -5.919 1.00 32.37 C ATOM 1442 H LYS A 158 27.103 34.536 -7.676 1.00 0.00 H ATOM 1443 N TYR A 159 24.859 35.421 -6.518 1.00 27.13 N ATOM 1444 CA TYR A 159 23.416 35.608 -6.429 1.00 23.71 C ATOM 1445 C TYR A 159 22.667 34.401 -6.966 1.00 21.01 C ATOM 1446 O TYR A 159 23.126 33.727 -7.884 1.00 23.26 O ATOM 1447 CB TYR A 159 22.998 36.869 -7.184 1.00 24.87 C ATOM 1448 CG TYR A 159 23.807 38.072 -6.781 1.00 29.73 C ATOM 1449 CD1 TYR A 159 23.515 38.771 -5.614 1.00 30.61 C ATOM 1450 CD2 TYR A 159 24.879 38.498 -7.551 1.00 32.19 C ATOM 1451 CE1 TYR A 159 24.263 39.869 -5.237 1.00 34.45 C ATOM 1452 CE2 TYR A 159 25.630 39.591 -7.183 1.00 33.81 C ATOM 1453 CZ TYR A 159 25.324 40.272 -6.026 1.00 38.20 C ATOM 1454 OH TYR A 159 26.077 41.364 -5.659 1.00 42.05 O ATOM 1455 HH TYR A 159 25.727 41.734 -4.810 1.00 0.00 H ATOM 1456 H TYR A 159 25.294 35.244 -7.446 1.00 0.00 H ATOM 1457 N GLN A 160 21.504 34.140 -6.380 1.00 20.65 N ATOM 1458 CA GLN A 160 20.621 33.068 -6.814 1.00 21.28 C ATOM 1459 C GLN A 160 19.283 33.661 -7.238 1.00 20.43 C ATOM 1460 O GLN A 160 18.710 34.468 -6.503 1.00 23.23 O ATOM 1461 CB GLN A 160 20.428 32.047 -5.685 1.00 20.79 C ATOM 1462 CG GLN A 160 19.420 30.951 -6.004 1.00 23.11 C ATOM 1463 CD GLN A 160 19.397 29.857 -4.954 1.00 27.71 C ATOM 1464 OE1 GLN A 160 20.100 29.931 -3.945 1.00 30.58 O ATOM 1465 NE2 GLN A 160 18.600 28.826 -5.199 1.00 34.69 N ATOM 1466 HE22 GLN A 160 18.025 28.808 -6.065 1.00 0.00 H ATOM 1467 HE21 GLN A 160 18.550 28.035 -4.525 1.00 0.00 H ATOM 1468 H GLN A 160 21.211 34.729 -5.574 1.00 0.00 H ATOM 1469 N LEU A 161 18.795 33.281 -8.420 1.00 18.36 N ATOM 1470 CA LEU A 161 17.522 33.793 -8.924 1.00 20.06 C ATOM 1471 C LEU A 161 16.389 33.339 -8.009 1.00 23.17 C ATOM 1472 O LEU A 161 16.447 32.247 -7.446 1.00 21.63 O ATOM 1473 CB LEU A 161 17.267 33.313 -10.360 1.00 18.03 C ATOM 1474 CG LEU A 161 17.888 34.079 -11.539 1.00 18.29 C ATOM 1475 CD1 LEU A 161 17.090 35.343 -11.814 1.00 21.43 C ATOM 1476 CD2 LEU A 161 19.365 34.430 -11.287 1.00 18.22 C ATOM 1477 H LEU A 161 19.334 32.604 -8.997 1.00 0.00 H ATOM 1478 N ASN A 162 15.372 34.182 -7.850 1.00 21.58 N ATOM 1479 CA ASN A 162 14.214 33.834 -7.035 1.00 21.80 C ATOM 1480 C ASN A 162 12.925 33.970 -7.833 1.00 20.75 C ATOM 1481 O ASN A 162 12.205 34.958 -7.689 1.00 22.30 O ATOM 1482 CB ASN A 162 14.155 34.710 -5.778 1.00 25.02 C ATOM 1483 CG ASN A 162 13.048 34.287 -4.831 1.00 28.82 C ATOM 1484 OD1 ASN A 162 12.782 33.096 -4.668 1.00 30.58 O ATOM 1485 ND2 ASN A 162 12.374 35.260 -4.227 1.00 26.44 N ATOM 1486 HD22 ASN A 162 12.633 36.253 -4.394 1.00 0.00 H ATOM 1487 HD21 ASN A 162 11.587 35.028 -3.587 1.00 0.00 H ATOM 1488 H ASN A 162 15.404 35.110 -8.318 1.00 0.00 H ATOM 1489 N PRO A 163 12.620 32.971 -8.674 1.00 22.27 N ATOM 1490 CA PRO A 163 11.434 33.031 -9.538 1.00 21.24 C ATOM 1491 C PRO A 163 10.139 33.176 -8.747 1.00 22.71 C ATOM 1492 O PRO A 163 9.193 33.776 -9.247 1.00 22.38 O ATOM 1493 CB PRO A 163 11.471 31.693 -10.289 1.00 24.58 C ATOM 1494 CG PRO A 163 12.314 30.800 -9.437 1.00 22.60 C ATOM 1495 CD PRO A 163 13.356 31.705 -8.836 1.00 21.19 C ATOM 1496 N GLN A 164 10.114 32.657 -7.522 1.00 22.49 N ATOM 1497 CA GLN A 164 8.937 32.763 -6.659 1.00 28.54 C ATOM 1498 C GLN A 164 8.564 34.208 -6.367 1.00 32.20 C ATOM 1499 O GLN A 164 7.407 34.511 -6.066 1.00 33.90 O ATOM 1500 CB GLN A 164 9.168 32.017 -5.344 1.00 32.25 C ATOM 1501 CG GLN A 164 9.089 30.506 -5.479 1.00 34.40 C ATOM 1502 H GLN A 164 10.956 32.161 -7.167 1.00 0.00 H ATOM 1503 N GLY A 165 9.548 35.097 -6.457 1.00 28.97 N ATOM 1504 CA GLY A 165 9.329 36.504 -6.193 1.00 28.23 C ATOM 1505 C GLY A 165 8.910 37.310 -7.410 1.00 29.36 C ATOM 1506 O GLY A 165 8.786 38.534 -7.341 1.00 33.77 O ATOM 1507 H GLY A 165 10.500 34.774 -6.724 1.00 0.00 H ATOM 1508 N MET A 166 8.684 36.620 -8.523 1.00 23.86 N ATOM 1509 CA MET A 166 8.354 37.272 -9.784 1.00 20.90 C ATOM 1510 C MET A 166 6.890 37.077 -10.150 1.00 22.91 C ATOM 1511 O MET A 166 6.188 36.269 -9.546 1.00 24.51 O ATOM 1512 CB MET A 166 9.252 36.737 -10.899 1.00 23.30 C ATOM 1513 CG MET A 166 10.723 36.853 -10.568 1.00 25.29 C ATOM 1514 SD MET A 166 11.798 36.102 -11.803 1.00 23.27 S ATOM 1515 CE MET A 166 13.413 36.564 -11.175 1.00 23.18 C ATOM 1516 H MET A 166 8.745 35.582 -8.493 1.00 0.00 H ATOM 1517 N ASP A 167 6.455 37.833 -11.151 1.00 22.35 N ATOM 1518 CA ASP A 167 5.095 37.779 -11.655 1.00 23.84 C ATOM 1519 C ASP A 167 4.841 36.465 -12.387 1.00 21.80 C ATOM 1520 O ASP A 167 5.652 36.042 -13.217 1.00 20.68 O ATOM 1521 CB ASP A 167 4.852 38.970 -12.584 1.00 26.90 C ATOM 1522 CG ASP A 167 3.417 39.426 -12.582 1.00 28.89 C ATOM 1523 OD1 ASP A 167 2.520 38.583 -12.373 1.00 26.83 O ATOM 1524 OD2 ASP A 167 3.178 40.630 -12.799 1.00 34.50 O ATOM 1525 H ASP A 167 7.121 38.496 -11.596 1.00 0.00 H ATOM 1526 N THR A 168 3.727 35.807 -12.074 1.00 20.98 N ATOM 1527 CA THR A 168 3.395 34.554 -12.750 1.00 19.94 C ATOM 1528 C THR A 168 2.005 34.549 -13.392 1.00 22.00 C ATOM 1529 O THR A 168 1.406 33.486 -13.574 1.00 21.54 O ATOM 1530 CB THR A 168 3.465 33.368 -11.776 1.00 24.20 C ATOM 1531 OG1 THR A 168 2.581 33.610 -10.674 1.00 24.73 O ATOM 1532 CG2 THR A 168 4.902 33.165 -11.271 1.00 23.83 C ATOM 1533 HG1 THR A 168 2.855 34.440 -10.208 1.00 0.00 H ATOM 1534 H THR A 168 3.090 36.186 -11.345 1.00 0.00 H ATOM 1535 N SER A 169 1.517 35.737 -13.736 1.00 21.13 N ATOM 1536 CA SER A 169 0.206 35.905 -14.364 1.00 21.08 C ATOM 1537 C SER A 169 0.284 35.810 -15.885 1.00 22.55 C ATOM 1538 O SER A 169 -0.721 35.571 -16.556 1.00 21.10 O ATOM 1539 CB SER A 169 -0.404 37.250 -13.965 1.00 22.11 C ATOM 1540 OG SER A 169 -1.522 37.554 -14.777 1.00 22.55 O ATOM 1541 HG SER A 169 -1.238 37.600 -15.724 1.00 0.00 H ATOM 1542 H SER A 169 2.092 36.584 -13.551 1.00 0.00 H ATOM 1543 N ASN A 170 1.486 36.009 -16.416 1.00 21.70 N ATOM 1544 CA ASN A 170 1.734 35.980 -17.850 1.00 22.17 C ATOM 1545 C ASN A 170 3.086 35.336 -18.088 1.00 20.37 C ATOM 1546 O ASN A 170 4.077 35.758 -17.499 1.00 21.24 O ATOM 1547 CB ASN A 170 1.699 37.400 -18.435 1.00 23.04 C ATOM 1548 CG ASN A 170 2.078 37.443 -19.907 1.00 23.28 C ATOM 1549 OD1 ASN A 170 3.211 37.137 -20.279 1.00 28.16 O ATOM 1550 ND2 ASN A 170 1.134 37.844 -20.750 1.00 31.91 N ATOM 1551 HD22 ASN A 170 0.190 38.093 -20.393 1.00 0.00 H ATOM 1552 HD21 ASN A 170 1.339 37.909 -21.768 1.00 0.00 H ATOM 1553 H ASN A 170 2.286 36.194 -15.778 1.00 0.00 H ATOM 1554 N MET A 171 3.130 34.321 -18.948 1.00 18.64 N ATOM 1555 CA MET A 171 4.361 33.570 -19.167 1.00 19.07 C ATOM 1556 C MET A 171 5.502 34.455 -19.661 1.00 22.57 C ATOM 1557 O MET A 171 6.637 34.318 -19.224 1.00 21.94 O ATOM 1558 CB MET A 171 4.134 32.458 -20.174 1.00 19.89 C ATOM 1559 CG MET A 171 3.204 31.368 -19.702 1.00 22.35 C ATOM 1560 SD MET A 171 3.270 30.029 -20.913 1.00 28.48 S ATOM 1561 CE MET A 171 2.036 28.919 -20.247 1.00 32.49 C ATOM 1562 H MET A 171 2.271 34.059 -19.473 1.00 0.00 H ATOM 1563 N ASP A 172 5.193 35.358 -20.576 1.00 29.83 N ATOM 1564 CA ASP A 172 6.248 36.132 -21.206 1.00 29.85 C ATOM 1565 C ASP A 172 6.705 37.281 -20.308 1.00 29.41 C ATOM 1566 O ASP A 172 7.883 37.638 -20.311 1.00 29.52 O ATOM 1567 CB ASP A 172 5.777 36.601 -22.578 1.00 29.24 C ATOM 1568 CG ASP A 172 5.412 35.425 -23.472 1.00 30.36 C ATOM 1569 OD1 ASP A 172 6.321 34.622 -23.796 1.00 29.09 O ATOM 1570 OD2 ASP A 172 4.224 35.269 -23.812 1.00 31.45 O ATOM 1571 H ASP A 172 4.200 35.513 -20.843 1.00 0.00 H ATOM 1572 N VAL A 173 5.798 37.812 -19.495 1.00 24.86 N ATOM 1573 CA VAL A 173 6.202 38.750 -18.455 1.00 25.52 C ATOM 1574 C VAL A 173 7.147 38.079 -17.456 1.00 24.31 C ATOM 1575 O VAL A 173 8.159 38.661 -17.074 1.00 25.43 O ATOM 1576 CB VAL A 173 4.994 39.326 -17.702 1.00 26.05 C ATOM 1577 CG1 VAL A 173 5.453 40.165 -16.511 1.00 27.53 C ATOM 1578 CG2 VAL A 173 4.140 40.157 -18.648 1.00 27.46 C ATOM 1579 H VAL A 173 4.795 37.557 -19.601 1.00 0.00 H ATOM 1580 N PHE A 174 6.818 36.857 -17.034 1.00 19.05 N ATOM 1581 CA PHE A 174 7.688 36.115 -16.128 1.00 16.97 C ATOM 1582 C PHE A 174 9.070 35.931 -16.746 1.00 21.84 C ATOM 1583 O PHE A 174 10.090 36.168 -16.092 1.00 19.11 O ATOM 1584 CB PHE A 174 7.098 34.744 -15.774 1.00 17.36 C ATOM 1585 CG PHE A 174 8.033 33.873 -14.990 1.00 18.18 C ATOM 1586 CD1 PHE A 174 8.105 33.981 -13.607 1.00 18.95 C ATOM 1587 CD2 PHE A 174 8.864 32.952 -15.635 1.00 16.60 C ATOM 1588 CE1 PHE A 174 8.978 33.169 -12.877 1.00 18.92 C ATOM 1589 CE2 PHE A 174 9.737 32.154 -14.918 1.00 16.84 C ATOM 1590 CZ PHE A 174 9.798 32.256 -13.540 1.00 18.62 C ATOM 1591 H PHE A 174 5.928 36.427 -17.356 1.00 0.00 H ATOM 1592 N VAL A 175 9.101 35.497 -18.003 1.00 19.64 N ATOM 1593 CA VAL A 175 10.373 35.257 -18.675 1.00 21.13 C ATOM 1594 C VAL A 175 11.168 36.555 -18.787 1.00 22.10 C ATOM 1595 O VAL A 175 12.377 36.571 -18.544 1.00 23.08 O ATOM 1596 CB VAL A 175 10.169 34.638 -20.077 1.00 22.67 C ATOM 1597 CG1 VAL A 175 11.445 34.730 -20.899 1.00 28.26 C ATOM 1598 CG2 VAL A 175 9.722 33.195 -19.952 1.00 19.94 C ATOM 1599 H VAL A 175 8.210 35.327 -18.511 1.00 0.00 H ATOM 1600 N GLN A 176 10.484 37.640 -19.132 1.00 22.40 N ATOM 1601 CA GLN A 176 11.129 38.949 -19.216 1.00 22.78 C ATOM 1602 C GLN A 176 11.723 39.361 -17.871 1.00 24.94 C ATOM 1603 O GLN A 176 12.858 39.830 -17.810 1.00 25.39 O ATOM 1604 CB GLN A 176 10.132 40.012 -19.707 1.00 26.98 C ATOM 1605 CG GLN A 176 10.587 41.460 -19.528 1.00 32.80 C ATOM 1606 CD GLN A 176 10.176 42.052 -18.183 1.00 34.87 C ATOM 1607 OE1 GLN A 176 9.011 41.971 -17.784 1.00 37.84 O ATOM 1608 NE2 GLN A 176 11.139 42.638 -17.473 1.00 34.92 N ATOM 1609 HE22 GLN A 176 12.108 42.683 -17.849 1.00 0.00 H ATOM 1610 HE21 GLN A 176 10.922 43.050 -16.543 1.00 0.00 H ATOM 1611 H GLN A 176 9.470 37.557 -19.347 1.00 0.00 H ATOM 1612 N GLN A 177 10.953 39.199 -16.795 1.00 22.74 N ATOM 1613 CA GLN A 177 11.434 39.596 -15.470 1.00 22.71 C ATOM 1614 C GLN A 177 12.613 38.736 -15.044 1.00 20.62 C ATOM 1615 O GLN A 177 13.565 39.230 -14.438 1.00 21.42 O ATOM 1616 CB GLN A 177 10.317 39.515 -14.424 1.00 20.74 C ATOM 1617 CG GLN A 177 9.259 40.595 -14.591 1.00 23.88 C ATOM 1618 CD GLN A 177 8.215 40.584 -13.488 1.00 25.26 C ATOM 1619 OE1 GLN A 177 8.248 39.744 -12.588 1.00 28.50 O ATOM 1620 NE2 GLN A 177 7.276 41.526 -13.557 1.00 26.29 N ATOM 1621 HE22 GLN A 177 7.287 42.215 -14.336 1.00 0.00 H ATOM 1622 HE21 GLN A 177 6.532 41.572 -12.832 1.00 0.00 H ATOM 1623 H GLN A 177 10.003 38.788 -16.897 1.00 0.00 H ATOM 1624 N TYR A 178 12.544 37.449 -15.364 1.00 18.16 N ATOM 1625 CA TYR A 178 13.611 36.514 -15.029 1.00 17.39 C ATOM 1626 C TYR A 178 14.894 36.906 -15.761 1.00 21.93 C ATOM 1627 O TYR A 178 15.940 37.110 -15.141 1.00 18.68 O ATOM 1628 CB TYR A 178 13.185 35.085 -15.383 1.00 19.41 C ATOM 1629 CG TYR A 178 14.044 33.999 -14.785 1.00 19.04 C ATOM 1630 CD1 TYR A 178 15.291 33.709 -15.317 1.00 19.60 C ATOM 1631 CD2 TYR A 178 13.598 33.241 -13.706 1.00 17.62 C ATOM 1632 CE1 TYR A 178 16.074 32.703 -14.788 1.00 19.18 C ATOM 1633 CE2 TYR A 178 14.387 32.230 -13.167 1.00 15.00 C ATOM 1634 CZ TYR A 178 15.622 31.973 -13.715 1.00 19.44 C ATOM 1635 OH TYR A 178 16.407 30.974 -13.193 1.00 21.18 O ATOM 1636 HH TYR A 178 15.928 30.110 -13.261 1.00 0.00 H ATOM 1637 H TYR A 178 11.705 37.098 -15.868 1.00 0.00 H ATOM 1638 N ALA A 179 14.802 37.011 -17.082 1.00 21.19 N ATOM 1639 CA ALA A 179 15.954 37.345 -17.910 1.00 21.73 C ATOM 1640 C ALA A 179 16.539 38.702 -17.526 1.00 25.94 C ATOM 1641 O ALA A 179 17.755 38.854 -17.431 1.00 25.11 O ATOM 1642 CB ALA A 179 15.566 37.330 -19.389 1.00 25.85 C ATOM 1643 H ALA A 179 13.881 36.850 -17.539 1.00 0.00 H ATOM 1644 N ASP A 180 15.670 39.682 -17.293 1.00 22.41 N ATOM 1645 CA ASP A 180 16.122 41.015 -16.913 1.00 22.99 C ATOM 1646 C ASP A 180 16.839 40.993 -15.570 1.00 23.08 C ATOM 1647 O ASP A 180 17.787 41.751 -15.359 1.00 25.92 O ATOM 1648 CB ASP A 180 14.952 42.002 -16.868 1.00 25.24 C ATOM 1649 CG ASP A 180 14.527 42.468 -18.248 1.00 29.39 C ATOM 1650 OD1 ASP A 180 15.211 42.123 -19.235 1.00 31.40 O ATOM 1651 OD2 ASP A 180 13.517 43.196 -18.340 1.00 28.68 O ATOM 1652 H ASP A 180 14.651 39.494 -17.383 1.00 0.00 H ATOM 1653 N THR A 181 16.394 40.124 -14.666 1.00 22.26 N ATOM 1654 CA THR A 181 17.056 39.987 -13.378 1.00 22.04 C ATOM 1655 C THR A 181 18.463 39.418 -13.574 1.00 21.75 C ATOM 1656 O THR A 181 19.424 39.902 -12.965 1.00 22.80 O ATOM 1657 CB THR A 181 16.252 39.093 -12.413 1.00 20.94 C ATOM 1658 OG1 THR A 181 14.983 39.712 -12.149 1.00 22.48 O ATOM 1659 CG2 THR A 181 17.009 38.923 -11.095 1.00 26.08 C ATOM 1660 HG1 THR A 181 14.486 39.818 -12.999 1.00 0.00 H ATOM 1661 H THR A 181 15.564 39.536 -14.883 1.00 0.00 H ATOM 1662 N VAL A 182 18.587 38.411 -14.435 1.00 20.48 N ATOM 1663 CA VAL A 182 19.899 37.825 -14.700 1.00 21.28 C ATOM 1664 C VAL A 182 20.863 38.890 -15.234 1.00 24.69 C ATOM 1665 O VAL A 182 22.009 38.975 -14.790 1.00 23.64 O ATOM 1666 CB VAL A 182 19.818 36.654 -15.691 1.00 21.20 C ATOM 1667 CG1 VAL A 182 21.196 36.047 -15.905 1.00 20.90 C ATOM 1668 CG2 VAL A 182 18.852 35.594 -15.173 1.00 19.56 C ATOM 1669 H VAL A 182 17.746 38.039 -14.921 1.00 0.00 H ATOM 1670 N LYS A 183 20.387 39.718 -16.161 1.00 24.59 N ATOM 1671 CA LYS A 183 21.214 40.782 -16.728 1.00 28.09 C ATOM 1672 C LYS A 183 21.618 41.795 -15.663 1.00 26.72 C ATOM 1673 O LYS A 183 22.788 42.138 -15.544 1.00 29.45 O ATOM 1674 CB LYS A 183 20.484 41.487 -17.871 1.00 29.98 C ATOM 1675 CG LYS A 183 21.383 42.406 -18.687 1.00 40.07 C ATOM 1676 CD LYS A 183 20.677 42.900 -19.936 1.00 44.94 C ATOM 1677 CE LYS A 183 21.669 43.422 -20.960 1.00 45.83 C ATOM 1678 NZ LYS A 183 22.526 44.509 -20.416 1.00 48.29 N ATOM 1679 HZ1 LYS A 183 21.926 45.304 -20.115 1.00 0.00 H ATOM 1680 HZ2 LYS A 183 23.063 44.150 -19.601 1.00 0.00 H ATOM 1681 HZ3 LYS A 183 23.185 44.831 -21.153 1.00 0.00 H ATOM 1682 H LYS A 183 19.406 39.606 -16.489 1.00 0.00 H ATOM 1683 N TYR A 184 20.644 42.252 -14.884 1.00 27.22 N ATOM 1684 CA TYR A 184 20.905 43.158 -13.770 1.00 32.31 C ATOM 1685 C TYR A 184 21.986 42.620 -12.825 1.00 35.63 C ATOM 1686 O TYR A 184 22.900 43.354 -12.433 1.00 37.69 O ATOM 1687 CB TYR A 184 19.612 43.419 -12.997 1.00 34.08 C ATOM 1688 CG TYR A 184 19.821 44.060 -11.647 1.00 33.23 C ATOM 1689 CD1 TYR A 184 20.090 45.419 -11.533 1.00 37.65 C ATOM 1690 CD2 TYR A 184 19.744 43.309 -10.482 1.00 33.78 C ATOM 1691 CE1 TYR A 184 20.274 46.007 -10.300 1.00 39.02 C ATOM 1692 CE2 TYR A 184 19.931 43.890 -9.245 1.00 38.18 C ATOM 1693 CZ TYR A 184 20.193 45.237 -9.159 1.00 40.84 C ATOM 1694 OH TYR A 184 20.380 45.813 -7.923 1.00 43.83 O ATOM 1695 HH TYR A 184 19.565 45.687 -7.375 1.00 0.00 H ATOM 1696 H TYR A 184 19.665 41.955 -15.074 1.00 0.00 H ATOM 1697 N LEU A 185 21.880 41.341 -12.470 1.00 31.92 N ATOM 1698 CA LEU A 185 22.834 40.711 -11.556 1.00 25.75 C ATOM 1699 C LEU A 185 24.223 40.560 -12.171 1.00 30.50 C ATOM 1700 O LEU A 185 25.228 40.705 -11.481 1.00 35.36 O ATOM 1701 CB LEU A 185 22.320 39.339 -11.104 1.00 23.89 C ATOM 1702 CG LEU A 185 21.084 39.362 -10.205 1.00 25.15 C ATOM 1703 CD1 LEU A 185 20.651 37.954 -9.859 1.00 24.02 C ATOM 1704 CD2 LEU A 185 21.350 40.171 -8.949 1.00 28.10 C ATOM 1705 H LEU A 185 21.097 40.774 -12.853 1.00 0.00 H ATOM 1706 N SER A 186 24.277 40.265 -13.465 1.00 32.38 N ATOM 1707 CA SER A 186 25.554 40.066 -14.142 1.00 35.70 C ATOM 1708 C SER A 186 26.336 41.374 -14.234 1.00 43.42 C ATOM 1709 O SER A 186 27.565 41.375 -14.215 1.00 47.87 O ATOM 1710 CB SER A 186 25.338 39.486 -15.540 1.00 36.93 C ATOM 1711 OG SER A 186 24.853 40.477 -16.428 1.00 43.52 O ATOM 1712 HG SER A 186 23.990 40.827 -16.091 1.00 0.00 H ATOM 1713 H SER A 186 23.393 40.174 -14.005 1.00 0.00 H ATOM 1714 N GLU A 187 25.612 42.484 -14.335 1.00 47.14 N ATOM 1715 CA GLU A 187 26.226 43.805 -14.406 1.00 49.66 C ATOM 1716 C GLU A 187 26.503 44.370 -13.016 1.00 52.57 C ATOM 1717 O GLU A 187 27.156 45.406 -12.877 1.00 52.87 O ATOM 1718 CB GLU A 187 25.333 44.767 -15.193 1.00 53.14 C ATOM 1719 CG GLU A 187 25.341 44.531 -16.696 1.00 55.99 C ATOM 1720 CD GLU A 187 24.094 45.064 -17.380 1.00 60.47 C ATOM 1721 OE1 GLU A 187 23.315 45.796 -16.729 1.00 59.65 O ATOM 1722 OE2 GLU A 187 23.889 44.741 -18.571 1.00 63.54 O ATOM 1723 H GLU A 187 24.575 42.408 -14.364 1.00 0.00 H ATOM 1724 N LYS A 188 26.002 43.686 -11.992 1.00 52.57 N ATOM 1725 CA LYS A 188 26.198 44.115 -10.611 1.00 57.40 C ATOM 1726 C LYS A 188 27.670 44.056 -10.225 1.00 64.78 C ATOM 1727 O LYS A 188 28.471 43.406 -10.900 1.00 68.01 O ATOM 1728 CB LYS A 188 25.372 43.250 -9.660 1.00 53.52 C ATOM 1729 CG LYS A 188 24.546 44.033 -8.655 1.00 54.33 C ATOM 1730 CD LYS A 188 24.013 43.123 -7.560 1.00 52.16 C ATOM 1731 CE LYS A 188 23.041 43.858 -6.656 1.00 53.08 C ATOM 1732 NZ LYS A 188 23.627 45.126 -6.147 1.00 55.56 N ATOM 1733 HZ1 LYS A 188 24.489 44.915 -5.604 1.00 0.00 H ATOM 1734 HZ2 LYS A 188 23.864 45.744 -6.949 1.00 0.00 H ATOM 1735 HZ3 LYS A 188 22.937 45.603 -5.533 1.00 0.00 H ATOM 1736 H LYS A 188 25.455 42.821 -12.180 1.00 0.00 H TER 1737 LYS A 188 ATOM 1738 N ALA B 1 -7.062 -10.175 -14.817 1.00 21.65 N ATOM 1739 CA ALA B 1 -6.738 -9.255 -13.734 1.00 21.77 C ATOM 1740 C ALA B 1 -7.244 -9.774 -12.402 1.00 23.14 C ATOM 1741 O ALA B 1 -8.395 -10.200 -12.294 1.00 24.76 O ATOM 1742 CB ALA B 1 -7.330 -7.871 -14.006 1.00 20.80 C ATOM 1743 HN3 ALA B 1 -8.094 -10.290 -14.876 1.00 0.00 H ATOM 1744 HN2 ALA B 1 -6.620 -11.098 -14.631 1.00 0.00 H ATOM 1745 HN1 ALA B 1 -6.703 -9.792 -15.715 1.00 0.00 H ATOM 1746 N GLN B 2 -6.373 -9.719 -11.397 1.00 24.03 N ATOM 1747 CA GLN B 2 -6.714 -10.086 -10.030 1.00 21.73 C ATOM 1748 C GLN B 2 -6.478 -8.870 -9.149 1.00 19.90 C ATOM 1749 O GLN B 2 -5.344 -8.421 -8.994 1.00 22.49 O ATOM 1750 CB GLN B 2 -5.876 -11.277 -9.556 1.00 22.74 C ATOM 1751 CG GLN B 2 -6.040 -12.530 -10.412 1.00 26.00 C ATOM 1752 CD GLN B 2 -7.428 -13.146 -10.298 1.00 26.40 C ATOM 1753 OE1 GLN B 2 -7.937 -13.357 -9.198 1.00 30.00 O ATOM 1754 NE2 GLN B 2 -8.047 -13.433 -11.439 1.00 19.55 N ATOM 1755 HE22 GLN B 2 -7.580 -13.238 -12.347 1.00 0.00 H ATOM 1756 HE21 GLN B 2 -8.999 -13.852 -11.423 1.00 0.00 H ATOM 1757 H GLN B 2 -5.404 -9.399 -11.598 1.00 0.00 H ATOM 1758 N TYR B 3 -7.550 -8.325 -8.589 1.00 21.23 N ATOM 1759 CA TYR B 3 -7.448 -7.041 -7.898 1.00 22.21 C ATOM 1760 C TYR B 3 -7.095 -7.228 -6.426 1.00 22.10 C ATOM 1761 O TYR B 3 -7.610 -8.118 -5.749 1.00 26.97 O ATOM 1762 CB TYR B 3 -8.745 -6.238 -8.060 1.00 22.44 C ATOM 1763 CG TYR B 3 -8.975 -5.859 -9.502 1.00 21.65 C ATOM 1764 CD1 TYR B 3 -8.349 -4.752 -10.052 1.00 21.41 C ATOM 1765 CD2 TYR B 3 -9.773 -6.650 -10.332 1.00 24.98 C ATOM 1766 CE1 TYR B 3 -8.526 -4.416 -11.390 1.00 24.30 C ATOM 1767 CE2 TYR B 3 -9.963 -6.322 -11.672 1.00 23.48 C ATOM 1768 CZ TYR B 3 -9.332 -5.205 -12.192 1.00 23.78 C ATOM 1769 OH TYR B 3 -9.496 -4.865 -13.519 1.00 26.07 O ATOM 1770 HH TYR B 3 -10.455 -4.700 -13.700 1.00 0.00 H ATOM 1771 H TYR B 3 -8.467 -8.813 -8.642 1.00 0.00 H ATOM 1772 N GLU B 4 -6.173 -6.391 -5.963 1.00 24.07 N ATOM 1773 CA GLU B 4 -5.708 -6.405 -4.582 1.00 25.30 C ATOM 1774 C GLU B 4 -5.440 -4.984 -4.138 1.00 23.24 C ATOM 1775 O GLU B 4 -4.860 -4.199 -4.890 1.00 20.73 O ATOM 1776 CB GLU B 4 -4.431 -7.236 -4.423 1.00 30.83 C ATOM 1777 CG GLU B 4 -4.601 -8.719 -4.652 1.00 41.71 C ATOM 1778 CD GLU B 4 -3.297 -9.478 -4.487 1.00 56.96 C ATOM 1779 OE1 GLU B 4 -2.334 -9.186 -5.230 1.00 59.27 O ATOM 1780 OE2 GLU B 4 -3.232 -10.363 -3.608 1.00 66.99 O ATOM 1781 H GLU B 4 -5.764 -5.693 -6.617 1.00 0.00 H ATOM 1782 N ASP B 5 -5.861 -4.661 -2.921 1.00 26.32 N ATOM 1783 CA ASP B 5 -5.535 -3.379 -2.318 1.00 27.69 C ATOM 1784 C ASP B 5 -4.019 -3.216 -2.337 1.00 28.44 C ATOM 1785 O ASP B 5 -3.283 -4.139 -1.975 1.00 27.37 O ATOM 1786 CB ASP B 5 -6.091 -3.311 -0.893 1.00 33.00 C ATOM 1787 CG ASP B 5 -5.867 -1.965 -0.232 1.00 36.33 C ATOM 1788 OD1 ASP B 5 -5.811 -0.944 -0.938 1.00 30.91 O ATOM 1789 OD2 ASP B 5 -5.759 -1.928 1.011 1.00 43.51 O ATOM 1790 H ASP B 5 -6.438 -5.341 -2.386 1.00 0.00 H ATOM 1791 N GLY B 6 -3.552 -2.064 -2.799 1.00 22.44 N ATOM 1792 CA GLY B 6 -2.127 -1.807 -2.866 1.00 23.65 C ATOM 1793 C GLY B 6 -1.516 -2.128 -4.215 1.00 25.91 C ATOM 1794 O GLY B 6 -0.377 -1.749 -4.491 1.00 28.80 O ATOM 1795 H GLY B 6 -4.219 -1.333 -3.118 1.00 0.00 H ATOM 1796 N LYS B 7 -2.271 -2.825 -5.064 1.00 24.13 N ATOM 1797 CA LYS B 7 -1.779 -3.200 -6.388 1.00 25.07 C ATOM 1798 C LYS B 7 -2.268 -2.202 -7.442 1.00 22.95 C ATOM 1799 O LYS B 7 -1.581 -1.226 -7.749 1.00 22.15 O ATOM 1800 CB LYS B 7 -2.219 -4.624 -6.749 1.00 24.85 C ATOM 1801 CG LYS B 7 -1.444 -5.245 -7.905 1.00 25.15 C ATOM 1802 H LYS B 7 -3.230 -3.108 -4.778 1.00 0.00 H ATOM 1803 N GLN B 8 -3.457 -2.438 -7.984 1.00 19.06 N ATOM 1804 CA GLN B 8 -4.003 -1.556 -9.010 1.00 17.79 C ATOM 1805 C GLN B 8 -4.571 -0.270 -8.426 1.00 18.95 C ATOM 1806 O GLN B 8 -4.863 0.666 -9.159 1.00 17.71 O ATOM 1807 CB GLN B 8 -5.101 -2.258 -9.810 1.00 18.82 C ATOM 1808 CG GLN B 8 -4.653 -3.507 -10.553 1.00 20.37 C ATOM 1809 CD GLN B 8 -4.839 -4.764 -9.742 1.00 21.82 C ATOM 1810 OE1 GLN B 8 -5.038 -4.708 -8.528 1.00 20.31 O ATOM 1811 NE2 GLN B 8 -4.784 -5.916 -10.409 1.00 22.69 N ATOM 1812 HE22 GLN B 8 -4.613 -5.915 -11.435 1.00 0.00 H ATOM 1813 HE21 GLN B 8 -4.912 -6.816 -9.904 1.00 0.00 H ATOM 1814 H GLN B 8 -4.007 -3.264 -7.673 1.00 0.00 H ATOM 1815 N TYR B 9 -4.746 -0.243 -7.110 1.00 17.89 N ATOM 1816 CA TYR B 9 -5.331 0.898 -6.425 1.00 19.87 C ATOM 1817 C TYR B 9 -4.865 0.865 -4.983 1.00 22.03 C ATOM 1818 O TYR B 9 -4.369 -0.158 -4.516 1.00 21.13 O ATOM 1819 CB TYR B 9 -6.863 0.858 -6.491 1.00 18.26 C ATOM 1820 CG TYR B 9 -7.456 -0.321 -5.741 1.00 19.63 C ATOM 1821 CD1 TYR B 9 -7.598 -1.559 -6.356 1.00 23.75 C ATOM 1822 CD2 TYR B 9 -7.861 -0.196 -4.414 1.00 20.67 C ATOM 1823 CE1 TYR B 9 -8.137 -2.643 -5.675 1.00 23.15 C ATOM 1824 CE2 TYR B 9 -8.395 -1.273 -3.723 1.00 22.18 C ATOM 1825 CZ TYR B 9 -8.530 -2.494 -4.362 1.00 26.31 C ATOM 1826 OH TYR B 9 -9.057 -3.570 -3.682 1.00 29.47 O ATOM 1827 HH TYR B 9 -9.975 -3.352 -3.382 1.00 0.00 H ATOM 1828 H TYR B 9 -4.454 -1.068 -6.549 1.00 0.00 H ATOM 1829 N THR B 10 -5.030 1.981 -4.284 1.00 19.59 N ATOM 1830 CA THR B 10 -4.823 2.025 -2.846 1.00 22.41 C ATOM 1831 C THR B 10 -6.095 2.540 -2.195 1.00 22.48 C ATOM 1832 O THR B 10 -6.982 3.056 -2.876 1.00 20.19 O ATOM 1833 CB THR B 10 -3.637 2.925 -2.450 1.00 23.53 C ATOM 1834 OG1 THR B 10 -3.822 4.228 -3.009 1.00 24.01 O ATOM 1835 CG2 THR B 10 -2.316 2.346 -2.952 1.00 25.60 C ATOM 1836 HG1 THR B 10 -3.060 4.806 -2.754 1.00 0.00 H ATOM 1837 H THR B 10 -5.316 2.849 -4.780 1.00 0.00 H ATOM 1838 N THR B 11 -6.186 2.395 -0.877 1.00 23.96 N ATOM 1839 CA THR B 11 -7.383 2.802 -0.152 1.00 23.60 C ATOM 1840 C THR B 11 -7.068 3.952 0.792 1.00 22.99 C ATOM 1841 O THR B 11 -6.181 3.838 1.640 1.00 27.82 O ATOM 1842 CB THR B 11 -7.975 1.613 0.635 1.00 26.22 C ATOM 1843 OG1 THR B 11 -8.257 0.547 -0.272 1.00 29.21 O ATOM 1844 CG2 THR B 11 -9.255 2.013 1.357 1.00 28.74 C ATOM 1845 HG1 THR B 11 -8.637 -0.218 0.228 1.00 0.00 H ATOM 1846 H THR B 11 -5.388 1.983 -0.353 1.00 0.00 H ATOM 1847 N LEU B 12 -7.775 5.071 0.633 1.00 26.83 N ATOM 1848 CA LEU B 12 -7.545 6.241 1.483 1.00 26.32 C ATOM 1849 C LEU B 12 -7.790 5.901 2.948 1.00 26.73 C ATOM 1850 O LEU B 12 -8.777 5.242 3.289 1.00 28.14 O ATOM 1851 CB LEU B 12 -8.441 7.409 1.062 1.00 22.15 C ATOM 1852 CG LEU B 12 -8.251 7.950 -0.363 1.00 21.78 C ATOM 1853 CD1 LEU B 12 -9.242 9.066 -0.639 1.00 22.65 C ATOM 1854 CD2 LEU B 12 -6.834 8.447 -0.601 1.00 29.51 C ATOM 1855 H LEU B 12 -8.503 5.114 -0.108 1.00 0.00 H ATOM 1856 N GLU B 13 -6.891 6.350 3.817 1.00 29.36 N ATOM 1857 CA GLU B 13 -7.074 6.138 5.249 1.00 32.62 C ATOM 1858 C GLU B 13 -8.255 6.966 5.746 1.00 32.35 C ATOM 1859 O GLU B 13 -8.974 6.553 6.657 1.00 33.44 O ATOM 1860 CB GLU B 13 -5.803 6.494 6.023 1.00 37.77 C ATOM 1861 H GLU B 13 -6.050 6.857 3.474 1.00 0.00 H ATOM 1862 N LYS B 14 -8.457 8.128 5.128 1.00 34.47 N ATOM 1863 CA LYS B 14 -9.574 9.005 5.472 1.00 36.89 C ATOM 1864 C LYS B 14 -10.498 9.195 4.272 1.00 35.21 C ATOM 1865 O LYS B 14 -10.343 10.145 3.513 1.00 36.58 O ATOM 1866 CB LYS B 14 -9.063 10.362 5.963 1.00 40.41 C ATOM 1867 CG LYS B 14 -8.098 10.273 7.135 1.00 45.87 C ATOM 1868 CD LYS B 14 -7.429 11.612 7.411 1.00 48.62 C ATOM 1869 H LYS B 14 -7.799 8.420 4.377 1.00 0.00 H ATOM 1870 N PRO B 15 -11.457 8.278 4.090 1.00 35.92 N ATOM 1871 CA PRO B 15 -12.386 8.360 2.956 1.00 36.19 C ATOM 1872 C PRO B 15 -13.212 9.647 2.944 1.00 38.01 C ATOM 1873 O PRO B 15 -13.509 10.212 3.998 1.00 40.63 O ATOM 1874 CB PRO B 15 -13.287 7.134 3.151 1.00 36.87 C ATOM 1875 CG PRO B 15 -13.109 6.742 4.586 1.00 38.94 C ATOM 1876 CD PRO B 15 -11.692 7.076 4.904 1.00 37.55 C ATOM 1877 N VAL B 16 -13.579 10.089 1.745 1.00 34.26 N ATOM 1878 CA VAL B 16 -14.292 11.347 1.556 1.00 35.91 C ATOM 1879 C VAL B 16 -15.782 11.133 1.299 1.00 38.91 C ATOM 1880 O VAL B 16 -16.160 10.509 0.305 1.00 43.07 O ATOM 1881 CB VAL B 16 -13.699 12.136 0.377 1.00 31.25 C ATOM 1882 CG1 VAL B 16 -14.292 13.542 0.319 1.00 29.40 C ATOM 1883 CG2 VAL B 16 -12.178 12.175 0.481 1.00 30.03 C ATOM 1884 H VAL B 16 -13.349 9.515 0.909 1.00 0.00 H ATOM 1885 N ALA B 17 -16.626 11.658 2.182 1.00 37.94 N ATOM 1886 CA ALA B 17 -18.071 11.534 2.008 1.00 37.35 C ATOM 1887 C ALA B 17 -18.593 12.502 0.942 1.00 37.54 C ATOM 1888 O ALA B 17 -18.079 13.611 0.787 1.00 36.37 O ATOM 1889 CB ALA B 17 -18.785 11.763 3.328 1.00 40.06 C ATOM 1890 H ALA B 17 -16.252 12.165 3.009 1.00 0.00 H ATOM 1891 N GLY B 18 -19.606 12.070 0.199 1.00 37.44 N ATOM 1892 CA GLY B 18 -20.217 12.914 -0.812 1.00 39.01 C ATOM 1893 C GLY B 18 -19.319 13.229 -1.995 1.00 34.48 C ATOM 1894 O GLY B 18 -19.602 14.139 -2.775 1.00 38.05 O ATOM 1895 H GLY B 18 -19.969 11.106 0.345 1.00 0.00 H ATOM 1896 N ALA B 19 -18.228 12.483 -2.140 1.00 33.27 N ATOM 1897 CA ALA B 19 -17.328 12.682 -3.274 1.00 30.51 C ATOM 1898 C ALA B 19 -17.997 12.234 -4.569 1.00 27.03 C ATOM 1899 O ALA B 19 -18.882 11.374 -4.540 1.00 25.24 O ATOM 1900 CB ALA B 19 -16.019 11.922 -3.061 1.00 29.63 C ATOM 1901 H ALA B 19 -18.012 11.748 -1.437 1.00 0.00 H ATOM 1902 N PRO B 20 -17.579 12.815 -5.710 1.00 27.24 N ATOM 1903 CA PRO B 20 -18.049 12.305 -7.004 1.00 25.72 C ATOM 1904 C PRO B 20 -17.748 10.815 -7.142 1.00 25.21 C ATOM 1905 O PRO B 20 -16.774 10.339 -6.554 1.00 27.13 O ATOM 1906 CB PRO B 20 -17.249 13.122 -8.027 1.00 23.10 C ATOM 1907 CG PRO B 20 -16.865 14.365 -7.311 1.00 24.43 C ATOM 1908 CD PRO B 20 -16.685 13.977 -5.864 1.00 27.63 C ATOM 1909 N GLN B 21 -18.577 10.095 -7.892 1.00 23.96 N ATOM 1910 CA GLN B 21 -18.382 8.665 -8.098 1.00 25.39 C ATOM 1911 C GLN B 21 -16.991 8.368 -8.670 1.00 22.91 C ATOM 1912 O GLN B 21 -16.276 7.488 -8.181 1.00 21.45 O ATOM 1913 CB GLN B 21 -19.465 8.116 -9.031 1.00 28.25 C ATOM 1914 CG GLN B 21 -20.888 8.323 -8.543 1.00 34.84 C ATOM 1915 CD GLN B 21 -21.908 8.221 -9.669 1.00 39.26 C ATOM 1916 OE1 GLN B 21 -21.994 9.099 -10.532 1.00 40.38 O ATOM 1917 NE2 GLN B 21 -22.674 7.142 -9.672 1.00 38.51 N ATOM 1918 HE22 GLN B 21 -22.568 6.427 -8.925 1.00 0.00 H ATOM 1919 HE21 GLN B 21 -23.382 7.009 -10.422 1.00 0.00 H ATOM 1920 H GLN B 21 -19.387 10.565 -8.344 1.00 0.00 H ATOM 1921 N VAL B 22 -16.613 9.102 -9.711 1.00 18.88 N ATOM 1922 CA VAL B 22 -15.286 8.969 -10.305 1.00 18.43 C ATOM 1923 C VAL B 22 -14.702 10.366 -10.470 1.00 19.32 C ATOM 1924 O VAL B 22 -15.268 11.210 -11.163 1.00 19.76 O ATOM 1925 CB VAL B 22 -15.321 8.232 -11.672 1.00 19.15 C ATOM 1926 CG1 VAL B 22 -13.916 8.119 -12.249 1.00 23.09 C ATOM 1927 CG2 VAL B 22 -15.934 6.851 -11.525 1.00 20.42 C ATOM 1928 H VAL B 22 -17.281 9.790 -10.114 1.00 0.00 H ATOM 1929 N LEU B 23 -13.590 10.622 -9.796 1.00 16.60 N ATOM 1930 CA LEU B 23 -13.021 11.963 -9.767 1.00 17.05 C ATOM 1931 C LEU B 23 -11.587 11.972 -10.243 1.00 17.76 C ATOM 1932 O LEU B 23 -10.708 11.334 -9.656 1.00 16.16 O ATOM 1933 CB LEU B 23 -13.099 12.559 -8.367 1.00 19.14 C ATOM 1934 CG LEU B 23 -12.457 13.945 -8.263 1.00 20.71 C ATOM 1935 CD1 LEU B 23 -13.049 14.927 -9.293 1.00 23.63 C ATOM 1936 CD2 LEU B 23 -12.620 14.480 -6.852 1.00 23.89 C ATOM 1937 H LEU B 23 -13.116 9.854 -9.280 1.00 0.00 H ATOM 1938 N GLU B 24 -11.356 12.717 -11.315 1.00 17.63 N ATOM 1939 CA GLU B 24 -10.037 12.821 -11.910 1.00 12.06 C ATOM 1940 C GLU B 24 -9.492 14.219 -11.659 1.00 13.63 C ATOM 1941 O GLU B 24 -10.233 15.199 -11.746 1.00 15.52 O ATOM 1942 CB GLU B 24 -10.120 12.518 -13.406 1.00 14.19 C ATOM 1943 CG GLU B 24 -8.804 12.528 -14.132 1.00 16.83 C ATOM 1944 CD GLU B 24 -8.978 12.196 -15.603 1.00 25.72 C ATOM 1945 OE1 GLU B 24 -10.095 11.788 -15.998 1.00 28.62 O ATOM 1946 OE2 GLU B 24 -8.001 12.331 -16.361 1.00 26.89 O ATOM 1947 H GLU B 24 -12.145 13.243 -11.743 1.00 0.00 H ATOM 1948 N PHE B 25 -8.212 14.299 -11.314 1.00 11.73 N ATOM 1949 CA PHE B 25 -7.515 15.572 -11.168 1.00 9.67 C ATOM 1950 C PHE B 25 -6.459 15.716 -12.255 1.00 14.03 C ATOM 1951 O PHE B 25 -5.779 14.754 -12.592 1.00 12.73 O ATOM 1952 CB PHE B 25 -6.837 15.675 -9.803 1.00 10.73 C ATOM 1953 CG PHE B 25 -7.786 15.817 -8.656 1.00 12.76 C ATOM 1954 CD1 PHE B 25 -8.248 17.070 -8.272 1.00 14.33 C ATOM 1955 CD2 PHE B 25 -8.195 14.704 -7.943 1.00 14.42 C ATOM 1956 CE1 PHE B 25 -9.112 17.215 -7.194 1.00 14.44 C ATOM 1957 CE2 PHE B 25 -9.059 14.842 -6.862 1.00 11.49 C ATOM 1958 CZ PHE B 25 -9.523 16.084 -6.490 1.00 13.79 C ATOM 1959 H PHE B 25 -7.686 13.419 -11.141 1.00 0.00 H ATOM 1960 N PHE B 26 -6.307 16.926 -12.778 1.00 10.76 N ATOM 1961 CA PHE B 26 -5.304 17.196 -13.808 1.00 13.02 C ATOM 1962 C PHE B 26 -4.900 18.662 -13.770 1.00 11.65 C ATOM 1963 O PHE B 26 -5.509 19.485 -13.067 1.00 13.09 O ATOM 1964 CB PHE B 26 -5.849 16.836 -15.200 1.00 12.68 C ATOM 1965 CG PHE B 26 -6.766 17.886 -15.784 1.00 10.85 C ATOM 1966 CD1 PHE B 26 -8.035 18.101 -15.260 1.00 12.62 C ATOM 1967 CD2 PHE B 26 -6.352 18.665 -16.859 1.00 11.82 C ATOM 1968 CE1 PHE B 26 -8.880 19.088 -15.797 1.00 15.34 C ATOM 1969 CE2 PHE B 26 -7.184 19.641 -17.412 1.00 13.02 C ATOM 1970 CZ PHE B 26 -8.457 19.853 -16.874 1.00 15.45 C ATOM 1971 H PHE B 26 -6.916 17.702 -12.447 1.00 0.00 H ATOM 1972 N SER B 27 -3.866 18.990 -14.543 1.00 11.98 N ATOM 1973 CA SER B 27 -3.494 20.372 -14.790 1.00 12.63 C ATOM 1974 C SER B 27 -3.117 20.508 -16.256 1.00 11.34 C ATOM 1975 O SER B 27 -2.530 19.580 -16.832 1.00 12.95 O ATOM 1976 CB SER B 27 -2.325 20.790 -13.900 1.00 19.90 C ATOM 1977 OG SER B 27 -1.655 21.902 -14.445 1.00 21.61 O ATOM 1978 HG SER B 27 -2.286 22.661 -14.522 1.00 0.00 H ATOM 1979 H SER B 27 -3.307 18.232 -14.984 1.00 0.00 H ATOM 1980 N PHE B 28 -3.432 21.650 -16.857 1.00 12.28 N ATOM 1981 CA PHE B 28 -3.066 21.883 -18.252 1.00 14.06 C ATOM 1982 C PHE B 28 -1.562 22.116 -18.426 1.00 14.68 C ATOM 1983 O PHE B 28 -1.073 22.071 -19.548 1.00 14.60 O ATOM 1984 CB PHE B 28 -3.858 23.062 -18.842 1.00 16.03 C ATOM 1985 CG PHE B 28 -5.282 22.716 -19.169 1.00 16.34 C ATOM 1986 CD1 PHE B 28 -5.574 21.858 -20.221 1.00 15.53 C ATOM 1987 CD2 PHE B 28 -6.325 23.231 -18.418 1.00 14.41 C ATOM 1988 CE1 PHE B 28 -6.882 21.526 -20.527 1.00 17.01 C ATOM 1989 CE2 PHE B 28 -7.637 22.901 -18.718 1.00 15.44 C ATOM 1990 CZ PHE B 28 -7.916 22.051 -19.772 1.00 16.07 C ATOM 1991 H PHE B 28 -3.944 22.385 -16.329 1.00 0.00 H ATOM 1992 N PHE B 29 -0.837 22.339 -17.327 1.00 13.84 N ATOM 1993 CA PHE B 29 0.630 22.468 -17.368 1.00 16.13 C ATOM 1994 C PHE B 29 1.350 21.125 -17.273 1.00 17.23 C ATOM 1995 O PHE B 29 2.547 21.025 -17.562 1.00 20.34 O ATOM 1996 CB PHE B 29 1.140 23.348 -16.219 1.00 17.31 C ATOM 1997 CG PHE B 29 1.123 24.811 -16.509 1.00 18.88 C ATOM 1998 CD1 PHE B 29 2.096 25.363 -17.303 1.00 18.90 C ATOM 1999 CD2 PHE B 29 0.159 25.638 -15.960 1.00 27.57 C ATOM 2000 CE1 PHE B 29 2.114 26.720 -17.572 1.00 36.86 C ATOM 2001 CE2 PHE B 29 0.169 26.996 -16.223 1.00 29.99 C ATOM 2002 CZ PHE B 29 1.147 27.533 -17.032 1.00 35.46 C ATOM 2003 H PHE B 29 -1.324 22.424 -16.412 1.00 0.00 H ATOM 2004 N CYS B 30 0.610 20.108 -16.859 1.00 14.33 N ATOM 2005 CA CYS B 30 1.174 18.822 -16.457 1.00 14.15 C ATOM 2006 C CYS B 30 1.414 17.910 -17.681 1.00 15.65 C ATOM 2007 O CYS B 30 0.465 17.512 -18.349 1.00 15.23 O ATOM 2008 CB CYS B 30 0.222 18.193 -15.429 1.00 15.27 C ATOM 2009 SG CYS B 30 0.293 16.427 -15.191 1.00 15.77 S ATOM 2010 H CYS B 30 -0.422 20.231 -16.818 1.00 0.00 H ATOM 2011 N PRO B 31 2.689 17.593 -17.988 1.00 15.88 N ATOM 2012 CA PRO B 31 2.903 16.866 -19.249 1.00 15.98 C ATOM 2013 C PRO B 31 2.391 15.428 -19.217 1.00 14.99 C ATOM 2014 O PRO B 31 1.940 14.945 -20.255 1.00 16.41 O ATOM 2015 CB PRO B 31 4.425 16.903 -19.433 1.00 20.09 C ATOM 2016 CG PRO B 31 4.992 17.153 -18.093 1.00 17.90 C ATOM 2017 CD PRO B 31 3.960 18.022 -17.380 1.00 15.20 C ATOM 2018 N HIS B 32 2.419 14.762 -18.067 1.00 14.69 N ATOM 2019 CA HIS B 32 1.858 13.419 -18.030 1.00 15.37 C ATOM 2020 C HIS B 32 0.334 13.472 -18.103 1.00 14.90 C ATOM 2021 O HIS B 32 -0.301 12.507 -18.542 1.00 14.53 O ATOM 2022 CB HIS B 32 2.293 12.641 -16.792 1.00 16.58 C ATOM 2023 CG HIS B 32 2.111 11.161 -16.940 1.00 17.86 C ATOM 2024 ND1 HIS B 32 2.501 10.475 -18.073 1.00 19.62 N ATOM 2025 CD2 HIS B 32 1.571 10.237 -16.109 1.00 19.90 C ATOM 2026 CE1 HIS B 32 2.222 9.191 -17.928 1.00 22.57 C ATOM 2027 NE2 HIS B 32 1.653 9.020 -16.747 1.00 23.45 N ATOM 2028 H HIS B 32 2.832 15.190 -17.214 1.00 0.00 H ATOM 2029 N CYS B 33 -0.241 14.609 -17.710 1.00 15.59 N ATOM 2030 CA CYS B 33 -1.680 14.830 -17.843 1.00 15.72 C ATOM 2031 C CYS B 33 -2.048 15.011 -19.311 1.00 14.75 C ATOM 2032 O CYS B 33 -3.081 14.523 -19.772 1.00 16.93 O ATOM 2033 CB CYS B 33 -2.129 16.053 -17.046 1.00 13.67 C ATOM 2034 SG CYS B 33 -1.714 15.999 -15.293 1.00 15.12 S ATOM 2035 H CYS B 33 0.350 15.359 -17.298 1.00 0.00 H ATOM 2036 N TYR B 34 -1.184 15.704 -20.044 1.00 12.78 N ATOM 2037 CA TYR B 34 -1.339 15.817 -21.493 1.00 14.05 C ATOM 2038 C TYR B 34 -1.298 14.416 -22.116 1.00 15.71 C ATOM 2039 O TYR B 34 -2.113 14.084 -22.971 1.00 17.77 O ATOM 2040 CB TYR B 34 -0.234 16.705 -22.076 1.00 15.04 C ATOM 2041 CG TYR B 34 -0.244 16.880 -23.589 1.00 16.73 C ATOM 2042 CD1 TYR B 34 0.219 15.879 -24.431 1.00 18.09 C ATOM 2043 CD2 TYR B 34 -0.678 18.067 -24.169 1.00 17.85 C ATOM 2044 CE1 TYR B 34 0.230 16.037 -25.796 1.00 19.98 C ATOM 2045 CE2 TYR B 34 -0.672 18.238 -25.544 1.00 19.77 C ATOM 2046 CZ TYR B 34 -0.216 17.213 -26.352 1.00 23.23 C ATOM 2047 OH TYR B 34 -0.186 17.347 -27.721 1.00 24.13 O ATOM 2048 HH TYR B 34 -1.103 17.513 -28.055 1.00 0.00 H ATOM 2049 H TYR B 34 -0.382 16.175 -19.578 1.00 0.00 H ATOM 2050 N GLN B 35 -0.330 13.606 -21.695 1.00 17.62 N ATOM 2051 CA GLN B 35 -0.230 12.226 -22.162 1.00 18.14 C ATOM 2052 C GLN B 35 -1.531 11.455 -21.913 1.00 16.89 C ATOM 2053 O GLN B 35 -2.092 10.841 -22.826 1.00 17.57 O ATOM 2054 CB GLN B 35 0.942 11.523 -21.471 1.00 18.00 C ATOM 2055 CG GLN B 35 1.166 10.078 -21.895 1.00 20.74 C ATOM 2056 CD GLN B 35 1.802 9.944 -23.276 1.00 25.58 C ATOM 2057 OE1 GLN B 35 2.043 10.935 -23.982 1.00 20.98 O ATOM 2058 NE2 GLN B 35 2.085 8.701 -23.667 1.00 28.76 N ATOM 2059 HE22 GLN B 35 1.866 7.897 -23.044 1.00 0.00 H ATOM 2060 HE21 GLN B 35 2.524 8.535 -24.595 1.00 0.00 H ATOM 2061 H GLN B 35 0.372 13.964 -21.017 1.00 0.00 H ATOM 2062 N PHE B 36 -1.999 11.498 -20.671 1.00 17.39 N ATOM 2063 CA PHE B 36 -3.227 10.818 -20.273 1.00 17.05 C ATOM 2064 C PHE B 36 -4.405 11.197 -21.146 1.00 18.66 C ATOM 2065 O PHE B 36 -5.116 10.337 -21.646 1.00 18.45 O ATOM 2066 CB PHE B 36 -3.572 11.152 -18.821 1.00 16.60 C ATOM 2067 CG PHE B 36 -3.237 10.071 -17.850 1.00 19.21 C ATOM 2068 CD1 PHE B 36 -2.083 9.320 -17.993 1.00 20.14 C ATOM 2069 CD2 PHE B 36 -4.071 9.823 -16.772 1.00 20.79 C ATOM 2070 CE1 PHE B 36 -1.772 8.322 -17.076 1.00 24.37 C ATOM 2071 CE2 PHE B 36 -3.765 8.831 -15.846 1.00 23.73 C ATOM 2072 CZ PHE B 36 -2.619 8.082 -15.998 1.00 20.60 C ATOM 2073 H PHE B 36 -1.470 12.036 -19.955 1.00 0.00 H ATOM 2074 N GLU B 37 -4.611 12.495 -21.318 1.00 17.28 N ATOM 2075 CA GLU B 37 -5.830 12.971 -21.950 1.00 18.59 C ATOM 2076 C GLU B 37 -5.733 13.036 -23.472 1.00 18.48 C ATOM 2077 O GLU B 37 -6.610 12.540 -24.178 1.00 22.36 O ATOM 2078 CB GLU B 37 -6.192 14.346 -21.371 1.00 18.89 C ATOM 2079 CG GLU B 37 -7.377 15.031 -22.029 1.00 18.84 C ATOM 2080 CD GLU B 37 -8.668 14.242 -21.924 1.00 22.98 C ATOM 2081 OE1 GLU B 37 -8.815 13.440 -20.975 1.00 22.72 O ATOM 2082 OE2 GLU B 37 -9.532 14.430 -22.805 1.00 24.33 O ATOM 2083 H GLU B 37 -3.895 13.178 -20.998 1.00 0.00 H ATOM 2084 N GLU B 38 -4.655 13.627 -23.984 1.00 21.43 N ATOM 2085 CA GLU B 38 -4.539 13.902 -25.411 1.00 22.70 C ATOM 2086 C GLU B 38 -4.033 12.714 -26.228 1.00 24.34 C ATOM 2087 O GLU B 38 -4.344 12.593 -27.407 1.00 25.45 O ATOM 2088 CB GLU B 38 -3.615 15.103 -25.646 1.00 22.60 C ATOM 2089 CG GLU B 38 -4.112 16.387 -25.025 1.00 20.53 C ATOM 2090 CD GLU B 38 -5.452 16.827 -25.595 1.00 21.81 C ATOM 2091 OE1 GLU B 38 -5.476 17.376 -26.713 1.00 26.71 O ATOM 2092 OE2 GLU B 38 -6.476 16.635 -24.912 1.00 24.17 O ATOM 2093 H GLU B 38 -3.877 13.899 -23.350 1.00 0.00 H ATOM 2094 N VAL B 39 -3.250 11.847 -25.596 1.00 22.31 N ATOM 2095 CA VAL B 39 -2.642 10.722 -26.294 1.00 24.94 C ATOM 2096 C VAL B 39 -3.313 9.395 -25.935 1.00 20.03 C ATOM 2097 O VAL B 39 -3.726 8.649 -26.837 1.00 24.57 O ATOM 2098 CB VAL B 39 -1.129 10.633 -26.000 1.00 24.84 C ATOM 2099 CG1 VAL B 39 -0.518 9.409 -26.676 1.00 27.57 C ATOM 2100 CG2 VAL B 39 -0.427 11.903 -26.465 1.00 26.78 C ATOM 2101 H VAL B 39 -3.067 11.974 -24.580 1.00 0.00 H ATOM 2102 N LEU B 40 -3.433 9.114 -24.638 1.00 19.81 N ATOM 2103 CA LEU B 40 -3.987 7.846 -24.160 1.00 21.24 C ATOM 2104 C LEU B 40 -5.521 7.849 -24.097 1.00 20.59 C ATOM 2105 O LEU B 40 -6.157 6.797 -24.200 1.00 22.02 O ATOM 2106 CB LEU B 40 -3.409 7.511 -22.787 1.00 18.38 C ATOM 2107 CG LEU B 40 -1.890 7.321 -22.737 1.00 21.86 C ATOM 2108 CD1 LEU B 40 -1.436 6.964 -21.336 1.00 23.28 C ATOM 2109 CD2 LEU B 40 -1.453 6.266 -23.740 1.00 24.25 C ATOM 2110 H LEU B 40 -3.122 9.820 -23.941 1.00 0.00 H ATOM 2111 N HIS B 41 -6.097 9.036 -23.952 1.00 21.62 N ATOM 2112 CA HIS B 41 -7.540 9.220 -23.758 1.00 21.29 C ATOM 2113 C HIS B 41 -8.070 8.428 -22.569 1.00 22.88 C ATOM 2114 O HIS B 41 -9.065 7.712 -22.680 1.00 21.87 O ATOM 2115 CB HIS B 41 -8.311 8.832 -25.014 1.00 23.25 C ATOM 2116 CG HIS B 41 -7.815 9.503 -26.254 1.00 24.22 C ATOM 2117 ND1 HIS B 41 -8.003 10.847 -26.499 1.00 25.22 N ATOM 2118 CD2 HIS B 41 -7.138 9.015 -27.318 1.00 25.44 C ATOM 2119 CE1 HIS B 41 -7.465 11.155 -27.667 1.00 26.56 C ATOM 2120 NE2 HIS B 41 -6.935 10.061 -28.184 1.00 27.89 N ATOM 2121 H HIS B 41 -5.493 9.882 -23.977 1.00 0.00 H ATOM 2122 N ILE B 42 -7.399 8.565 -21.430 1.00 18.64 N ATOM 2123 CA ILE B 42 -7.783 7.837 -20.228 1.00 18.95 C ATOM 2124 C ILE B 42 -9.232 8.120 -19.814 1.00 19.76 C ATOM 2125 O ILE B 42 -10.014 7.189 -19.617 1.00 23.98 O ATOM 2126 CB ILE B 42 -6.822 8.174 -19.060 1.00 19.24 C ATOM 2127 CG1 ILE B 42 -5.470 7.494 -19.291 1.00 18.62 C ATOM 2128 CG2 ILE B 42 -7.407 7.728 -17.732 1.00 18.02 C ATOM 2129 CD1 ILE B 42 -5.507 5.983 -19.156 1.00 20.50 C ATOM 2130 H ILE B 42 -6.581 9.207 -21.396 1.00 0.00 H ATOM 2131 N SER B 43 -9.590 9.395 -19.692 1.00 20.43 N ATOM 2132 CA SER B 43 -10.943 9.779 -19.279 1.00 21.98 C ATOM 2133 C SER B 43 -12.005 9.110 -20.139 1.00 22.82 C ATOM 2134 O SER B 43 -12.959 8.529 -19.627 1.00 25.51 O ATOM 2135 CB SER B 43 -11.123 11.299 -19.349 1.00 19.54 C ATOM 2136 OG SER B 43 -10.262 11.970 -18.456 1.00 27.19 O ATOM 2137 HG SER B 43 -10.454 11.676 -17.530 1.00 0.00 H ATOM 2138 H SER B 43 -8.892 10.139 -19.895 1.00 0.00 H ATOM 2139 N ASP B 44 -11.820 9.187 -21.452 1.00 21.24 N ATOM 2140 CA ASP B 44 -12.783 8.653 -22.402 1.00 22.47 C ATOM 2141 C ASP B 44 -12.893 7.131 -22.314 1.00 23.62 C ATOM 2142 O ASP B 44 -13.989 6.572 -22.403 1.00 26.43 O ATOM 2143 CB ASP B 44 -12.399 9.071 -23.826 1.00 25.60 C ATOM 2144 CG ASP B 44 -13.507 8.818 -24.832 1.00 29.38 C ATOM 2145 OD1 ASP B 44 -14.694 8.949 -24.463 1.00 29.81 O ATOM 2146 OD2 ASP B 44 -13.188 8.494 -25.998 1.00 32.18 O ATOM 2147 H ASP B 44 -10.958 9.644 -21.813 1.00 0.00 H ATOM 2148 N ASN B 45 -11.756 6.463 -22.141 1.00 25.43 N ATOM 2149 CA ASN B 45 -11.738 5.011 -22.086 1.00 25.14 C ATOM 2150 C ASN B 45 -12.323 4.475 -20.781 1.00 21.47 C ATOM 2151 O ASN B 45 -12.949 3.406 -20.763 1.00 23.38 O ATOM 2152 CB ASN B 45 -10.315 4.495 -22.302 1.00 25.73 C ATOM 2153 CG ASN B 45 -9.968 4.379 -23.775 1.00 27.86 C ATOM 2154 OD1 ASN B 45 -10.324 3.400 -24.426 1.00 34.16 O ATOM 2155 ND2 ASN B 45 -9.279 5.377 -24.306 1.00 25.50 N ATOM 2156 HD22 ASN B 45 -8.998 6.187 -23.717 1.00 0.00 H ATOM 2157 HD21 ASN B 45 -9.018 5.351 -25.312 1.00 0.00 H ATOM 2158 H ASN B 45 -10.864 6.989 -22.043 1.00 0.00 H ATOM 2159 N VAL B 46 -12.138 5.232 -19.703 1.00 21.95 N ATOM 2160 CA VAL B 46 -12.752 4.904 -18.425 1.00 20.98 C ATOM 2161 C VAL B 46 -14.269 5.045 -18.536 1.00 27.04 C ATOM 2162 O VAL B 46 -15.023 4.161 -18.127 1.00 23.42 O ATOM 2163 CB VAL B 46 -12.217 5.804 -17.295 1.00 19.09 C ATOM 2164 CG1 VAL B 46 -13.096 5.680 -16.054 1.00 20.13 C ATOM 2165 CG2 VAL B 46 -10.776 5.441 -16.972 1.00 16.06 C ATOM 2166 H VAL B 46 -11.540 6.080 -19.775 1.00 0.00 H ATOM 2167 N LYS B 47 -14.705 6.157 -19.119 1.00 25.42 N ATOM 2168 CA LYS B 47 -16.121 6.433 -19.287 1.00 26.14 C ATOM 2169 C LYS B 47 -16.824 5.344 -20.109 1.00 29.03 C ATOM 2170 O LYS B 47 -17.958 4.970 -19.807 1.00 33.50 O ATOM 2171 CB LYS B 47 -16.311 7.804 -19.948 1.00 29.02 C ATOM 2172 CG LYS B 47 -17.750 8.305 -19.976 1.00 34.80 C ATOM 2173 H LYS B 47 -14.011 6.850 -19.465 1.00 0.00 H ATOM 2174 N LYS B 48 -16.143 4.839 -21.140 1.00 29.17 N ATOM 2175 CA LYS B 48 -16.693 3.792 -22.016 1.00 35.11 C ATOM 2176 C LYS B 48 -17.054 2.535 -21.237 1.00 37.05 C ATOM 2177 O LYS B 48 -17.987 1.812 -21.592 1.00 38.59 O ATOM 2178 CB LYS B 48 -15.697 3.404 -23.114 1.00 39.47 C ATOM 2179 CG LYS B 48 -15.492 4.410 -24.230 1.00 48.45 C ATOM 2180 CD LYS B 48 -14.686 3.769 -25.359 1.00 54.15 C ATOM 2181 CE LYS B 48 -14.186 4.790 -26.371 1.00 54.90 C ATOM 2182 NZ LYS B 48 -13.061 5.612 -25.845 1.00 49.12 N ATOM 2183 HZ1 LYS B 48 -13.376 6.128 -24.999 1.00 0.00 H ATOM 2184 HZ2 LYS B 48 -12.265 4.990 -25.597 1.00 0.00 H ATOM 2185 HZ3 LYS B 48 -12.759 6.290 -26.573 1.00 0.00 H ATOM 2186 H LYS B 48 -15.186 5.199 -21.332 1.00 0.00 H ATOM 2187 N LYS B 49 -16.290 2.270 -20.182 1.00 30.63 N ATOM 2188 CA LYS B 49 -16.452 1.039 -19.420 1.00 34.46 C ATOM 2189 C LYS B 49 -17.233 1.252 -18.133 1.00 32.75 C ATOM 2190 O LYS B 49 -17.549 0.292 -17.431 1.00 39.02 O ATOM 2191 CB LYS B 49 -15.084 0.429 -19.110 1.00 33.90 C ATOM 2192 CG LYS B 49 -14.319 0.032 -20.357 1.00 38.62 C ATOM 2193 CD LYS B 49 -13.257 -0.997 -20.054 1.00 38.49 C ATOM 2194 CE LYS B 49 -12.699 -1.592 -21.339 1.00 42.28 C ATOM 2195 NZ LYS B 49 -11.679 -2.642 -21.083 1.00 45.38 N ATOM 2196 HZ1 LYS B 49 -10.887 -2.231 -20.549 1.00 0.00 H ATOM 2197 HZ2 LYS B 49 -12.108 -3.413 -20.532 1.00 0.00 H ATOM 2198 HZ3 LYS B 49 -11.331 -3.014 -21.990 1.00 0.00 H ATOM 2199 H LYS B 49 -15.562 2.955 -19.895 1.00 0.00 H ATOM 2200 N LEU B 50 -17.543 2.507 -17.823 1.00 42.32 N ATOM 2201 CA LEU B 50 -18.296 2.811 -16.617 1.00 40.44 C ATOM 2202 C LEU B 50 -19.716 2.287 -16.730 1.00 45.32 C ATOM 2203 O LEU B 50 -20.301 2.301 -17.815 1.00 45.04 O ATOM 2204 CB LEU B 50 -18.322 4.310 -16.348 1.00 35.53 C ATOM 2205 CG LEU B 50 -17.099 4.928 -15.675 1.00 36.12 C ATOM 2206 CD1 LEU B 50 -17.452 6.309 -15.180 1.00 37.31 C ATOM 2207 CD2 LEU B 50 -16.630 4.050 -14.531 1.00 41.24 C ATOM 2208 H LEU B 50 -17.243 3.280 -18.450 1.00 0.00 H ATOM 2209 N PRO B 51 -20.271 1.815 -15.603 1.00 49.34 N ATOM 2210 CA PRO B 51 -21.652 1.334 -15.556 1.00 55.66 C ATOM 2211 C PRO B 51 -22.634 2.466 -15.829 1.00 56.34 C ATOM 2212 O PRO B 51 -22.282 3.635 -15.656 1.00 55.94 O ATOM 2213 CB PRO B 51 -21.799 0.808 -14.122 1.00 56.14 C ATOM 2214 CG PRO B 51 -20.396 0.616 -13.628 1.00 51.61 C ATOM 2215 CD PRO B 51 -19.600 1.685 -14.299 1.00 47.55 C ATOM 2216 N GLU B 52 -23.841 2.121 -16.262 1.00 57.91 N ATOM 2217 CA GLU B 52 -24.884 3.112 -16.500 1.00 56.71 C ATOM 2218 C GLU B 52 -25.176 3.878 -15.215 1.00 54.95 C ATOM 2219 O GLU B 52 -25.301 3.282 -14.146 1.00 56.50 O ATOM 2220 CB GLU B 52 -26.162 2.445 -17.028 1.00 57.84 C ATOM 2221 H GLU B 52 -24.048 1.117 -16.436 1.00 0.00 H ATOM 2222 N GLY B 53 -25.258 5.201 -15.322 1.00 52.45 N ATOM 2223 CA GLY B 53 -25.568 6.037 -14.177 1.00 49.52 C ATOM 2224 C GLY B 53 -24.345 6.635 -13.506 1.00 48.06 C ATOM 2225 O GLY B 53 -24.441 7.654 -12.824 1.00 52.26 O ATOM 2226 H GLY B 53 -25.096 5.647 -16.248 1.00 0.00 H ATOM 2227 N VAL B 54 -23.191 6.004 -13.698 1.00 43.70 N ATOM 2228 CA VAL B 54 -21.958 6.498 -13.096 1.00 40.14 C ATOM 2229 C VAL B 54 -21.316 7.571 -13.974 1.00 37.12 C ATOM 2230 O VAL B 54 -20.878 7.295 -15.090 1.00 35.84 O ATOM 2231 CB VAL B 54 -20.951 5.358 -12.853 1.00 40.64 C ATOM 2232 CG1 VAL B 54 -19.663 5.910 -12.251 1.00 37.57 C ATOM 2233 CG2 VAL B 54 -21.562 4.300 -11.948 1.00 40.73 C ATOM 2234 H VAL B 54 -23.167 5.146 -14.286 1.00 0.00 H ATOM 2235 N LYS B 55 -21.271 8.796 -13.460 1.00 36.06 N ATOM 2236 CA LYS B 55 -20.734 9.929 -14.203 1.00 34.09 C ATOM 2237 C LYS B 55 -19.288 10.198 -13.824 1.00 33.75 C ATOM 2238 O LYS B 55 -18.846 9.857 -12.724 1.00 34.24 O ATOM 2239 CB LYS B 55 -21.574 11.185 -13.955 1.00 34.63 C ATOM 2240 H LYS B 55 -21.631 8.951 -12.497 1.00 0.00 H ATOM 2241 N MET B 56 -18.556 10.811 -14.744 1.00 30.28 N ATOM 2242 CA MET B 56 -17.174 11.176 -14.492 1.00 29.59 C ATOM 2243 C MET B 56 -17.064 12.645 -14.163 1.00 29.05 C ATOM 2244 O MET B 56 -17.732 13.483 -14.764 1.00 27.20 O ATOM 2245 CB MET B 56 -16.297 10.863 -15.695 1.00 30.60 C ATOM 2246 CG MET B 56 -16.171 9.395 -15.973 1.00 35.36 C ATOM 2247 SD MET B 56 -14.697 9.017 -16.920 1.00 57.90 S ATOM 2248 CE MET B 56 -13.429 9.648 -15.825 1.00 29.58 C ATOM 2249 H MET B 56 -18.981 11.035 -15.666 1.00 0.00 H ATOM 2250 N THR B 57 -16.212 12.950 -13.201 1.00 26.89 N ATOM 2251 CA THR B 57 -15.951 14.327 -12.844 1.00 22.68 C ATOM 2252 C THR B 57 -14.459 14.580 -12.984 1.00 18.23 C ATOM 2253 O THR B 57 -13.641 13.712 -12.677 1.00 16.91 O ATOM 2254 CB THR B 57 -16.431 14.626 -11.426 1.00 23.86 C ATOM 2255 OG1 THR B 57 -17.818 14.275 -11.317 1.00 26.91 O ATOM 2256 CG2 THR B 57 -16.252 16.091 -11.104 1.00 22.34 C ATOM 2257 HG1 THR B 57 -17.929 13.311 -11.511 1.00 0.00 H ATOM 2258 H THR B 57 -15.721 12.188 -12.692 1.00 0.00 H ATOM 2259 N LYS B 58 -14.102 15.754 -13.492 1.00 18.17 N ATOM 2260 CA LYS B 58 -12.700 16.086 -13.695 1.00 13.71 C ATOM 2261 C LYS B 58 -12.428 17.496 -13.189 1.00 12.11 C ATOM 2262 O LYS B 58 -13.122 18.442 -13.579 1.00 13.67 O ATOM 2263 CB LYS B 58 -12.321 15.967 -15.167 1.00 18.65 C ATOM 2264 CG LYS B 58 -10.900 16.352 -15.435 1.00 23.96 C ATOM 2265 CD LYS B 58 -10.232 15.413 -16.434 1.00 33.74 C ATOM 2266 CE LYS B 58 -11.017 15.326 -17.723 1.00 32.27 C ATOM 2267 NZ LYS B 58 -10.167 14.837 -18.853 1.00 27.54 N ATOM 2268 HZ1 LYS B 58 -9.372 15.492 -18.996 1.00 0.00 H ATOM 2269 HZ2 LYS B 58 -9.802 13.890 -18.626 1.00 0.00 H ATOM 2270 HZ3 LYS B 58 -10.739 14.790 -19.720 1.00 0.00 H ATOM 2271 H LYS B 58 -14.835 16.446 -13.748 1.00 0.00 H ATOM 2272 N TYR B 59 -11.450 17.614 -12.287 1.00 11.63 N ATOM 2273 CA TYR B 59 -11.106 18.899 -11.679 1.00 12.67 C ATOM 2274 C TYR B 59 -9.677 19.312 -11.993 1.00 13.33 C ATOM 2275 O TYR B 59 -8.792 18.472 -12.094 1.00 11.87 O ATOM 2276 CB TYR B 59 -11.262 18.840 -10.163 1.00 12.35 C ATOM 2277 CG TYR B 59 -12.674 18.769 -9.622 1.00 14.60 C ATOM 2278 CD1 TYR B 59 -13.773 19.128 -10.396 1.00 14.54 C ATOM 2279 CD2 TYR B 59 -12.896 18.378 -8.309 1.00 14.81 C ATOM 2280 CE1 TYR B 59 -15.068 19.075 -9.871 1.00 18.26 C ATOM 2281 CE2 TYR B 59 -14.182 18.314 -7.784 1.00 17.38 C ATOM 2282 CZ TYR B 59 -15.254 18.669 -8.569 1.00 18.71 C ATOM 2283 OH TYR B 59 -16.529 18.613 -8.047 1.00 23.22 O ATOM 2284 HH TYR B 59 -17.179 18.898 -8.737 1.00 0.00 H ATOM 2285 H TYR B 59 -10.917 16.766 -12.008 1.00 0.00 H ATOM 2286 N HIS B 60 -9.476 20.622 -12.107 1.00 11.83 N ATOM 2287 CA HIS B 60 -8.175 21.221 -12.386 1.00 11.59 C ATOM 2288 C HIS B 60 -7.491 21.621 -11.081 1.00 14.61 C ATOM 2289 O HIS B 60 -8.146 22.028 -10.127 1.00 17.32 O ATOM 2290 CB HIS B 60 -8.339 22.443 -13.302 1.00 11.53 C ATOM 2291 CG HIS B 60 -7.063 22.903 -13.938 1.00 12.40 C ATOM 2292 ND1 HIS B 60 -6.270 23.886 -13.386 1.00 13.27 N ATOM 2293 CD2 HIS B 60 -6.436 22.509 -15.076 1.00 15.56 C ATOM 2294 CE1 HIS B 60 -5.213 24.082 -14.157 1.00 14.39 C ATOM 2295 NE2 HIS B 60 -5.293 23.263 -15.192 1.00 14.57 N ATOM 2296 H HIS B 60 -10.293 21.255 -11.991 1.00 0.00 H ATOM 2297 N VAL B 61 -6.173 21.479 -11.040 1.00 13.53 N ATOM 2298 CA VAL B 61 -5.390 21.873 -9.877 1.00 15.03 C ATOM 2299 C VAL B 61 -4.208 22.714 -10.322 1.00 20.91 C ATOM 2300 O VAL B 61 -3.923 22.826 -11.513 1.00 21.13 O ATOM 2301 CB VAL B 61 -4.869 20.667 -9.094 1.00 19.67 C ATOM 2302 CG1 VAL B 61 -6.016 19.757 -8.705 1.00 22.82 C ATOM 2303 CG2 VAL B 61 -3.842 19.909 -9.926 1.00 25.72 C ATOM 2304 H VAL B 61 -5.684 21.074 -11.863 1.00 0.00 H ATOM 2305 N ASN B 62 -3.497 23.280 -9.363 1.00 25.55 N ATOM 2306 CA ASN B 62 -2.398 24.172 -9.695 1.00 28.62 C ATOM 2307 C ASN B 62 -1.130 23.919 -8.885 1.00 32.44 C ATOM 2308 O ASN B 62 -0.831 24.652 -7.947 1.00 41.18 O ATOM 2309 CB ASN B 62 -2.852 25.614 -9.507 1.00 25.88 C ATOM 2310 CG ASN B 62 -1.879 26.608 -10.094 1.00 28.66 C ATOM 2311 OD1 ASN B 62 -1.129 26.282 -11.016 1.00 29.57 O ATOM 2312 ND2 ASN B 62 -1.880 27.831 -9.564 1.00 29.89 N ATOM 2313 HD22 ASN B 62 -2.531 28.060 -8.786 1.00 0.00 H ATOM 2314 HD21 ASN B 62 -1.229 28.556 -9.928 1.00 0.00 H ATOM 2315 H ASN B 62 -3.724 23.087 -8.367 1.00 0.00 H ATOM 2316 N PHE B 63 -0.376 22.888 -9.256 1.00 33.59 N ATOM 2317 CA PHE B 63 0.900 22.615 -8.602 1.00 34.67 C ATOM 2318 C PHE B 63 2.042 23.394 -9.245 1.00 34.26 C ATOM 2319 O PHE B 63 3.020 23.735 -8.578 1.00 38.19 O ATOM 2320 CB PHE B 63 1.229 21.119 -8.640 1.00 36.65 C ATOM 2321 CG PHE B 63 0.350 20.273 -7.764 1.00 34.65 C ATOM 2322 CD1 PHE B 63 0.462 20.327 -6.385 1.00 38.87 C ATOM 2323 CD2 PHE B 63 -0.569 19.399 -8.319 1.00 31.32 C ATOM 2324 CE1 PHE B 63 -0.348 19.537 -5.575 1.00 40.99 C ATOM 2325 CE2 PHE B 63 -1.377 18.611 -7.518 1.00 29.62 C ATOM 2326 CZ PHE B 63 -1.266 18.679 -6.146 1.00 33.33 C ATOM 2327 H PHE B 63 -0.701 22.267 -10.024 1.00 0.00 H ATOM 2328 N MET B 64 1.914 23.673 -10.540 1.00 30.41 N ATOM 2329 CA MET B 64 3.017 24.248 -11.312 1.00 37.09 C ATOM 2330 C MET B 64 2.816 25.680 -11.805 1.00 34.87 C ATOM 2331 O MET B 64 3.786 26.366 -12.125 1.00 33.94 O ATOM 2332 CB MET B 64 3.302 23.367 -12.534 1.00 43.72 C ATOM 2333 CG MET B 64 4.013 22.065 -12.228 1.00 50.02 C ATOM 2334 SD MET B 64 5.631 22.359 -11.491 1.00 59.88 S ATOM 2335 CE MET B 64 5.347 21.797 -9.809 1.00 39.15 C ATOM 2336 H MET B 64 1.009 23.478 -11.015 1.00 0.00 H ATOM 2337 N GLY B 65 1.569 26.132 -11.878 1.00 33.83 N ATOM 2338 CA GLY B 65 1.256 27.275 -12.719 1.00 33.90 C ATOM 2339 C GLY B 65 1.221 28.688 -12.163 1.00 28.34 C ATOM 2340 O GLY B 65 0.992 29.617 -12.931 1.00 28.45 O ATOM 2341 H GLY B 65 0.816 25.667 -11.332 1.00 0.00 H ATOM 2342 N GLY B 66 1.450 28.875 -10.864 1.00 23.58 N ATOM 2343 CA GLY B 66 1.349 30.213 -10.287 1.00 26.96 C ATOM 2344 C GLY B 66 0.004 30.891 -10.546 1.00 24.84 C ATOM 2345 O GLY B 66 -1.039 30.230 -10.541 1.00 20.03 O ATOM 2346 H GLY B 66 1.701 28.067 -10.260 1.00 0.00 H ATOM 2347 N ASP B 67 0.011 32.205 -10.784 1.00 23.29 N ATOM 2348 CA ASP B 67 -1.240 32.936 -11.002 1.00 20.80 C ATOM 2349 C ASP B 67 -1.959 32.488 -12.272 1.00 18.24 C ATOM 2350 O ASP B 67 -3.181 32.391 -12.293 1.00 18.40 O ATOM 2351 CB ASP B 67 -0.998 34.450 -11.065 1.00 23.58 C ATOM 2352 CG ASP B 67 -1.145 35.121 -9.716 1.00 33.54 C ATOM 2353 OD1 ASP B 67 -1.743 34.513 -8.802 1.00 39.75 O ATOM 2354 OD2 ASP B 67 -0.661 36.260 -9.569 1.00 33.21 O ATOM 2355 H ASP B 67 0.916 32.716 -10.815 1.00 0.00 H ATOM 2356 N LEU B 68 -1.202 32.216 -13.332 1.00 17.53 N ATOM 2357 CA LEU B 68 -1.814 31.739 -14.567 1.00 14.11 C ATOM 2358 C LEU B 68 -2.481 30.385 -14.319 1.00 15.07 C ATOM 2359 O LEU B 68 -3.547 30.094 -14.880 1.00 16.21 O ATOM 2360 CB LEU B 68 -0.773 31.642 -15.690 1.00 15.86 C ATOM 2361 CG LEU B 68 -1.233 31.158 -17.069 1.00 17.70 C ATOM 2362 CD1 LEU B 68 -2.364 32.024 -17.622 1.00 18.35 C ATOM 2363 CD2 LEU B 68 -0.041 31.129 -18.036 1.00 17.54 C ATOM 2364 H LEU B 68 -0.171 32.344 -13.280 1.00 0.00 H ATOM 2365 N GLY B 69 -1.854 29.576 -13.464 1.00 16.52 N ATOM 2366 CA GLY B 69 -2.427 28.304 -13.053 1.00 17.32 C ATOM 2367 C GLY B 69 -3.792 28.498 -12.415 1.00 15.65 C ATOM 2368 O GLY B 69 -4.717 27.729 -12.682 1.00 13.96 O ATOM 2369 H GLY B 69 -0.931 29.862 -13.081 1.00 0.00 H ATOM 2370 N LYS B 70 -3.912 29.526 -11.580 1.00 16.14 N ATOM 2371 CA LYS B 70 -5.195 29.868 -10.971 1.00 14.09 C ATOM 2372 C LYS B 70 -6.209 30.298 -12.028 1.00 13.73 C ATOM 2373 O LYS B 70 -7.392 29.949 -11.941 1.00 14.60 O ATOM 2374 CB LYS B 70 -5.027 30.978 -9.924 1.00 17.52 C ATOM 2375 CG LYS B 70 -4.356 30.527 -8.636 1.00 22.23 C ATOM 2376 CD LYS B 70 -4.680 31.486 -7.496 1.00 29.32 C ATOM 2377 CE LYS B 70 -4.080 31.013 -6.184 1.00 44.66 C ATOM 2378 NZ LYS B 70 -2.616 31.281 -6.117 1.00 52.03 N ATOM 2379 HZ1 LYS B 70 -2.138 30.782 -6.894 1.00 0.00 H ATOM 2380 HZ2 LYS B 70 -2.448 32.304 -6.204 1.00 0.00 H ATOM 2381 HZ3 LYS B 70 -2.244 30.943 -5.206 1.00 0.00 H ATOM 2382 H LYS B 70 -3.074 30.099 -11.356 1.00 0.00 H ATOM 2383 N ASP B 71 -5.752 31.041 -13.035 1.00 16.49 N ATOM 2384 CA ASP B 71 -6.644 31.424 -14.132 1.00 15.34 C ATOM 2385 C ASP B 71 -7.158 30.180 -14.853 1.00 15.68 C ATOM 2386 O ASP B 71 -8.334 30.111 -15.241 1.00 14.45 O ATOM 2387 CB ASP B 71 -5.941 32.352 -15.125 1.00 18.59 C ATOM 2388 CG ASP B 71 -5.801 33.766 -14.609 1.00 18.21 C ATOM 2389 OD1 ASP B 71 -6.697 34.237 -13.883 1.00 17.52 O ATOM 2390 OD2 ASP B 71 -4.789 34.417 -14.946 1.00 20.51 O ATOM 2391 H ASP B 71 -4.759 31.350 -13.042 1.00 0.00 H ATOM 2392 N LEU B 72 -6.278 29.196 -15.039 1.00 11.58 N ATOM 2393 CA LEU B 72 -6.673 27.960 -15.712 1.00 13.16 C ATOM 2394 C LEU B 72 -7.705 27.183 -14.894 1.00 12.36 C ATOM 2395 O LEU B 72 -8.638 26.620 -15.463 1.00 12.28 O ATOM 2396 CB LEU B 72 -5.453 27.077 -16.001 1.00 14.44 C ATOM 2397 CG LEU B 72 -4.625 27.551 -17.198 1.00 15.02 C ATOM 2398 CD1 LEU B 72 -3.256 26.893 -17.147 1.00 15.44 C ATOM 2399 CD2 LEU B 72 -5.354 27.230 -18.520 1.00 18.21 C ATOM 2400 H LEU B 72 -5.301 29.309 -14.702 1.00 0.00 H ATOM 2401 N THR B 73 -7.552 27.157 -13.577 1.00 13.17 N ATOM 2402 CA THR B 73 -8.528 26.486 -12.725 1.00 13.51 C ATOM 2403 C THR B 73 -9.876 27.192 -12.813 1.00 14.55 C ATOM 2404 O THR B 73 -10.919 26.545 -12.860 1.00 13.68 O ATOM 2405 CB THR B 73 -8.057 26.426 -11.261 1.00 15.89 C ATOM 2406 OG1 THR B 73 -6.875 25.612 -11.189 1.00 15.35 O ATOM 2407 CG2 THR B 73 -9.143 25.835 -10.354 1.00 15.47 C ATOM 2408 HG1 THR B 73 -6.563 25.567 -10.250 1.00 0.00 H ATOM 2409 H THR B 73 -6.727 27.620 -13.146 1.00 0.00 H ATOM 2410 N GLN B 74 -9.857 28.520 -12.852 1.00 14.71 N ATOM 2411 CA GLN B 74 -11.107 29.275 -12.990 1.00 14.52 C ATOM 2412 C GLN B 74 -11.712 29.085 -14.382 1.00 13.63 C ATOM 2413 O GLN B 74 -12.926 28.956 -14.514 1.00 14.84 O ATOM 2414 CB GLN B 74 -10.887 30.764 -12.685 1.00 12.85 C ATOM 2415 CG GLN B 74 -12.180 31.602 -12.688 1.00 13.82 C ATOM 2416 CD GLN B 74 -12.050 32.928 -11.972 1.00 18.74 C ATOM 2417 OE1 GLN B 74 -11.042 33.215 -11.329 1.00 17.70 O ATOM 2418 NE2 GLN B 74 -13.091 33.751 -12.070 1.00 19.88 N ATOM 2419 HE22 GLN B 74 -13.925 33.470 -12.624 1.00 0.00 H ATOM 2420 HE21 GLN B 74 -13.070 34.675 -11.593 1.00 0.00 H ATOM 2421 H GLN B 74 -8.951 29.027 -12.784 1.00 0.00 H ATOM 2422 N ALA B 75 -10.873 29.050 -15.416 1.00 11.87 N ATOM 2423 CA ALA B 75 -11.366 28.769 -16.755 1.00 12.46 C ATOM 2424 C ALA B 75 -11.958 27.367 -16.847 1.00 10.04 C ATOM 2425 O ALA B 75 -12.957 27.166 -17.540 1.00 12.91 O ATOM 2426 CB ALA B 75 -10.265 28.946 -17.781 1.00 13.23 C ATOM 2427 H ALA B 75 -9.859 29.225 -15.265 1.00 0.00 H ATOM 2428 N TRP B 76 -11.358 26.398 -16.156 1.00 11.58 N ATOM 2429 CA TRP B 76 -11.920 25.049 -16.151 1.00 11.91 C ATOM 2430 C TRP B 76 -13.282 25.056 -15.443 1.00 12.90 C ATOM 2431 O TRP B 76 -14.207 24.357 -15.864 1.00 12.92 O ATOM 2432 CB TRP B 76 -10.975 24.043 -15.490 1.00 11.11 C ATOM 2433 CG TRP B 76 -11.487 22.642 -15.641 1.00 13.08 C ATOM 2434 CD1 TRP B 76 -11.957 21.831 -14.650 1.00 11.32 C ATOM 2435 CD2 TRP B 76 -11.636 21.914 -16.866 1.00 10.56 C ATOM 2436 NE1 TRP B 76 -12.382 20.632 -15.179 1.00 12.39 N ATOM 2437 CE2 TRP B 76 -12.186 20.656 -16.537 1.00 11.29 C ATOM 2438 CE3 TRP B 76 -11.362 22.205 -18.211 1.00 12.06 C ATOM 2439 CZ2 TRP B 76 -12.457 19.680 -17.501 1.00 13.76 C ATOM 2440 CZ3 TRP B 76 -11.621 21.229 -19.167 1.00 13.92 C ATOM 2441 CH2 TRP B 76 -12.156 19.981 -18.804 1.00 13.67 C ATOM 2442 HE1 TRP B 76 -12.785 19.840 -14.639 1.00 0.00 H ATOM 2443 H TRP B 76 -10.490 26.602 -15.621 1.00 0.00 H ATOM 2444 N ALA B 77 -13.398 25.835 -14.367 1.00 13.76 N ATOM 2445 CA ALA B 77 -14.684 26.045 -13.714 1.00 15.51 C ATOM 2446 C ALA B 77 -15.719 26.591 -14.717 1.00 16.20 C ATOM 2447 O ALA B 77 -16.842 26.117 -14.758 1.00 14.55 O ATOM 2448 CB ALA B 77 -14.529 26.990 -12.514 1.00 13.18 C ATOM 2449 H ALA B 77 -12.552 26.303 -13.985 1.00 0.00 H ATOM 2450 N VAL B 78 -15.324 27.560 -15.540 1.00 13.16 N ATOM 2451 CA VAL B 78 -16.218 28.087 -16.579 1.00 15.09 C ATOM 2452 C VAL B 78 -16.606 26.981 -17.574 1.00 13.36 C ATOM 2453 O VAL B 78 -17.771 26.881 -17.962 1.00 14.53 O ATOM 2454 CB VAL B 78 -15.572 29.279 -17.337 1.00 14.47 C ATOM 2455 CG1 VAL B 78 -16.365 29.633 -18.600 1.00 13.91 C ATOM 2456 CG2 VAL B 78 -15.479 30.493 -16.422 1.00 15.70 C ATOM 2457 H VAL B 78 -14.365 27.951 -15.445 1.00 0.00 H ATOM 2458 N ALA B 79 -15.639 26.146 -17.963 1.00 12.51 N ATOM 2459 CA ALA B 79 -15.922 25.058 -18.903 1.00 12.05 C ATOM 2460 C ALA B 79 -16.949 24.102 -18.308 1.00 13.78 C ATOM 2461 O ALA B 79 -17.872 23.650 -18.995 1.00 14.98 O ATOM 2462 CB ALA B 79 -14.629 24.315 -19.272 1.00 13.93 C ATOM 2463 H ALA B 79 -14.674 26.269 -17.595 1.00 0.00 H ATOM 2464 N MET B 80 -16.807 23.810 -17.018 1.00 11.53 N ATOM 2465 CA MET B 80 -17.796 22.970 -16.338 1.00 13.98 C ATOM 2466 C MET B 80 -19.160 23.658 -16.245 1.00 15.43 C ATOM 2467 O MET B 80 -20.196 23.029 -16.504 1.00 16.69 O ATOM 2468 CB MET B 80 -17.299 22.580 -14.949 1.00 13.09 C ATOM 2469 CG MET B 80 -16.136 21.590 -14.987 1.00 13.54 C ATOM 2470 SD MET B 80 -15.719 20.963 -13.346 1.00 16.91 S ATOM 2471 CE MET B 80 -14.994 22.409 -12.577 1.00 15.13 C ATOM 2472 H MET B 80 -15.991 24.179 -16.490 1.00 0.00 H ATOM 2473 N ALA B 81 -19.157 24.941 -15.887 1.00 15.44 N ATOM 2474 CA ALA B 81 -20.396 25.714 -15.739 1.00 15.92 C ATOM 2475 C ALA B 81 -21.185 25.780 -17.046 1.00 14.40 C ATOM 2476 O ALA B 81 -22.423 25.734 -17.037 1.00 17.30 O ATOM 2477 CB ALA B 81 -20.085 27.138 -15.244 1.00 14.49 C ATOM 2478 H ALA B 81 -18.247 25.411 -15.706 1.00 0.00 H ATOM 2479 N LEU B 82 -20.456 25.876 -18.159 1.00 15.66 N ATOM 2480 CA LEU B 82 -21.053 26.020 -19.482 1.00 16.07 C ATOM 2481 C LEU B 82 -21.291 24.673 -20.169 1.00 17.17 C ATOM 2482 O LEU B 82 -21.995 24.603 -21.185 1.00 19.17 O ATOM 2483 CB LEU B 82 -20.156 26.896 -20.370 1.00 15.17 C ATOM 2484 CG LEU B 82 -20.053 28.366 -19.960 1.00 17.54 C ATOM 2485 CD1 LEU B 82 -19.075 29.101 -20.861 1.00 18.72 C ATOM 2486 CD2 LEU B 82 -21.424 29.041 -19.990 1.00 17.08 C ATOM 2487 H LEU B 82 -19.419 25.847 -18.080 1.00 0.00 H ATOM 2488 N GLY B 83 -20.708 23.616 -19.614 1.00 15.34 N ATOM 2489 CA GLY B 83 -20.792 22.284 -20.198 1.00 16.78 C ATOM 2490 C GLY B 83 -20.048 22.162 -21.517 1.00 17.89 C ATOM 2491 O GLY B 83 -20.510 21.505 -22.450 1.00 18.03 O ATOM 2492 H GLY B 83 -20.173 23.744 -18.732 1.00 0.00 H ATOM 2493 N VAL B 84 -18.886 22.793 -21.600 1.00 14.89 N ATOM 2494 CA VAL B 84 -18.130 22.794 -22.846 1.00 14.71 C ATOM 2495 C VAL B 84 -16.749 22.174 -22.663 1.00 15.39 C ATOM 2496 O VAL B 84 -15.834 22.467 -23.433 1.00 16.56 O ATOM 2497 CB VAL B 84 -17.984 24.228 -23.429 1.00 16.49 C ATOM 2498 CG1 VAL B 84 -19.358 24.819 -23.760 1.00 18.71 C ATOM 2499 CG2 VAL B 84 -17.199 25.149 -22.471 1.00 13.81 C ATOM 2500 H VAL B 84 -18.510 23.292 -20.769 1.00 0.00 H ATOM 2501 N GLU B 85 -16.606 21.313 -21.655 1.00 15.81 N ATOM 2502 CA GLU B 85 -15.336 20.621 -21.407 1.00 16.57 C ATOM 2503 C GLU B 85 -14.831 19.899 -22.643 1.00 19.50 C ATOM 2504 O GLU B 85 -13.626 19.925 -22.950 1.00 19.71 O ATOM 2505 CB GLU B 85 -15.475 19.610 -20.257 1.00 17.48 C ATOM 2506 CG GLU B 85 -15.997 20.202 -18.975 1.00 21.29 C ATOM 2507 CD GLU B 85 -17.489 19.936 -18.778 1.00 27.61 C ATOM 2508 OE1 GLU B 85 -18.295 20.093 -19.739 1.00 21.65 O ATOM 2509 OE2 GLU B 85 -17.854 19.551 -17.649 1.00 26.92 O ATOM 2510 H GLU B 85 -17.415 21.127 -21.029 1.00 0.00 H ATOM 2511 N ASP B 86 -15.747 19.257 -23.358 1.00 16.59 N ATOM 2512 CA ASP B 86 -15.364 18.480 -24.533 1.00 19.74 C ATOM 2513 C ASP B 86 -15.019 19.342 -25.751 1.00 21.76 C ATOM 2514 O ASP B 86 -14.674 18.814 -26.805 1.00 24.33 O ATOM 2515 CB ASP B 86 -16.475 17.491 -24.894 1.00 26.51 C ATOM 2516 CG ASP B 86 -16.592 16.359 -23.891 1.00 40.75 C ATOM 2517 OD1 ASP B 86 -15.614 16.120 -23.149 1.00 38.58 O ATOM 2518 OD2 ASP B 86 -17.660 15.708 -23.842 1.00 51.48 O ATOM 2519 H ASP B 86 -16.747 19.308 -23.078 1.00 0.00 H ATOM 2520 N LYS B 87 -15.109 20.662 -25.597 1.00 19.41 N ATOM 2521 CA LYS B 87 -14.805 21.587 -26.686 1.00 18.44 C ATOM 2522 C LYS B 87 -13.538 22.404 -26.446 1.00 16.53 C ATOM 2523 O LYS B 87 -12.956 22.941 -27.390 1.00 17.70 O ATOM 2524 CB LYS B 87 -15.982 22.539 -26.918 1.00 19.64 C ATOM 2525 CG LYS B 87 -17.142 21.915 -27.670 1.00 22.81 C ATOM 2526 CD LYS B 87 -18.208 22.949 -27.990 1.00 23.31 C ATOM 2527 CE LYS B 87 -19.284 22.367 -28.895 1.00 26.06 C ATOM 2528 NZ LYS B 87 -18.724 21.946 -30.210 1.00 26.18 N ATOM 2529 HZ1 LYS B 87 -18.303 22.769 -30.686 1.00 0.00 H ATOM 2530 HZ2 LYS B 87 -17.994 21.221 -30.058 1.00 0.00 H ATOM 2531 HZ3 LYS B 87 -19.485 21.554 -30.800 1.00 0.00 H ATOM 2532 H LYS B 87 -15.404 21.045 -24.676 1.00 0.00 H ATOM 2533 N VAL B 88 -13.112 22.503 -25.191 1.00 14.16 N ATOM 2534 CA VAL B 88 -11.940 23.304 -24.865 1.00 12.74 C ATOM 2535 C VAL B 88 -10.755 22.517 -24.305 1.00 14.11 C ATOM 2536 O VAL B 88 -9.671 23.067 -24.200 1.00 14.74 O ATOM 2537 CB VAL B 88 -12.288 24.443 -23.868 1.00 16.06 C ATOM 2538 CG1 VAL B 88 -13.380 25.353 -24.454 1.00 15.75 C ATOM 2539 CG2 VAL B 88 -12.719 23.872 -22.514 1.00 17.24 C ATOM 2540 H VAL B 88 -13.621 22.003 -24.434 1.00 0.00 H ATOM 2541 N THR B 89 -10.937 21.244 -23.956 1.00 12.18 N ATOM 2542 CA THR B 89 -9.832 20.473 -23.376 1.00 14.38 C ATOM 2543 C THR B 89 -8.639 20.383 -24.337 1.00 12.19 C ATOM 2544 O THR B 89 -7.501 20.654 -23.949 1.00 13.35 O ATOM 2545 CB THR B 89 -10.278 19.057 -22.974 1.00 16.10 C ATOM 2546 OG1 THR B 89 -11.229 19.151 -21.904 1.00 13.41 O ATOM 2547 CG2 THR B 89 -9.096 18.247 -22.481 1.00 16.99 C ATOM 2548 HG1 THR B 89 -12.013 19.675 -22.206 1.00 0.00 H ATOM 2549 H THR B 89 -11.865 20.796 -24.095 1.00 0.00 H ATOM 2550 N VAL B 90 -8.908 20.040 -25.593 1.00 12.62 N ATOM 2551 CA VAL B 90 -7.840 19.937 -26.585 1.00 16.23 C ATOM 2552 C VAL B 90 -7.136 21.277 -26.856 1.00 14.78 C ATOM 2553 O VAL B 90 -5.910 21.343 -26.765 1.00 16.13 O ATOM 2554 CB VAL B 90 -8.362 19.342 -27.904 1.00 17.76 C ATOM 2555 CG1 VAL B 90 -7.307 19.476 -29.013 1.00 17.91 C ATOM 2556 CG2 VAL B 90 -8.751 17.891 -27.688 1.00 16.46 C ATOM 2557 H VAL B 90 -9.890 19.843 -25.873 1.00 0.00 H ATOM 2558 N PRO B 91 -7.885 22.348 -27.184 1.00 14.64 N ATOM 2559 CA PRO B 91 -7.104 23.553 -27.502 1.00 13.34 C ATOM 2560 C PRO B 91 -6.401 24.160 -26.287 1.00 15.81 C ATOM 2561 O PRO B 91 -5.388 24.839 -26.463 1.00 14.64 O ATOM 2562 CB PRO B 91 -8.162 24.516 -28.081 1.00 14.16 C ATOM 2563 CG PRO B 91 -9.473 24.024 -27.495 1.00 18.54 C ATOM 2564 CD PRO B 91 -9.322 22.529 -27.478 1.00 15.72 C ATOM 2565 N LEU B 92 -6.897 23.906 -25.079 1.00 14.34 N ATOM 2566 CA LEU B 92 -6.196 24.368 -23.879 1.00 12.22 C ATOM 2567 C LEU B 92 -4.899 23.566 -23.691 1.00 12.64 C ATOM 2568 O LEU B 92 -3.832 24.147 -23.488 1.00 13.04 O ATOM 2569 CB LEU B 92 -7.092 24.267 -22.640 1.00 12.28 C ATOM 2570 CG LEU B 92 -8.210 25.311 -22.626 1.00 12.60 C ATOM 2571 CD1 LEU B 92 -9.161 25.025 -21.476 1.00 13.04 C ATOM 2572 CD2 LEU B 92 -7.658 26.713 -22.513 1.00 15.68 C ATOM 2573 H LEU B 92 -7.787 23.377 -24.986 1.00 0.00 H ATOM 2574 N PHE B 93 -4.962 22.239 -23.783 1.00 12.83 N ATOM 2575 CA PHE B 93 -3.756 21.435 -23.651 1.00 12.57 C ATOM 2576 C PHE B 93 -2.750 21.786 -24.752 1.00 13.81 C ATOM 2577 O PHE B 93 -1.560 21.966 -24.495 1.00 14.37 O ATOM 2578 CB PHE B 93 -4.073 19.935 -23.709 1.00 14.02 C ATOM 2579 CG PHE B 93 -4.125 19.267 -22.358 1.00 12.17 C ATOM 2580 CD1 PHE B 93 -3.017 19.284 -21.510 1.00 12.74 C ATOM 2581 CD2 PHE B 93 -5.262 18.577 -21.950 1.00 14.91 C ATOM 2582 CE1 PHE B 93 -3.060 18.666 -20.272 1.00 14.33 C ATOM 2583 CE2 PHE B 93 -5.297 17.946 -20.709 1.00 15.21 C ATOM 2584 CZ PHE B 93 -4.199 17.991 -19.873 1.00 16.44 C ATOM 2585 H PHE B 93 -5.878 21.775 -23.950 1.00 0.00 H ATOM 2586 N GLU B 94 -3.218 21.888 -25.990 1.00 15.34 N ATOM 2587 CA GLU B 94 -2.273 22.139 -27.070 1.00 17.39 C ATOM 2588 C GLU B 94 -1.730 23.569 -26.961 1.00 17.86 C ATOM 2589 O GLU B 94 -0.554 23.811 -27.186 1.00 16.13 O ATOM 2590 CB GLU B 94 -2.909 21.891 -28.443 1.00 19.92 C ATOM 2591 CG GLU B 94 -3.504 20.479 -28.637 1.00 20.40 C ATOM 2592 CD GLU B 94 -2.497 19.341 -28.432 1.00 26.89 C ATOM 2593 OE1 GLU B 94 -1.319 19.520 -28.782 1.00 31.75 O ATOM 2594 OE2 GLU B 94 -2.905 18.265 -27.930 1.00 28.64 O ATOM 2595 H GLU B 94 -4.235 21.791 -26.184 1.00 0.00 H ATOM 2596 N GLY B 95 -2.585 24.513 -26.583 1.00 16.21 N ATOM 2597 CA GLY B 95 -2.160 25.899 -26.478 1.00 18.22 C ATOM 2598 C GLY B 95 -1.139 26.161 -25.381 1.00 15.27 C ATOM 2599 O GLY B 95 -0.223 26.974 -25.553 1.00 17.25 O ATOM 2600 H GLY B 95 -3.568 24.258 -26.360 1.00 0.00 H ATOM 2601 N VAL B 96 -1.274 25.477 -24.251 1.00 14.25 N ATOM 2602 CA VAL B 96 -0.296 25.623 -23.187 1.00 15.46 C ATOM 2603 C VAL B 96 1.006 24.900 -23.539 1.00 17.14 C ATOM 2604 O VAL B 96 2.087 25.499 -23.475 1.00 17.47 O ATOM 2605 CB VAL B 96 -0.833 25.095 -21.831 1.00 14.04 C ATOM 2606 CG1 VAL B 96 0.249 25.152 -20.781 1.00 14.40 C ATOM 2607 CG2 VAL B 96 -2.066 25.904 -21.394 1.00 14.79 C ATOM 2608 H VAL B 96 -2.083 24.835 -24.127 1.00 0.00 H ATOM 2609 N GLN B 97 0.901 23.635 -23.952 1.00 14.38 N ATOM 2610 CA GLN B 97 2.066 22.750 -24.014 1.00 14.82 C ATOM 2611 C GLN B 97 2.731 22.596 -25.369 1.00 16.50 C ATOM 2612 O GLN B 97 3.926 22.359 -25.428 1.00 18.43 O ATOM 2613 CB GLN B 97 1.696 21.353 -23.504 1.00 14.66 C ATOM 2614 CG GLN B 97 1.314 21.364 -22.015 1.00 14.86 C ATOM 2615 CD GLN B 97 1.358 20.001 -21.353 1.00 16.39 C ATOM 2616 OE1 GLN B 97 2.174 19.149 -21.694 1.00 18.45 O ATOM 2617 NE2 GLN B 97 0.467 19.792 -20.385 1.00 15.03 N ATOM 2618 HE22 GLN B 97 -0.207 20.541 -20.128 1.00 0.00 H ATOM 2619 HE21 GLN B 97 0.445 18.879 -19.887 1.00 0.00 H ATOM 2620 H GLN B 97 -0.030 23.269 -24.236 1.00 0.00 H ATOM 2621 N LYS B 98 1.973 22.721 -26.451 1.00 21.36 N ATOM 2622 CA LYS B 98 2.534 22.426 -27.767 1.00 23.03 C ATOM 2623 C LYS B 98 2.801 23.684 -28.591 1.00 23.67 C ATOM 2624 O LYS B 98 3.926 23.922 -29.019 1.00 25.48 O ATOM 2625 CB LYS B 98 1.607 21.484 -28.538 1.00 32.90 C ATOM 2626 H LYS B 98 0.983 23.028 -26.362 1.00 0.00 H ATOM 2627 N THR B 99 1.774 24.494 -28.826 1.00 22.49 N ATOM 2628 CA THR B 99 1.961 25.669 -29.674 1.00 23.39 C ATOM 2629 C THR B 99 2.433 26.869 -28.859 1.00 30.29 C ATOM 2630 O THR B 99 2.888 27.863 -29.420 1.00 29.29 O ATOM 2631 CB THR B 99 0.662 26.046 -30.415 1.00 22.60 C ATOM 2632 OG1 THR B 99 -0.375 26.252 -29.456 1.00 20.67 O ATOM 2633 CG2 THR B 99 0.240 24.938 -31.353 1.00 25.37 C ATOM 2634 HG1 THR B 99 -1.213 26.495 -29.924 1.00 0.00 H ATOM 2635 H THR B 99 0.843 24.293 -28.409 1.00 0.00 H ATOM 2636 N GLN B 100 2.304 26.762 -27.538 1.00 24.27 N ATOM 2637 CA GLN B 100 2.692 27.821 -26.613 1.00 29.52 C ATOM 2638 C GLN B 100 2.069 29.149 -27.013 1.00 29.31 C ATOM 2639 O GLN B 100 2.727 30.193 -27.042 1.00 26.57 O ATOM 2640 CB GLN B 100 4.212 27.929 -26.530 1.00 35.51 C ATOM 2641 CG GLN B 100 4.837 26.771 -25.775 1.00 38.15 C ATOM 2642 CD GLN B 100 6.039 26.199 -26.485 1.00 47.63 C ATOM 2643 OE1 GLN B 100 6.977 26.921 -26.824 1.00 50.23 O ATOM 2644 NE2 GLN B 100 6.018 24.894 -26.720 1.00 52.71 N ATOM 2645 HE22 GLN B 100 5.204 24.324 -26.415 1.00 0.00 H ATOM 2646 HE21 GLN B 100 6.816 24.441 -27.209 1.00 0.00 H ATOM 2647 H GLN B 100 1.908 25.883 -27.148 1.00 0.00 H ATOM 2648 N THR B 101 0.782 29.081 -27.328 1.00 22.17 N ATOM 2649 CA THR B 101 0.000 30.261 -27.668 1.00 24.48 C ATOM 2650 C THR B 101 -0.807 30.750 -26.467 1.00 25.30 C ATOM 2651 O THR B 101 -1.334 31.866 -26.476 1.00 25.25 O ATOM 2652 CB THR B 101 -0.940 29.974 -28.850 1.00 24.40 C ATOM 2653 OG1 THR B 101 -1.675 28.774 -28.578 1.00 26.93 O ATOM 2654 CG2 THR B 101 -0.150 29.798 -30.135 1.00 28.33 C ATOM 2655 HG1 THR B 101 -1.043 28.021 -28.462 1.00 0.00 H ATOM 2656 H THR B 101 0.315 28.152 -27.332 1.00 0.00 H ATOM 2657 N ILE B 102 -0.922 29.913 -25.439 1.00 20.90 N ATOM 2658 CA ILE B 102 -1.631 30.302 -24.226 1.00 21.01 C ATOM 2659 C ILE B 102 -0.616 30.785 -23.191 1.00 24.66 C ATOM 2660 O ILE B 102 0.141 29.991 -22.627 1.00 24.35 O ATOM 2661 CB ILE B 102 -2.486 29.136 -23.673 1.00 23.62 C ATOM 2662 CG1 ILE B 102 -3.517 28.724 -24.725 1.00 24.33 C ATOM 2663 CG2 ILE B 102 -3.167 29.532 -22.375 1.00 21.50 C ATOM 2664 CD1 ILE B 102 -4.434 27.599 -24.307 1.00 21.35 C ATOM 2665 H ILE B 102 -0.499 28.965 -25.502 1.00 0.00 H ATOM 2666 N ARG B 103 -0.589 32.098 -22.975 1.00 18.54 N ATOM 2667 CA ARG B 103 0.418 32.725 -22.128 1.00 19.70 C ATOM 2668 C ARG B 103 -0.202 33.567 -21.021 1.00 24.26 C ATOM 2669 O ARG B 103 0.494 34.010 -20.105 1.00 22.11 O ATOM 2670 CB ARG B 103 1.358 33.598 -22.973 1.00 21.93 C ATOM 2671 CG ARG B 103 1.808 32.953 -24.280 1.00 23.14 C ATOM 2672 CD ARG B 103 2.728 31.758 -24.035 1.00 25.50 C ATOM 2673 NE ARG B 103 4.111 32.166 -23.808 1.00 28.91 N ATOM 2674 CZ ARG B 103 5.130 31.318 -23.689 1.00 29.85 C ATOM 2675 NH1 ARG B 103 4.922 30.009 -23.771 1.00 27.68 N ATOM 2676 NH2 ARG B 103 6.355 31.777 -23.482 1.00 30.63 N ATOM 2677 HE ARG B 103 4.313 33.184 -23.735 1.00 0.00 H ATOM 2678 HH12 ARG B 103 5.720 29.349 -23.678 1.00 0.00 H ATOM 2679 HH11 ARG B 103 3.961 29.644 -23.929 1.00 0.00 H ATOM 2680 HH22 ARG B 103 7.150 31.113 -23.389 1.00 0.00 H ATOM 2681 HH21 ARG B 103 6.522 32.801 -23.412 1.00 0.00 H ATOM 2682 H ARG B 103 -1.310 32.697 -23.426 1.00 0.00 H ATOM 2683 N SER B 104 -1.507 33.791 -21.122 1.00 22.01 N ATOM 2684 CA SER B 104 -2.236 34.610 -20.161 1.00 21.73 C ATOM 2685 C SER B 104 -3.711 34.262 -20.173 1.00 18.85 C ATOM 2686 O SER B 104 -4.174 33.516 -21.033 1.00 17.19 O ATOM 2687 CB SER B 104 -2.075 36.091 -20.478 1.00 22.76 C ATOM 2688 OG SER B 104 -2.801 36.394 -21.653 1.00 23.07 O ATOM 2689 HG SER B 104 -2.452 35.852 -22.404 1.00 0.00 H ATOM 2690 H SER B 104 -2.028 33.367 -21.916 1.00 0.00 H ATOM 2691 N ALA B 105 -4.449 34.842 -19.233 1.00 20.57 N ATOM 2692 CA ALA B 105 -5.886 34.628 -19.132 1.00 18.63 C ATOM 2693 C ALA B 105 -6.598 35.080 -20.403 1.00 16.28 C ATOM 2694 O ALA B 105 -7.599 34.486 -20.798 1.00 16.37 O ATOM 2695 CB ALA B 105 -6.447 35.356 -17.919 1.00 20.24 C ATOM 2696 H ALA B 105 -3.985 35.470 -18.546 1.00 0.00 H ATOM 2697 N SER B 106 -6.071 36.120 -21.047 1.00 19.96 N ATOM 2698 CA SER B 106 -6.669 36.622 -22.275 1.00 22.07 C ATOM 2699 C SER B 106 -6.620 35.563 -23.373 1.00 17.66 C ATOM 2700 O SER B 106 -7.566 35.416 -24.133 1.00 17.90 O ATOM 2701 CB SER B 106 -5.966 37.898 -22.736 1.00 28.24 C ATOM 2702 OG SER B 106 -6.633 38.460 -23.848 1.00 34.66 O ATOM 2703 HG SER B 106 -6.637 37.808 -24.593 1.00 0.00 H ATOM 2704 H SER B 106 -5.219 36.580 -20.667 1.00 0.00 H ATOM 2705 N ASP B 107 -5.508 34.829 -23.450 1.00 20.71 N ATOM 2706 CA ASP B 107 -5.358 33.744 -24.429 1.00 18.25 C ATOM 2707 C ASP B 107 -6.296 32.579 -24.126 1.00 16.28 C ATOM 2708 O ASP B 107 -6.799 31.925 -25.035 1.00 16.19 O ATOM 2709 CB ASP B 107 -3.911 33.231 -24.470 1.00 17.30 C ATOM 2710 CG ASP B 107 -2.920 34.287 -24.921 1.00 21.97 C ATOM 2711 OD1 ASP B 107 -3.268 35.108 -25.797 1.00 23.97 O ATOM 2712 OD2 ASP B 107 -1.781 34.293 -24.412 1.00 21.92 O ATOM 2713 H ASP B 107 -4.724 35.031 -22.797 1.00 0.00 H ATOM 2714 N ILE B 108 -6.511 32.303 -22.843 1.00 14.69 N ATOM 2715 CA ILE B 108 -7.496 31.302 -22.454 1.00 17.26 C ATOM 2716 C ILE B 108 -8.893 31.679 -22.951 1.00 17.27 C ATOM 2717 O ILE B 108 -9.599 30.859 -23.560 1.00 15.46 O ATOM 2718 CB ILE B 108 -7.519 31.118 -20.933 1.00 14.87 C ATOM 2719 CG1 ILE B 108 -6.154 30.624 -20.446 1.00 16.33 C ATOM 2720 CG2 ILE B 108 -8.594 30.135 -20.549 1.00 14.78 C ATOM 2721 CD1 ILE B 108 -6.014 30.649 -18.932 1.00 19.42 C ATOM 2722 H ILE B 108 -5.971 32.806 -22.110 1.00 0.00 H ATOM 2723 N ARG B 109 -9.290 32.921 -22.684 1.00 15.82 N ATOM 2724 CA ARG B 109 -10.563 33.457 -23.155 1.00 16.07 C ATOM 2725 C ARG B 109 -10.698 33.323 -24.675 1.00 18.88 C ATOM 2726 O ARG B 109 -11.740 32.905 -25.178 1.00 18.12 O ATOM 2727 CB ARG B 109 -10.694 34.920 -22.727 1.00 18.32 C ATOM 2728 CG ARG B 109 -12.036 35.565 -23.016 1.00 18.23 C ATOM 2729 CD ARG B 109 -12.091 36.959 -22.374 1.00 19.56 C ATOM 2730 NE ARG B 109 -13.356 37.649 -22.609 1.00 18.95 N ATOM 2731 CZ ARG B 109 -13.620 38.383 -23.689 1.00 20.24 C ATOM 2732 NH1 ARG B 109 -12.702 38.509 -24.643 1.00 27.53 N ATOM 2733 NH2 ARG B 109 -14.797 38.994 -23.821 1.00 22.87 N ATOM 2734 HE ARG B 109 -14.099 37.562 -21.887 1.00 0.00 H ATOM 2735 HH12 ARG B 109 -12.905 39.081 -25.487 1.00 0.00 H ATOM 2736 HH11 ARG B 109 -11.781 38.035 -24.545 1.00 0.00 H ATOM 2737 HH22 ARG B 109 -14.994 39.565 -24.668 1.00 0.00 H ATOM 2738 HH21 ARG B 109 -15.518 38.900 -23.077 1.00 0.00 H ATOM 2739 H ARG B 109 -8.669 33.533 -22.118 1.00 0.00 H ATOM 2740 N ASP B 110 -9.630 33.649 -25.405 1.00 19.40 N ATOM 2741 CA ASP B 110 -9.646 33.510 -26.859 1.00 19.10 C ATOM 2742 C ASP B 110 -9.954 32.073 -27.308 1.00 15.93 C ATOM 2743 O ASP B 110 -10.650 31.875 -28.307 1.00 20.19 O ATOM 2744 CB ASP B 110 -8.313 33.959 -27.470 1.00 18.73 C ATOM 2745 CG ASP B 110 -8.126 35.471 -27.446 1.00 23.88 C ATOM 2746 OD1 ASP B 110 -9.112 36.218 -27.239 1.00 23.95 O ATOM 2747 OD2 ASP B 110 -6.975 35.915 -27.655 1.00 27.36 O ATOM 2748 H ASP B 110 -8.775 34.007 -24.933 1.00 0.00 H ATOM 2749 N VAL B 111 -9.447 31.082 -26.577 1.00 15.89 N ATOM 2750 CA VAL B 111 -9.747 29.676 -26.869 1.00 15.73 C ATOM 2751 C VAL B 111 -11.245 29.365 -26.736 1.00 17.43 C ATOM 2752 O VAL B 111 -11.829 28.691 -27.591 1.00 18.58 O ATOM 2753 CB VAL B 111 -8.944 28.721 -25.945 1.00 16.73 C ATOM 2754 CG1 VAL B 111 -9.516 27.313 -25.999 1.00 16.25 C ATOM 2755 CG2 VAL B 111 -7.475 28.699 -26.346 1.00 18.09 C ATOM 2756 H VAL B 111 -8.822 31.311 -25.778 1.00 0.00 H ATOM 2757 N PHE B 112 -11.875 29.861 -25.679 1.00 18.18 N ATOM 2758 CA PHE B 112 -13.311 29.658 -25.533 1.00 16.07 C ATOM 2759 C PHE B 112 -14.064 30.340 -26.666 1.00 18.80 C ATOM 2760 O PHE B 112 -14.996 29.766 -27.223 1.00 17.30 O ATOM 2761 CB PHE B 112 -13.805 30.165 -24.174 1.00 13.88 C ATOM 2762 CG PHE B 112 -13.521 29.220 -23.035 1.00 14.60 C ATOM 2763 CD1 PHE B 112 -12.226 29.034 -22.568 1.00 13.12 C ATOM 2764 CD2 PHE B 112 -14.555 28.523 -22.422 1.00 16.72 C ATOM 2765 CE1 PHE B 112 -11.960 28.166 -21.519 1.00 16.94 C ATOM 2766 CE2 PHE B 112 -14.303 27.654 -21.368 1.00 16.91 C ATOM 2767 CZ PHE B 112 -13.007 27.477 -20.910 1.00 17.09 C ATOM 2768 H PHE B 112 -11.347 30.392 -24.958 1.00 0.00 H ATOM 2769 N ILE B 113 -13.653 31.558 -27.021 1.00 18.97 N ATOM 2770 CA ILE B 113 -14.337 32.314 -28.060 1.00 20.45 C ATOM 2771 C ILE B 113 -14.200 31.599 -29.401 1.00 17.72 C ATOM 2772 O ILE B 113 -15.167 31.470 -30.158 1.00 21.47 O ATOM 2773 CB ILE B 113 -13.799 33.761 -28.137 1.00 19.54 C ATOM 2774 CG1 ILE B 113 -14.185 34.506 -26.855 1.00 24.42 C ATOM 2775 CG2 ILE B 113 -14.348 34.483 -29.359 1.00 24.89 C ATOM 2776 CD1 ILE B 113 -13.727 35.938 -26.804 1.00 24.45 C ATOM 2777 H ILE B 113 -12.828 31.976 -26.546 1.00 0.00 H ATOM 2778 N ASN B 114 -13.007 31.082 -29.666 1.00 17.76 N ATOM 2779 CA ASN B 114 -12.771 30.353 -30.902 1.00 20.16 C ATOM 2780 C ASN B 114 -13.525 29.021 -30.933 1.00 20.66 C ATOM 2781 O ASN B 114 -13.879 28.530 -32.001 1.00 22.82 O ATOM 2782 CB ASN B 114 -11.279 30.129 -31.095 1.00 19.70 C ATOM 2783 CG ASN B 114 -10.937 29.729 -32.499 1.00 22.87 C ATOM 2784 OD1 ASN B 114 -11.497 30.258 -33.456 1.00 24.11 O ATOM 2785 ND2 ASN B 114 -10.025 28.778 -32.637 1.00 23.29 N ATOM 2786 HD22 ASN B 114 -9.578 28.360 -31.796 1.00 0.00 H ATOM 2787 HD21 ASN B 114 -9.756 28.449 -33.586 1.00 0.00 H ATOM 2788 H ASN B 114 -12.232 31.199 -28.982 1.00 0.00 H ATOM 2789 N ALA B 115 -13.804 28.464 -29.756 1.00 17.88 N ATOM 2790 CA ALA B 115 -14.552 27.209 -29.650 1.00 21.54 C ATOM 2791 C ALA B 115 -16.069 27.427 -29.677 1.00 22.43 C ATOM 2792 O ALA B 115 -16.841 26.466 -29.612 1.00 26.18 O ATOM 2793 CB ALA B 115 -14.151 26.458 -28.378 1.00 20.38 C ATOM 2794 H ALA B 115 -13.481 28.934 -28.886 1.00 0.00 H ATOM 2795 N GLY B 116 -16.499 28.681 -29.761 1.00 19.56 N ATOM 2796 CA GLY B 116 -17.906 28.982 -29.982 1.00 23.58 C ATOM 2797 C GLY B 116 -18.650 29.607 -28.819 1.00 25.16 C ATOM 2798 O GLY B 116 -19.853 29.862 -28.911 1.00 28.66 O ATOM 2799 H GLY B 116 -15.818 29.462 -29.667 1.00 0.00 H ATOM 2800 N ILE B 117 -17.943 29.841 -27.720 1.00 20.99 N ATOM 2801 CA ILE B 117 -18.533 30.522 -26.578 1.00 20.66 C ATOM 2802 C ILE B 117 -18.346 32.032 -26.749 1.00 23.26 C ATOM 2803 O ILE B 117 -17.215 32.513 -26.823 1.00 27.41 O ATOM 2804 CB ILE B 117 -17.906 30.056 -25.237 1.00 20.65 C ATOM 2805 CG1 ILE B 117 -18.187 28.566 -24.984 1.00 20.19 C ATOM 2806 CG2 ILE B 117 -18.443 30.896 -24.084 1.00 20.62 C ATOM 2807 CD1 ILE B 117 -17.172 27.613 -25.594 1.00 21.74 C ATOM 2808 H ILE B 117 -16.951 29.532 -27.675 1.00 0.00 H ATOM 2809 N LYS B 118 -19.447 32.776 -26.810 1.00 22.47 N ATOM 2810 CA LYS B 118 -19.367 34.225 -26.967 1.00 22.58 C ATOM 2811 C LYS B 118 -18.606 34.868 -25.810 1.00 24.71 C ATOM 2812 O LYS B 118 -18.722 34.430 -24.669 1.00 20.87 O ATOM 2813 CB LYS B 118 -20.768 34.830 -27.075 1.00 28.06 C ATOM 2814 CG LYS B 118 -21.309 34.904 -28.502 1.00 40.52 C ATOM 2815 CD LYS B 118 -21.653 33.533 -29.060 1.00 45.71 C ATOM 2816 H LYS B 118 -20.379 32.318 -26.745 1.00 0.00 H ATOM 2817 N GLY B 119 -17.832 35.908 -26.109 1.00 24.76 N ATOM 2818 CA GLY B 119 -17.034 36.578 -25.093 1.00 23.40 C ATOM 2819 C GLY B 119 -17.815 37.084 -23.890 1.00 26.78 C ATOM 2820 O GLY B 119 -17.345 36.984 -22.746 1.00 22.46 O ATOM 2821 H GLY B 119 -17.796 36.250 -27.091 1.00 0.00 H ATOM 2822 N GLU B 120 -19.012 37.609 -24.137 1.00 30.16 N ATOM 2823 CA GLU B 120 -19.822 38.154 -23.053 1.00 28.88 C ATOM 2824 C GLU B 120 -20.381 37.021 -22.198 1.00 24.32 C ATOM 2825 O GLU B 120 -20.605 37.191 -20.999 1.00 22.77 O ATOM 2826 CB GLU B 120 -20.955 39.042 -23.595 1.00 32.25 C ATOM 2827 CG GLU B 120 -21.970 38.330 -24.474 1.00 34.16 C ATOM 2828 H GLU B 120 -19.374 37.631 -25.112 1.00 0.00 H ATOM 2829 N GLU B 121 -20.593 35.858 -22.812 1.00 22.66 N ATOM 2830 CA GLU B 121 -21.051 34.692 -22.069 1.00 20.73 C ATOM 2831 C GLU B 121 -19.924 34.097 -21.219 1.00 19.06 C ATOM 2832 O GLU B 121 -20.135 33.742 -20.058 1.00 19.14 O ATOM 2833 CB GLU B 121 -21.623 33.638 -23.020 1.00 22.17 C ATOM 2834 CG GLU B 121 -22.100 32.365 -22.341 1.00 21.97 C ATOM 2835 CD GLU B 121 -23.301 32.560 -21.422 1.00 23.16 C ATOM 2836 OE1 GLU B 121 -23.876 33.671 -21.363 1.00 23.41 O ATOM 2837 OE2 GLU B 121 -23.687 31.579 -20.757 1.00 23.05 O ATOM 2838 H GLU B 121 -20.429 35.782 -23.836 1.00 0.00 H ATOM 2839 N TYR B 122 -18.728 33.998 -21.794 1.00 18.06 N ATOM 2840 CA TYR B 122 -17.558 33.564 -21.041 1.00 18.18 C ATOM 2841 C TYR B 122 -17.343 34.469 -19.831 1.00 18.91 C ATOM 2842 O TYR B 122 -17.142 33.992 -18.711 1.00 17.21 O ATOM 2843 CB TYR B 122 -16.316 33.560 -21.935 1.00 16.14 C ATOM 2844 CG TYR B 122 -15.045 33.156 -21.216 1.00 15.46 C ATOM 2845 CD1 TYR B 122 -14.671 31.823 -21.142 1.00 14.90 C ATOM 2846 CD2 TYR B 122 -14.225 34.106 -20.612 1.00 19.36 C ATOM 2847 CE1 TYR B 122 -13.497 31.432 -20.493 1.00 15.84 C ATOM 2848 CE2 TYR B 122 -13.055 33.731 -19.956 1.00 18.93 C ATOM 2849 CZ TYR B 122 -12.696 32.388 -19.907 1.00 16.11 C ATOM 2850 OH TYR B 122 -11.552 31.974 -19.265 1.00 18.42 O ATOM 2851 HH TYR B 122 -10.765 32.404 -19.685 1.00 0.00 H ATOM 2852 H TYR B 122 -18.626 34.235 -22.801 1.00 0.00 H ATOM 2853 N ASP B 123 -17.405 35.779 -20.051 1.00 18.43 N ATOM 2854 CA ASP B 123 -17.169 36.726 -18.964 1.00 20.19 C ATOM 2855 C ASP B 123 -18.236 36.631 -17.883 1.00 20.43 C ATOM 2856 O ASP B 123 -17.924 36.690 -16.689 1.00 20.83 O ATOM 2857 CB ASP B 123 -17.100 38.154 -19.498 1.00 21.29 C ATOM 2858 CG ASP B 123 -15.901 38.382 -20.402 1.00 22.36 C ATOM 2859 OD1 ASP B 123 -14.970 37.550 -20.379 1.00 21.72 O ATOM 2860 OD2 ASP B 123 -15.899 39.401 -21.129 1.00 25.71 O ATOM 2861 H ASP B 123 -17.623 36.132 -21.005 1.00 0.00 H ATOM 2862 N ALA B 124 -19.493 36.495 -18.299 1.00 20.78 N ATOM 2863 CA ALA B 124 -20.585 36.336 -17.347 1.00 21.78 C ATOM 2864 C ALA B 124 -20.336 35.096 -16.492 1.00 20.61 C ATOM 2865 O ALA B 124 -20.488 35.138 -15.274 1.00 23.54 O ATOM 2866 CB ALA B 124 -21.919 36.240 -18.065 1.00 22.95 C ATOM 2867 H ALA B 124 -19.699 36.502 -19.318 1.00 0.00 H ATOM 2868 N ALA B 125 -19.928 34.002 -17.127 1.00 19.27 N ATOM 2869 CA ALA B 125 -19.650 32.786 -16.376 1.00 22.06 C ATOM 2870 C ALA B 125 -18.440 33.003 -15.474 1.00 18.12 C ATOM 2871 O ALA B 125 -18.471 32.636 -14.298 1.00 18.70 O ATOM 2872 CB ALA B 125 -19.425 31.602 -17.312 1.00 22.11 C ATOM 2873 H ALA B 125 -19.807 34.015 -18.160 1.00 0.00 H ATOM 2874 N TRP B 126 -17.397 33.619 -16.027 1.00 18.83 N ATOM 2875 CA TRP B 126 -16.159 33.875 -15.286 1.00 18.58 C ATOM 2876 C TRP B 126 -16.417 34.585 -13.959 1.00 20.80 C ATOM 2877 O TRP B 126 -15.831 34.222 -12.936 1.00 21.45 O ATOM 2878 CB TRP B 126 -15.179 34.694 -16.143 1.00 20.06 C ATOM 2879 CG TRP B 126 -13.868 35.014 -15.453 1.00 22.73 C ATOM 2880 CD1 TRP B 126 -13.615 36.080 -14.637 1.00 22.91 C ATOM 2881 CD2 TRP B 126 -12.638 34.272 -15.531 1.00 18.97 C ATOM 2882 NE1 TRP B 126 -12.312 36.051 -14.201 1.00 22.29 N ATOM 2883 CE2 TRP B 126 -11.690 34.954 -14.735 1.00 19.48 C ATOM 2884 CE3 TRP B 126 -12.243 33.107 -16.200 1.00 16.28 C ATOM 2885 CZ2 TRP B 126 -10.380 34.497 -14.579 1.00 20.27 C ATOM 2886 CZ3 TRP B 126 -10.949 32.660 -16.045 1.00 19.56 C ATOM 2887 CH2 TRP B 126 -10.033 33.348 -15.238 1.00 17.84 C ATOM 2888 HE1 TRP B 126 -11.870 36.749 -13.569 1.00 0.00 H ATOM 2889 H TRP B 126 -17.463 33.929 -17.018 1.00 0.00 H ATOM 2890 N ASN B 127 -17.303 35.580 -13.972 1.00 20.47 N ATOM 2891 CA ASN B 127 -17.583 36.377 -12.780 1.00 21.57 C ATOM 2892 C ASN B 127 -18.769 35.882 -11.952 1.00 21.96 C ATOM 2893 O ASN B 127 -19.187 36.537 -10.991 1.00 23.59 O ATOM 2894 CB ASN B 127 -17.817 37.828 -13.186 1.00 24.42 C ATOM 2895 CG ASN B 127 -16.613 38.428 -13.874 1.00 29.48 C ATOM 2896 OD1 ASN B 127 -16.658 38.753 -15.062 1.00 33.46 O ATOM 2897 ND2 ASN B 127 -15.523 38.579 -13.129 1.00 27.69 N ATOM 2898 HD22 ASN B 127 -15.532 38.290 -12.130 1.00 0.00 H ATOM 2899 HD21 ASN B 127 -14.661 38.986 -13.545 1.00 0.00 H ATOM 2900 H ASN B 127 -17.809 35.795 -14.855 1.00 0.00 H ATOM 2901 N SER B 128 -19.303 34.721 -12.313 1.00 25.22 N ATOM 2902 CA SER B 128 -20.511 34.208 -11.680 1.00 22.34 C ATOM 2903 C SER B 128 -20.215 33.582 -10.328 1.00 25.83 C ATOM 2904 O SER B 128 -19.094 33.124 -10.084 1.00 24.78 O ATOM 2905 CB SER B 128 -21.193 33.171 -12.575 1.00 22.95 C ATOM 2906 OG SER B 128 -20.451 31.959 -12.581 1.00 22.44 O ATOM 2907 HG SER B 128 -19.539 32.133 -12.925 1.00 0.00 H ATOM 2908 H SER B 128 -18.848 34.165 -13.065 1.00 0.00 H ATOM 2909 N PHE B 129 -21.226 33.533 -9.465 1.00 25.40 N ATOM 2910 CA PHE B 129 -21.098 32.826 -8.201 1.00 29.73 C ATOM 2911 C PHE B 129 -20.952 31.323 -8.424 1.00 27.23 C ATOM 2912 O PHE B 129 -20.282 30.642 -7.646 1.00 26.69 O ATOM 2913 CB PHE B 129 -22.297 33.097 -7.290 1.00 39.99 C ATOM 2914 CG PHE B 129 -22.274 32.292 -6.020 1.00 46.19 C ATOM 2915 CD1 PHE B 129 -21.458 32.666 -4.962 1.00 46.97 C ATOM 2916 CD2 PHE B 129 -23.053 31.151 -5.890 1.00 49.86 C ATOM 2917 CE1 PHE B 129 -21.427 31.921 -3.794 1.00 50.12 C ATOM 2918 CE2 PHE B 129 -23.027 30.403 -4.722 1.00 53.16 C ATOM 2919 CZ PHE B 129 -22.213 30.790 -3.674 1.00 51.91 C ATOM 2920 H PHE B 129 -22.122 34.008 -9.698 1.00 0.00 H ATOM 2921 N VAL B 130 -21.581 30.807 -9.477 1.00 26.50 N ATOM 2922 CA VAL B 130 -21.474 29.382 -9.793 1.00 25.81 C ATOM 2923 C VAL B 130 -20.020 28.987 -10.019 1.00 22.45 C ATOM 2924 O VAL B 130 -19.548 27.964 -9.511 1.00 22.91 O ATOM 2925 CB VAL B 130 -22.314 29.010 -11.038 1.00 26.19 C ATOM 2926 CG1 VAL B 130 -21.942 27.623 -11.556 1.00 28.00 C ATOM 2927 CG2 VAL B 130 -23.786 29.078 -10.699 1.00 25.29 C ATOM 2928 H VAL B 130 -22.157 31.425 -10.084 1.00 0.00 H ATOM 2929 N VAL B 131 -19.297 29.823 -10.753 1.00 19.80 N ATOM 2930 CA VAL B 131 -17.894 29.529 -11.044 1.00 18.77 C ATOM 2931 C VAL B 131 -17.016 29.755 -9.807 1.00 21.11 C ATOM 2932 O VAL B 131 -16.088 28.981 -9.569 1.00 19.69 O ATOM 2933 CB VAL B 131 -17.411 30.362 -12.253 1.00 18.98 C ATOM 2934 CG1 VAL B 131 -15.889 30.482 -12.294 1.00 17.75 C ATOM 2935 CG2 VAL B 131 -17.938 29.727 -13.544 1.00 18.14 C ATOM 2936 H VAL B 131 -19.730 30.693 -11.124 1.00 0.00 H ATOM 2937 N LYS B 132 -17.332 30.775 -9.007 1.00 22.59 N ATOM 2938 CA LYS B 132 -16.646 30.988 -7.732 1.00 24.37 C ATOM 2939 C LYS B 132 -16.748 29.732 -6.861 1.00 24.90 C ATOM 2940 O LYS B 132 -15.748 29.270 -6.282 1.00 24.28 O ATOM 2941 CB LYS B 132 -17.232 32.206 -6.997 1.00 28.14 C ATOM 2942 CG LYS B 132 -16.468 32.616 -5.745 1.00 35.52 C ATOM 2943 CD LYS B 132 -16.904 34.000 -5.260 1.00 42.42 C ATOM 2944 CE LYS B 132 -16.172 34.415 -3.985 1.00 47.73 C ATOM 2945 NZ LYS B 132 -14.698 34.582 -4.176 1.00 47.42 N ATOM 2946 HZ1 LYS B 132 -14.287 33.682 -4.495 1.00 0.00 H ATOM 2947 HZ2 LYS B 132 -14.523 35.317 -4.891 1.00 0.00 H ATOM 2948 HZ3 LYS B 132 -14.263 34.864 -3.274 1.00 0.00 H ATOM 2949 H LYS B 132 -18.083 31.434 -9.296 1.00 0.00 H ATOM 2950 N SER B 133 -17.954 29.173 -6.789 1.00 22.72 N ATOM 2951 CA SER B 133 -18.206 27.958 -6.016 1.00 24.74 C ATOM 2952 C SER B 133 -17.459 26.752 -6.589 1.00 22.88 C ATOM 2953 O SER B 133 -16.896 25.947 -5.841 1.00 22.49 O ATOM 2954 CB SER B 133 -19.706 27.667 -5.964 1.00 27.58 C ATOM 2955 OG SER B 133 -19.981 26.515 -5.183 1.00 30.24 O ATOM 2956 HG SER B 133 -19.655 26.659 -4.259 1.00 0.00 H ATOM 2957 H SER B 133 -18.744 29.616 -7.300 1.00 0.00 H ATOM 2958 N LEU B 134 -17.461 26.628 -7.914 1.00 22.36 N ATOM 2959 CA LEU B 134 -16.761 25.528 -8.584 1.00 18.41 C ATOM 2960 C LEU B 134 -15.254 25.606 -8.351 1.00 19.65 C ATOM 2961 O LEU B 134 -14.594 24.583 -8.182 1.00 18.47 O ATOM 2962 CB LEU B 134 -17.059 25.522 -10.090 1.00 18.72 C ATOM 2963 CG LEU B 134 -18.419 24.951 -10.506 1.00 22.66 C ATOM 2964 CD1 LEU B 134 -18.669 25.243 -11.982 1.00 19.43 C ATOM 2965 CD2 LEU B 134 -18.491 23.452 -10.245 1.00 25.08 C ATOM 2966 H LEU B 134 -17.972 27.329 -8.488 1.00 0.00 H ATOM 2967 N VAL B 135 -14.707 26.812 -8.321 1.00 17.76 N ATOM 2968 CA VAL B 135 -13.294 26.946 -8.002 1.00 18.50 C ATOM 2969 C VAL B 135 -13.032 26.403 -6.595 1.00 17.75 C ATOM 2970 O VAL B 135 -12.125 25.592 -6.389 1.00 15.88 O ATOM 2971 CB VAL B 135 -12.819 28.402 -8.108 1.00 21.54 C ATOM 2972 CG1 VAL B 135 -11.478 28.571 -7.415 1.00 22.51 C ATOM 2973 CG2 VAL B 135 -12.737 28.821 -9.578 1.00 18.66 C ATOM 2974 H VAL B 135 -15.282 27.655 -8.523 1.00 0.00 H ATOM 2975 N ALA B 136 -13.859 26.817 -5.641 1.00 18.69 N ATOM 2976 CA ALA B 136 -13.737 26.356 -4.266 1.00 19.49 C ATOM 2977 C ALA B 136 -13.920 24.842 -4.166 1.00 20.34 C ATOM 2978 O ALA B 136 -13.232 24.195 -3.385 1.00 22.21 O ATOM 2979 CB ALA B 136 -14.748 27.078 -3.370 1.00 21.75 C ATOM 2980 H ALA B 136 -14.615 27.489 -5.884 1.00 0.00 H ATOM 2981 N GLN B 137 -14.842 24.287 -4.956 1.00 18.64 N ATOM 2982 CA GLN B 137 -15.098 22.845 -4.947 1.00 21.13 C ATOM 2983 C GLN B 137 -13.878 22.057 -5.411 1.00 18.09 C ATOM 2984 O GLN B 137 -13.567 21.008 -4.846 1.00 18.18 O ATOM 2985 CB GLN B 137 -16.294 22.479 -5.841 1.00 21.77 C ATOM 2986 CG GLN B 137 -17.677 22.768 -5.268 1.00 35.61 C ATOM 2987 CD GLN B 137 -18.785 22.526 -6.296 1.00 43.00 C ATOM 2988 OE1 GLN B 137 -18.922 21.423 -6.829 1.00 44.48 O ATOM 2989 NE2 GLN B 137 -19.568 23.568 -6.589 1.00 46.44 N ATOM 2990 HE22 GLN B 137 -19.417 24.481 -6.115 1.00 0.00 H ATOM 2991 HE21 GLN B 137 -20.328 23.466 -7.291 1.00 0.00 H ATOM 2992 H GLN B 137 -15.393 24.895 -5.595 1.00 0.00 H ATOM 2993 N GLN B 138 -13.212 22.551 -6.455 1.00 14.35 N ATOM 2994 CA GLN B 138 -12.042 21.857 -6.991 1.00 13.22 C ATOM 2995 C GLN B 138 -10.940 21.845 -5.941 1.00 15.34 C ATOM 2996 O GLN B 138 -10.307 20.812 -5.722 1.00 15.18 O ATOM 2997 CB GLN B 138 -11.547 22.510 -8.285 1.00 14.51 C ATOM 2998 CG GLN B 138 -12.528 22.413 -9.437 1.00 12.51 C ATOM 2999 CD GLN B 138 -12.069 23.176 -10.657 1.00 13.12 C ATOM 3000 OE1 GLN B 138 -11.434 22.613 -11.548 1.00 14.23 O ATOM 3001 NE2 GLN B 138 -12.423 24.465 -10.727 1.00 15.20 N ATOM 3002 HE22 GLN B 138 -12.960 24.900 -9.950 1.00 0.00 H ATOM 3003 HE21 GLN B 138 -12.161 25.032 -11.559 1.00 0.00 H ATOM 3004 H GLN B 138 -13.528 23.440 -6.893 1.00 0.00 H ATOM 3005 N GLU B 139 -10.734 22.982 -5.282 1.00 15.59 N ATOM 3006 CA GLU B 139 -9.702 23.117 -4.252 1.00 17.28 C ATOM 3007 C GLU B 139 -10.004 22.279 -3.009 1.00 16.79 C ATOM 3008 O GLU B 139 -9.097 21.743 -2.372 1.00 17.46 O ATOM 3009 CB GLU B 139 -9.543 24.589 -3.857 1.00 22.31 C ATOM 3010 CG GLU B 139 -9.101 25.490 -5.002 1.00 25.45 C ATOM 3011 CD GLU B 139 -9.272 26.965 -4.692 1.00 28.72 C ATOM 3012 OE1 GLU B 139 -9.986 27.296 -3.720 1.00 29.82 O ATOM 3013 OE2 GLU B 139 -8.692 27.796 -5.424 1.00 28.41 O ATOM 3014 H GLU B 139 -11.328 23.806 -5.507 1.00 0.00 H ATOM 3015 N LYS B 140 -11.281 22.177 -2.657 1.00 18.87 N ATOM 3016 CA LYS B 140 -11.693 21.393 -1.493 1.00 19.82 C ATOM 3017 C LYS B 140 -11.539 19.900 -1.763 1.00 17.62 C ATOM 3018 O LYS B 140 -11.093 19.140 -0.901 1.00 20.18 O ATOM 3019 CB LYS B 140 -13.140 21.712 -1.112 1.00 22.15 C ATOM 3020 CG LYS B 140 -13.635 20.999 0.142 1.00 25.17 C ATOM 3021 CD LYS B 140 -12.733 21.286 1.338 1.00 31.04 C ATOM 3022 CE LYS B 140 -13.480 21.126 2.668 1.00 34.46 C ATOM 3023 NZ LYS B 140 -14.035 19.755 2.873 1.00 37.24 N ATOM 3024 HZ1 LYS B 140 -14.705 19.536 2.109 1.00 0.00 H ATOM 3025 HZ2 LYS B 140 -13.259 19.063 2.864 1.00 0.00 H ATOM 3026 HZ3 LYS B 140 -14.526 19.715 3.789 1.00 0.00 H ATOM 3027 H LYS B 140 -12.004 22.666 -3.222 1.00 0.00 H ATOM 3028 N ALA B 141 -11.893 19.487 -2.976 1.00 17.35 N ATOM 3029 CA ALA B 141 -11.798 18.074 -3.330 1.00 18.91 C ATOM 3030 C ALA B 141 -10.346 17.612 -3.288 1.00 15.71 C ATOM 3031 O ALA B 141 -10.042 16.517 -2.819 1.00 18.38 O ATOM 3032 CB ALA B 141 -12.402 17.823 -4.712 1.00 18.58 C ATOM 3033 H ALA B 141 -12.239 20.174 -3.676 1.00 0.00 H ATOM 3034 N ALA B 142 -9.448 18.455 -3.782 1.00 16.03 N ATOM 3035 CA ALA B 142 -8.027 18.130 -3.766 1.00 14.80 C ATOM 3036 C ALA B 142 -7.538 18.027 -2.331 1.00 17.63 C ATOM 3037 O ALA B 142 -6.803 17.100 -1.985 1.00 19.26 O ATOM 3038 CB ALA B 142 -7.224 19.172 -4.533 1.00 16.69 C ATOM 3039 H ALA B 142 -9.762 19.360 -4.186 1.00 0.00 H ATOM 3040 N ALA B 143 -7.961 18.975 -1.495 1.00 15.98 N ATOM 3041 CA ALA B 143 -7.586 18.953 -0.085 1.00 20.36 C ATOM 3042 C ALA B 143 -8.110 17.695 0.600 1.00 21.20 C ATOM 3043 O ALA B 143 -7.414 17.090 1.411 1.00 22.36 O ATOM 3044 CB ALA B 143 -8.101 20.194 0.623 1.00 20.55 C ATOM 3045 H ALA B 143 -8.567 19.741 -1.853 1.00 0.00 H ATOM 3046 N ASP B 144 -9.324 17.289 0.250 1.00 18.27 N ATOM 3047 CA ASP B 144 -9.982 16.173 0.933 1.00 19.60 C ATOM 3048 C ASP B 144 -9.267 14.841 0.697 1.00 19.28 C ATOM 3049 O ASP B 144 -9.218 13.998 1.593 1.00 25.62 O ATOM 3050 CB ASP B 144 -11.445 16.038 0.488 1.00 22.94 C ATOM 3051 CG ASP B 144 -12.362 17.093 1.099 1.00 27.71 C ATOM 3052 OD1 ASP B 144 -11.973 17.778 2.072 1.00 25.54 O ATOM 3053 OD2 ASP B 144 -13.502 17.220 0.600 1.00 28.64 O ATOM 3054 H ASP B 144 -9.819 17.774 -0.526 1.00 0.00 H ATOM 3055 N VAL B 145 -8.732 14.648 -0.508 1.00 20.66 N ATOM 3056 CA VAL B 145 -8.055 13.397 -0.840 1.00 21.67 C ATOM 3057 C VAL B 145 -6.557 13.511 -0.588 1.00 24.00 C ATOM 3058 O VAL B 145 -5.792 12.609 -0.940 1.00 23.89 O ATOM 3059 CB VAL B 145 -8.296 12.971 -2.311 1.00 20.78 C ATOM 3060 CG1 VAL B 145 -9.792 12.736 -2.561 1.00 21.89 C ATOM 3061 CG2 VAL B 145 -7.706 13.992 -3.278 1.00 18.35 C ATOM 3062 H VAL B 145 -8.797 15.400 -1.223 1.00 0.00 H ATOM 3063 N GLN B 146 -6.157 14.619 0.032 1.00 21.80 N ATOM 3064 CA GLN B 146 -4.753 14.922 0.290 1.00 24.37 C ATOM 3065 C GLN B 146 -3.925 14.738 -0.989 1.00 25.27 C ATOM 3066 O GLN B 146 -2.903 14.039 -1.011 1.00 20.97 O ATOM 3067 CB GLN B 146 -4.222 14.056 1.436 1.00 27.63 C ATOM 3068 CG GLN B 146 -4.979 14.286 2.755 1.00 33.03 C ATOM 3069 CD GLN B 146 -4.328 13.611 3.948 1.00 42.68 C ATOM 3070 OE1 GLN B 146 -3.821 12.494 3.849 1.00 49.06 O ATOM 3071 NE2 GLN B 146 -4.340 14.291 5.086 1.00 46.07 N ATOM 3072 HE22 GLN B 146 -4.780 15.233 5.124 1.00 0.00 H ATOM 3073 HE21 GLN B 146 -3.910 13.883 5.940 1.00 0.00 H ATOM 3074 H GLN B 146 -6.878 15.300 0.347 1.00 0.00 H ATOM 3075 N LEU B 147 -4.388 15.376 -2.058 1.00 18.56 N ATOM 3076 CA LEU B 147 -3.769 15.239 -3.374 1.00 18.11 C ATOM 3077 C LEU B 147 -2.296 15.645 -3.380 1.00 22.73 C ATOM 3078 O LEU B 147 -1.945 16.764 -3.003 1.00 27.56 O ATOM 3079 CB LEU B 147 -4.527 16.080 -4.405 1.00 15.27 C ATOM 3080 CG LEU B 147 -4.108 15.833 -5.861 1.00 12.24 C ATOM 3081 CD1 LEU B 147 -4.520 14.416 -6.299 1.00 15.50 C ATOM 3082 CD2 LEU B 147 -4.709 16.901 -6.775 1.00 17.62 C ATOM 3083 H LEU B 147 -5.219 15.993 -1.955 1.00 0.00 H ATOM 3084 N ARG B 148 -1.447 14.735 -3.846 1.00 23.33 N ATOM 3085 CA ARG B 148 -0.004 14.968 -3.873 1.00 29.29 C ATOM 3086 C ARG B 148 0.492 15.391 -5.254 1.00 26.57 C ATOM 3087 O ARG B 148 1.487 16.104 -5.384 1.00 27.35 O ATOM 3088 CB ARG B 148 0.739 13.708 -3.418 1.00 33.56 C ATOM 3089 H ARG B 148 -1.820 13.832 -4.202 1.00 0.00 H ATOM 3090 N GLY B 149 -0.212 14.952 -6.288 1.00 20.62 N ATOM 3091 CA GLY B 149 0.235 15.202 -7.638 1.00 18.70 C ATOM 3092 C GLY B 149 -0.811 14.774 -8.638 1.00 16.28 C ATOM 3093 O GLY B 149 -1.819 14.151 -8.279 1.00 15.74 O ATOM 3094 H GLY B 149 -1.093 14.424 -6.126 1.00 0.00 H ATOM 3095 N VAL B 150 -0.554 15.097 -9.894 1.00 15.77 N ATOM 3096 CA VAL B 150 -1.448 14.747 -10.994 1.00 13.66 C ATOM 3097 C VAL B 150 -0.646 14.100 -12.115 1.00 14.45 C ATOM 3098 O VAL B 150 0.559 14.308 -12.223 1.00 16.88 O ATOM 3099 CB VAL B 150 -2.213 15.985 -11.527 1.00 13.19 C ATOM 3100 CG1 VAL B 150 -3.302 16.402 -10.523 1.00 15.46 C ATOM 3101 CG2 VAL B 150 -1.254 17.134 -11.815 1.00 14.57 C ATOM 3102 H VAL B 150 0.319 15.621 -10.107 1.00 0.00 H ATOM 3103 N PRO B 151 -1.310 13.305 -12.972 1.00 15.20 N ATOM 3104 CA PRO B 151 -2.744 12.979 -12.920 1.00 16.12 C ATOM 3105 C PRO B 151 -3.081 12.037 -11.772 1.00 18.38 C ATOM 3106 O PRO B 151 -2.198 11.356 -11.237 1.00 16.92 O ATOM 3107 CB PRO B 151 -3.011 12.324 -14.279 1.00 17.11 C ATOM 3108 CG PRO B 151 -1.677 11.796 -14.732 1.00 21.37 C ATOM 3109 CD PRO B 151 -0.628 12.679 -14.121 1.00 15.45 C ATOM 3110 N ALA B 152 -4.348 12.035 -11.375 1.00 13.46 N ATOM 3111 CA ALA B 152 -4.811 11.162 -10.296 1.00 12.43 C ATOM 3112 C ALA B 152 -6.288 10.882 -10.507 1.00 14.02 C ATOM 3113 O ALA B 152 -7.002 11.708 -11.092 1.00 16.14 O ATOM 3114 CB ALA B 152 -4.572 11.803 -8.929 1.00 13.66 C ATOM 3115 H ALA B 152 -5.027 12.669 -11.842 1.00 0.00 H ATOM 3116 N MET B 153 -6.742 9.717 -10.046 1.00 13.31 N ATOM 3117 CA MET B 153 -8.164 9.400 -10.113 1.00 13.24 C ATOM 3118 C MET B 153 -8.614 8.679 -8.858 1.00 15.09 C ATOM 3119 O MET B 153 -7.903 7.832 -8.321 1.00 16.00 O ATOM 3120 CB MET B 153 -8.488 8.557 -11.353 1.00 17.26 C ATOM 3121 CG MET B 153 -9.977 8.519 -11.686 1.00 19.84 C ATOM 3122 SD MET B 153 -10.327 7.644 -13.223 1.00 22.33 S ATOM 3123 CE MET B 153 -9.491 8.655 -14.441 1.00 21.22 C ATOM 3124 H MET B 153 -6.078 9.030 -9.636 1.00 0.00 H ATOM 3125 N PHE B 154 -9.813 9.030 -8.414 1.00 14.93 N ATOM 3126 CA PHE B 154 -10.383 8.506 -7.182 1.00 16.58 C ATOM 3127 C PHE B 154 -11.782 7.980 -7.432 1.00 17.73 C ATOM 3128 O PHE B 154 -12.558 8.574 -8.185 1.00 20.76 O ATOM 3129 CB PHE B 154 -10.422 9.594 -6.105 1.00 17.30 C ATOM 3130 CG PHE B 154 -9.074 10.114 -5.732 1.00 16.21 C ATOM 3131 CD1 PHE B 154 -8.457 11.100 -6.502 1.00 14.95 C ATOM 3132 CD2 PHE B 154 -8.412 9.609 -4.624 1.00 17.98 C ATOM 3133 CE1 PHE B 154 -7.206 11.572 -6.166 1.00 16.24 C ATOM 3134 CE2 PHE B 154 -7.163 10.084 -4.275 1.00 17.68 C ATOM 3135 CZ PHE B 154 -6.555 11.061 -5.055 1.00 18.10 C ATOM 3136 H PHE B 154 -10.370 9.709 -8.970 1.00 0.00 H ATOM 3137 N VAL B 155 -12.114 6.864 -6.793 1.00 18.08 N ATOM 3138 CA VAL B 155 -13.437 6.281 -6.950 1.00 17.51 C ATOM 3139 C VAL B 155 -14.175 6.303 -5.623 1.00 19.96 C ATOM 3140 O VAL B 155 -13.685 5.782 -4.626 1.00 22.10 O ATOM 3141 CB VAL B 155 -13.346 4.838 -7.486 1.00 19.62 C ATOM 3142 CG1 VAL B 155 -14.741 4.192 -7.579 1.00 22.96 C ATOM 3143 CG2 VAL B 155 -12.660 4.839 -8.845 1.00 18.12 C ATOM 3144 H VAL B 155 -11.419 6.401 -6.173 1.00 0.00 H ATOM 3145 N ASN B 156 -15.347 6.934 -5.637 1.00 19.97 N ATOM 3146 CA ASN B 156 -16.245 7.031 -4.482 1.00 23.41 C ATOM 3147 C ASN B 156 -15.569 7.572 -3.228 1.00 27.73 C ATOM 3148 O ASN B 156 -15.961 7.242 -2.103 1.00 30.48 O ATOM 3149 CB ASN B 156 -16.876 5.669 -4.202 1.00 28.53 C ATOM 3150 CG ASN B 156 -17.938 5.308 -5.220 1.00 29.47 C ATOM 3151 OD1 ASN B 156 -18.750 6.150 -5.607 1.00 35.45 O ATOM 3152 ND2 ASN B 156 -17.938 4.060 -5.661 1.00 33.87 N ATOM 3153 HD22 ASN B 156 -17.233 3.383 -5.306 1.00 0.00 H ATOM 3154 HD21 ASN B 156 -18.643 3.756 -6.363 1.00 0.00 H ATOM 3155 H ASN B 156 -15.645 7.387 -6.524 1.00 0.00 H ATOM 3156 N GLY B 157 -14.563 8.416 -3.434 1.00 24.30 N ATOM 3157 CA GLY B 157 -13.818 9.019 -2.347 1.00 26.23 C ATOM 3158 C GLY B 157 -13.133 8.009 -1.450 1.00 26.34 C ATOM 3159 O GLY B 157 -12.758 8.333 -0.327 1.00 31.82 O ATOM 3160 H GLY B 157 -14.301 8.653 -4.412 1.00 0.00 H ATOM 3161 N LYS B 158 -12.959 6.785 -1.940 1.00 23.60 N ATOM 3162 CA LYS B 158 -12.415 5.718 -1.098 1.00 24.00 C ATOM 3163 C LYS B 158 -11.133 5.118 -1.666 1.00 21.83 C ATOM 3164 O LYS B 158 -10.245 4.720 -0.912 1.00 23.85 O ATOM 3165 CB LYS B 158 -13.454 4.606 -0.896 1.00 27.71 C ATOM 3166 CG LYS B 158 -14.576 4.943 0.078 1.00 32.86 C ATOM 3167 H LYS B 158 -13.211 6.584 -2.929 1.00 0.00 H ATOM 3168 N TYR B 159 -11.052 5.052 -2.992 1.00 19.89 N ATOM 3169 CA TYR B 159 -9.974 4.344 -3.668 1.00 17.25 C ATOM 3170 C TYR B 159 -9.213 5.251 -4.628 1.00 16.91 C ATOM 3171 O TYR B 159 -9.808 6.038 -5.365 1.00 21.63 O ATOM 3172 CB TYR B 159 -10.539 3.136 -4.416 1.00 18.29 C ATOM 3173 CG TYR B 159 -11.369 2.248 -3.518 1.00 21.45 C ATOM 3174 CD1 TYR B 159 -10.765 1.479 -2.530 1.00 22.04 C ATOM 3175 CD2 TYR B 159 -12.751 2.188 -3.645 1.00 27.28 C ATOM 3176 CE1 TYR B 159 -11.513 0.674 -1.696 1.00 28.59 C ATOM 3177 CE2 TYR B 159 -13.507 1.375 -2.816 1.00 29.91 C ATOM 3178 CZ TYR B 159 -12.880 0.625 -1.849 1.00 31.82 C ATOM 3179 OH TYR B 159 -13.622 -0.183 -1.016 1.00 38.43 O ATOM 3180 HH TYR B 159 -14.267 0.371 -0.509 1.00 0.00 H ATOM 3181 H TYR B 159 -11.782 5.521 -3.565 1.00 0.00 H ATOM 3182 N GLN B 160 -7.891 5.122 -4.614 1.00 16.55 N ATOM 3183 CA GLN B 160 -7.003 5.906 -5.471 1.00 15.73 C ATOM 3184 C GLN B 160 -6.367 5.000 -6.517 1.00 13.50 C ATOM 3185 O GLN B 160 -5.775 3.983 -6.175 1.00 17.06 O ATOM 3186 CB GLN B 160 -5.922 6.586 -4.630 1.00 16.60 C ATOM 3187 CG GLN B 160 -5.003 7.516 -5.431 1.00 16.83 C ATOM 3188 CD GLN B 160 -4.071 8.311 -4.535 1.00 24.20 C ATOM 3189 OE1 GLN B 160 -4.261 8.376 -3.322 1.00 25.11 O ATOM 3190 NE2 GLN B 160 -3.049 8.914 -5.131 1.00 29.33 N ATOM 3191 HE22 GLN B 160 -2.926 8.833 -6.160 1.00 0.00 H ATOM 3192 HE21 GLN B 160 -2.372 9.467 -4.568 1.00 0.00 H ATOM 3193 H GLN B 160 -7.468 4.431 -3.963 1.00 0.00 H ATOM 3194 N LEU B 161 -6.522 5.346 -7.787 1.00 14.94 N ATOM 3195 CA LEU B 161 -5.903 4.559 -8.843 1.00 19.53 C ATOM 3196 C LEU B 161 -4.391 4.535 -8.667 1.00 19.90 C ATOM 3197 O LEU B 161 -3.795 5.534 -8.270 1.00 20.62 O ATOM 3198 CB LEU B 161 -6.283 5.121 -10.211 1.00 16.63 C ATOM 3199 CG LEU B 161 -7.550 4.538 -10.843 1.00 19.77 C ATOM 3200 CD1 LEU B 161 -7.291 3.093 -11.286 1.00 21.59 C ATOM 3201 CD2 LEU B 161 -8.773 4.631 -9.911 1.00 20.31 C ATOM 3202 H LEU B 161 -7.089 6.184 -8.030 1.00 0.00 H ATOM 3203 N ASN B 162 -3.779 3.383 -8.936 1.00 16.56 N ATOM 3204 CA ASN B 162 -2.341 3.221 -8.796 1.00 16.37 C ATOM 3205 C ASN B 162 -1.721 2.691 -10.087 1.00 22.69 C ATOM 3206 O ASN B 162 -1.488 1.496 -10.223 1.00 23.71 O ATOM 3207 CB ASN B 162 -2.007 2.267 -7.644 1.00 17.85 C ATOM 3208 CG ASN B 162 -0.520 2.187 -7.381 1.00 29.70 C ATOM 3209 OD1 ASN B 162 0.211 3.154 -7.602 1.00 31.67 O ATOM 3210 ND2 ASN B 162 -0.056 1.030 -6.934 1.00 28.63 N ATOM 3211 HD22 ASN B 162 -0.709 0.240 -6.761 1.00 0.00 H ATOM 3212 HD21 ASN B 162 0.962 0.912 -6.756 1.00 0.00 H ATOM 3213 H ASN B 162 -4.348 2.574 -9.256 1.00 0.00 H ATOM 3214 N PRO B 163 -1.452 3.579 -11.044 1.00 21.58 N ATOM 3215 CA PRO B 163 -0.940 3.123 -12.343 1.00 21.67 C ATOM 3216 C PRO B 163 0.491 2.597 -12.293 1.00 26.46 C ATOM 3217 O PRO B 163 0.941 2.004 -13.272 1.00 28.98 O ATOM 3218 CB PRO B 163 -1.016 4.383 -13.210 1.00 20.45 C ATOM 3219 CG PRO B 163 -0.982 5.514 -12.247 1.00 21.75 C ATOM 3220 CD PRO B 163 -1.695 5.032 -11.014 1.00 20.25 C ATOM 3221 N GLN B 164 1.172 2.776 -11.164 1.00 29.65 N ATOM 3222 CA GLN B 164 2.615 2.509 -11.043 1.00 39.55 C ATOM 3223 C GLN B 164 3.205 1.156 -11.508 1.00 46.48 C ATOM 3224 O GLN B 164 4.237 1.171 -12.179 1.00 52.14 O ATOM 3225 CB GLN B 164 3.037 2.722 -9.585 1.00 44.36 C ATOM 3226 CG GLN B 164 3.900 3.954 -9.374 1.00 48.96 C ATOM 3227 H GLN B 164 0.661 3.121 -10.327 1.00 0.00 H ATOM 3228 N GLY B 165 2.618 -0.004 -11.191 1.00 48.63 N ATOM 3229 CA GLY B 165 1.303 -0.184 -10.605 1.00 48.89 C ATOM 3230 C GLY B 165 0.521 -1.037 -11.589 1.00 52.87 C ATOM 3231 O GLY B 165 -0.274 -1.900 -11.208 1.00 59.53 O ATOM 3232 H GLY B 165 3.162 -0.869 -11.385 1.00 0.00 H ATOM 3233 N MET B 166 0.784 -0.792 -12.872 1.00 46.33 N ATOM 3234 CA MET B 166 0.102 -1.459 -13.977 1.00 38.05 C ATOM 3235 C MET B 166 1.051 -1.725 -15.128 1.00 38.39 C ATOM 3236 O MET B 166 2.160 -1.190 -15.171 1.00 40.99 O ATOM 3237 CB MET B 166 -1.067 -0.615 -14.485 1.00 29.60 C ATOM 3238 CG MET B 166 -2.175 -0.413 -13.480 1.00 27.60 C ATOM 3239 SD MET B 166 -3.400 0.720 -14.120 1.00 27.22 S ATOM 3240 CE MET B 166 -4.520 0.799 -12.723 1.00 30.02 C ATOM 3241 H MET B 166 1.515 -0.087 -13.098 1.00 0.00 H ATOM 3242 N ASP B 167 0.602 -2.539 -16.075 1.00 42.92 N ATOM 3243 CA ASP B 167 1.429 -2.895 -17.218 1.00 48.90 C ATOM 3244 C ASP B 167 1.625 -1.686 -18.122 1.00 53.90 C ATOM 3245 O ASP B 167 0.902 -1.503 -19.102 1.00 56.92 O ATOM 3246 CB ASP B 167 0.805 -4.057 -17.996 1.00 49.91 C ATOM 3247 CG ASP B 167 1.679 -4.535 -19.143 1.00 53.85 C ATOM 3248 OD1 ASP B 167 2.843 -4.089 -19.248 1.00 56.31 O ATOM 3249 OD2 ASP B 167 1.198 -5.367 -19.941 1.00 54.64 O ATOM 3250 H ASP B 167 -0.359 -2.930 -15.999 1.00 0.00 H ATOM 3251 N THR B 168 2.605 -0.859 -17.777 1.00 54.24 N ATOM 3252 CA THR B 168 2.936 0.305 -18.584 1.00 54.33 C ATOM 3253 C THR B 168 4.083 -0.032 -19.524 1.00 60.14 C ATOM 3254 O THR B 168 5.082 0.684 -19.584 1.00 64.72 O ATOM 3255 CB THR B 168 3.314 1.515 -17.711 1.00 49.73 C ATOM 3256 H THR B 168 3.148 -1.048 -16.910 1.00 0.00 H ATOM 3257 N SER B 169 3.933 -1.138 -20.247 1.00 61.89 N ATOM 3258 CA SER B 169 4.920 -1.574 -21.227 1.00 62.94 C ATOM 3259 C SER B 169 4.321 -1.507 -22.623 1.00 61.81 C ATOM 3260 O SER B 169 5.031 -1.530 -23.630 1.00 66.15 O ATOM 3261 CB SER B 169 5.392 -2.994 -20.922 1.00 64.86 C ATOM 3262 H SER B 169 3.078 -1.714 -20.108 1.00 0.00 H ATOM 3263 N ASN B 170 2.996 -1.445 -22.656 1.00 52.28 N ATOM 3264 CA ASN B 170 2.231 -1.267 -23.880 1.00 48.48 C ATOM 3265 C ASN B 170 1.102 -0.294 -23.562 1.00 45.88 C ATOM 3266 O ASN B 170 0.317 -0.531 -22.642 1.00 48.97 O ATOM 3267 CB ASN B 170 1.685 -2.602 -24.389 1.00 47.82 C ATOM 3268 CG ASN B 170 0.880 -2.458 -25.668 1.00 49.93 C ATOM 3269 OD1 ASN B 170 -0.231 -1.926 -25.664 1.00 46.16 O ATOM 3270 ND2 ASN B 170 1.431 -2.953 -26.769 1.00 61.51 N ATOM 3271 HD22 ASN B 170 2.372 -3.394 -26.727 1.00 0.00 H ATOM 3272 HD21 ASN B 170 0.922 -2.900 -27.674 1.00 0.00 H ATOM 3273 H ASN B 170 2.477 -1.528 -21.759 1.00 0.00 H ATOM 3274 N MET B 171 1.024 0.802 -24.307 1.00 44.81 N ATOM 3275 CA MET B 171 0.103 1.876 -23.948 1.00 36.19 C ATOM 3276 C MET B 171 -1.363 1.476 -24.115 1.00 35.99 C ATOM 3277 O MET B 171 -2.207 1.872 -23.309 1.00 32.20 O ATOM 3278 CB MET B 171 0.415 3.133 -24.760 1.00 42.55 C ATOM 3279 CG MET B 171 1.815 3.696 -24.504 1.00 46.36 C ATOM 3280 SD MET B 171 1.962 4.899 -23.153 1.00 57.83 S ATOM 3281 CE MET B 171 1.735 3.894 -21.679 1.00 37.92 C ATOM 3282 H MET B 171 1.623 0.896 -25.152 1.00 0.00 H ATOM 3283 N ASP B 172 -1.665 0.680 -25.137 1.00 40.47 N ATOM 3284 CA ASP B 172 -3.024 0.176 -25.313 1.00 37.46 C ATOM 3285 C ASP B 172 -3.434 -0.727 -24.149 1.00 39.95 C ATOM 3286 O ASP B 172 -4.542 -0.612 -23.623 1.00 36.47 O ATOM 3287 CB ASP B 172 -3.158 -0.577 -26.640 1.00 41.30 C ATOM 3288 CG ASP B 172 -3.413 0.352 -27.816 1.00 46.18 C ATOM 3289 OD1 ASP B 172 -3.892 1.485 -27.588 1.00 48.51 O ATOM 3290 OD2 ASP B 172 -3.143 -0.051 -28.968 1.00 49.63 O ATOM 3291 H ASP B 172 -0.925 0.414 -25.818 1.00 0.00 H ATOM 3292 N VAL B 173 -2.535 -1.617 -23.742 1.00 40.38 N ATOM 3293 CA VAL B 173 -2.814 -2.517 -22.625 1.00 40.33 C ATOM 3294 C VAL B 173 -2.965 -1.739 -21.321 1.00 36.13 C ATOM 3295 O VAL B 173 -3.854 -2.026 -20.516 1.00 35.07 O ATOM 3296 CB VAL B 173 -1.709 -3.585 -22.465 1.00 39.07 C ATOM 3297 CG1 VAL B 173 -1.979 -4.465 -21.248 1.00 38.19 C ATOM 3298 CG2 VAL B 173 -1.612 -4.433 -23.721 1.00 43.34 C ATOM 3299 H VAL B 173 -1.617 -1.674 -24.227 1.00 0.00 H ATOM 3300 N PHE B 174 -2.106 -0.739 -21.128 1.00 33.47 N ATOM 3301 CA PHE B 174 -2.164 0.099 -19.939 1.00 28.30 C ATOM 3302 C PHE B 174 -3.527 0.768 -19.817 1.00 26.15 C ATOM 3303 O PHE B 174 -4.149 0.750 -18.753 1.00 24.25 O ATOM 3304 CB PHE B 174 -1.051 1.156 -19.965 1.00 31.16 C ATOM 3305 CG PHE B 174 -1.187 2.206 -18.892 1.00 25.38 C ATOM 3306 CD1 PHE B 174 -0.905 1.910 -17.564 1.00 29.39 C ATOM 3307 CD2 PHE B 174 -1.601 3.489 -19.209 1.00 27.78 C ATOM 3308 CE1 PHE B 174 -1.040 2.880 -16.572 1.00 26.39 C ATOM 3309 CE2 PHE B 174 -1.734 4.457 -18.234 1.00 24.81 C ATOM 3310 CZ PHE B 174 -1.455 4.155 -16.906 1.00 24.86 C ATOM 3311 H PHE B 174 -1.376 -0.552 -21.845 1.00 0.00 H ATOM 3312 N VAL B 175 -4.001 1.340 -20.919 1.00 26.89 N ATOM 3313 CA VAL B 175 -5.286 2.027 -20.907 1.00 25.99 C ATOM 3314 C VAL B 175 -6.433 1.097 -20.501 1.00 25.25 C ATOM 3315 O VAL B 175 -7.276 1.476 -19.689 1.00 23.45 O ATOM 3316 CB VAL B 175 -5.591 2.655 -22.277 1.00 28.44 C ATOM 3317 CG1 VAL B 175 -7.039 3.100 -22.341 1.00 26.88 C ATOM 3318 CG2 VAL B 175 -4.653 3.832 -22.527 1.00 27.11 C ATOM 3319 H VAL B 175 -3.449 1.297 -21.799 1.00 0.00 H ATOM 3320 N GLN B 176 -6.460 -0.122 -21.028 1.00 28.18 N ATOM 3321 CA GLN B 176 -7.562 -1.015 -20.684 1.00 32.42 C ATOM 3322 C GLN B 176 -7.439 -1.521 -19.248 1.00 32.49 C ATOM 3323 O GLN B 176 -8.447 -1.672 -18.559 1.00 31.05 O ATOM 3324 CB GLN B 176 -7.652 -2.184 -21.664 1.00 39.67 C ATOM 3325 CG GLN B 176 -7.879 -1.761 -23.122 1.00 45.65 C ATOM 3326 CD GLN B 176 -8.880 -0.615 -23.290 1.00 50.35 C ATOM 3327 OE1 GLN B 176 -9.914 -0.558 -22.619 1.00 54.41 O ATOM 3328 NE2 GLN B 176 -8.570 0.303 -24.198 1.00 50.51 N ATOM 3329 HE22 GLN B 176 -7.688 0.218 -24.743 1.00 0.00 H ATOM 3330 HE21 GLN B 176 -9.209 1.107 -24.364 1.00 0.00 H ATOM 3331 H GLN B 176 -5.708 -0.435 -21.675 1.00 0.00 H ATOM 3332 N GLN B 177 -6.211 -1.770 -18.796 1.00 29.60 N ATOM 3333 CA GLN B 177 -5.978 -2.157 -17.406 1.00 29.75 C ATOM 3334 C GLN B 177 -6.456 -1.059 -16.455 1.00 24.97 C ATOM 3335 O GLN B 177 -7.089 -1.328 -15.433 1.00 26.43 O ATOM 3336 CB GLN B 177 -4.499 -2.451 -17.167 1.00 35.07 C ATOM 3337 CG GLN B 177 -4.181 -2.920 -15.752 1.00 40.58 C ATOM 3338 CD GLN B 177 -2.800 -3.544 -15.644 1.00 41.47 C ATOM 3339 OE1 GLN B 177 -2.061 -3.601 -16.624 1.00 36.92 O ATOM 3340 NE2 GLN B 177 -2.449 -4.021 -14.446 1.00 41.52 N ATOM 3341 HE22 GLN B 177 -3.108 -3.950 -13.645 1.00 0.00 H ATOM 3342 HE21 GLN B 177 -1.517 -4.463 -14.315 1.00 0.00 H ATOM 3343 H GLN B 177 -5.402 -1.687 -19.445 1.00 0.00 H ATOM 3344 N TYR B 178 -6.141 0.184 -16.798 1.00 24.91 N ATOM 3345 CA TYR B 178 -6.554 1.323 -15.998 1.00 20.47 C ATOM 3346 C TYR B 178 -8.087 1.430 -15.980 1.00 21.74 C ATOM 3347 O TYR B 178 -8.700 1.514 -14.918 1.00 22.26 O ATOM 3348 CB TYR B 178 -5.913 2.601 -16.551 1.00 21.29 C ATOM 3349 CG TYR B 178 -5.984 3.814 -15.645 1.00 20.04 C ATOM 3350 CD1 TYR B 178 -7.162 4.532 -15.505 1.00 19.76 C ATOM 3351 CD2 TYR B 178 -4.861 4.257 -14.955 1.00 20.99 C ATOM 3352 CE1 TYR B 178 -7.234 5.642 -14.680 1.00 20.86 C ATOM 3353 CE2 TYR B 178 -4.916 5.378 -14.132 1.00 18.88 C ATOM 3354 CZ TYR B 178 -6.110 6.062 -13.997 1.00 19.71 C ATOM 3355 OH TYR B 178 -6.184 7.174 -13.195 1.00 18.40 O ATOM 3356 HH TYR B 178 -7.106 7.534 -13.216 1.00 0.00 H ATOM 3357 H TYR B 178 -5.584 0.346 -17.661 1.00 0.00 H ATOM 3358 N ALA B 179 -8.703 1.393 -17.158 1.00 25.42 N ATOM 3359 CA ALA B 179 -10.152 1.528 -17.258 1.00 22.86 C ATOM 3360 C ALA B 179 -10.881 0.359 -16.590 1.00 23.41 C ATOM 3361 O ALA B 179 -11.914 0.552 -15.951 1.00 23.15 O ATOM 3362 CB ALA B 179 -10.574 1.657 -18.725 1.00 23.36 C ATOM 3363 H ALA B 179 -8.141 1.265 -18.024 1.00 0.00 H ATOM 3364 N ASP B 180 -10.343 -0.850 -16.729 1.00 23.42 N ATOM 3365 CA ASP B 180 -10.947 -2.014 -16.081 1.00 26.68 C ATOM 3366 C ASP B 180 -10.886 -1.879 -14.562 1.00 22.76 C ATOM 3367 O ASP B 180 -11.772 -2.354 -13.855 1.00 23.47 O ATOM 3368 CB ASP B 180 -10.260 -3.313 -16.513 1.00 28.93 C ATOM 3369 CG ASP B 180 -10.619 -3.718 -17.925 1.00 35.23 C ATOM 3370 OD1 ASP B 180 -11.614 -3.188 -18.461 1.00 36.95 O ATOM 3371 OD2 ASP B 180 -9.904 -4.564 -18.497 1.00 35.02 O ATOM 3372 H ASP B 180 -9.485 -0.969 -17.304 1.00 0.00 H ATOM 3373 N THR B 181 -9.844 -1.223 -14.064 1.00 21.25 N ATOM 3374 CA THR B 181 -9.685 -1.066 -12.623 1.00 21.42 C ATOM 3375 C THR B 181 -10.740 -0.106 -12.088 1.00 20.68 C ATOM 3376 O THR B 181 -11.323 -0.329 -11.024 1.00 22.38 O ATOM 3377 CB THR B 181 -8.281 -0.554 -12.258 1.00 19.99 C ATOM 3378 OG1 THR B 181 -7.301 -1.475 -12.749 1.00 21.67 O ATOM 3379 CG2 THR B 181 -8.132 -0.421 -10.740 1.00 21.22 C ATOM 3380 HG1 THR B 181 -7.383 -1.549 -13.733 1.00 0.00 H ATOM 3381 H THR B 181 -9.135 -0.818 -14.708 1.00 0.00 H ATOM 3382 N VAL B 182 -10.986 0.964 -12.832 1.00 19.52 N ATOM 3383 CA VAL B 182 -11.997 1.926 -12.420 1.00 19.07 C ATOM 3384 C VAL B 182 -13.366 1.247 -12.381 1.00 22.15 C ATOM 3385 O VAL B 182 -14.130 1.450 -11.437 1.00 21.95 O ATOM 3386 CB VAL B 182 -12.054 3.149 -13.343 1.00 18.24 C ATOM 3387 CG1 VAL B 182 -13.156 4.094 -12.878 1.00 19.50 C ATOM 3388 CG2 VAL B 182 -10.710 3.873 -13.356 1.00 19.84 C ATOM 3389 H VAL B 182 -10.454 1.116 -13.713 1.00 0.00 H ATOM 3390 N LYS B 183 -13.660 0.435 -13.395 1.00 24.08 N ATOM 3391 CA LYS B 183 -14.931 -0.284 -13.451 1.00 25.06 C ATOM 3392 C LYS B 183 -15.084 -1.195 -12.231 1.00 26.08 C ATOM 3393 O LYS B 183 -16.108 -1.167 -11.547 1.00 28.26 O ATOM 3394 CB LYS B 183 -15.035 -1.092 -14.755 1.00 24.67 C ATOM 3395 CG LYS B 183 -16.237 -2.028 -14.848 1.00 27.24 C ATOM 3396 CD LYS B 183 -16.298 -2.668 -16.230 1.00 29.05 C ATOM 3397 CE LYS B 183 -17.484 -3.616 -16.365 1.00 39.44 C ATOM 3398 NZ LYS B 183 -17.305 -4.868 -15.590 1.00 43.65 N ATOM 3399 HZ1 LYS B 183 -16.457 -5.366 -15.929 1.00 0.00 H ATOM 3400 HZ2 LYS B 183 -17.193 -4.637 -14.582 1.00 0.00 H ATOM 3401 HZ3 LYS B 183 -18.140 -5.475 -15.717 1.00 0.00 H ATOM 3402 H LYS B 183 -12.970 0.310 -14.163 1.00 0.00 H ATOM 3403 N TYR B 184 -14.054 -1.988 -11.957 1.00 23.95 N ATOM 3404 CA TYR B 184 -14.036 -2.864 -10.792 1.00 27.39 C ATOM 3405 C TYR B 184 -14.307 -2.102 -9.494 1.00 24.39 C ATOM 3406 O TYR B 184 -15.123 -2.526 -8.674 1.00 28.77 O ATOM 3407 CB TYR B 184 -12.689 -3.592 -10.692 1.00 25.39 C ATOM 3408 CG TYR B 184 -12.519 -4.391 -9.420 1.00 28.37 C ATOM 3409 CD1 TYR B 184 -13.050 -5.670 -9.307 1.00 30.75 C ATOM 3410 CD2 TYR B 184 -11.828 -3.867 -8.330 1.00 31.29 C ATOM 3411 CE1 TYR B 184 -12.900 -6.408 -8.142 1.00 38.50 C ATOM 3412 CE2 TYR B 184 -11.672 -4.596 -7.165 1.00 33.93 C ATOM 3413 CZ TYR B 184 -12.210 -5.864 -7.076 1.00 36.47 C ATOM 3414 OH TYR B 184 -12.060 -6.591 -5.919 1.00 40.15 O ATOM 3415 HH TYR B 184 -12.502 -7.471 -6.024 1.00 0.00 H ATOM 3416 H TYR B 184 -13.233 -1.984 -12.595 1.00 0.00 H ATOM 3417 N LEU B 185 -13.611 -0.985 -9.303 1.00 22.20 N ATOM 3418 CA LEU B 185 -13.735 -0.223 -8.067 1.00 24.41 C ATOM 3419 C LEU B 185 -15.118 0.400 -7.918 1.00 26.57 C ATOM 3420 O LEU B 185 -15.655 0.491 -6.814 1.00 28.10 O ATOM 3421 CB LEU B 185 -12.669 0.871 -8.006 1.00 21.22 C ATOM 3422 CG LEU B 185 -11.241 0.387 -7.752 1.00 19.13 C ATOM 3423 CD1 LEU B 185 -10.269 1.551 -7.901 1.00 17.18 C ATOM 3424 CD2 LEU B 185 -11.124 -0.255 -6.374 1.00 25.60 C ATOM 3425 H LEU B 185 -12.968 -0.650 -10.048 1.00 0.00 H ATOM 3426 N SER B 186 -15.692 0.832 -9.033 1.00 26.19 N ATOM 3427 CA SER B 186 -16.989 1.486 -8.995 1.00 29.36 C ATOM 3428 C SER B 186 -18.075 0.479 -8.636 1.00 33.11 C ATOM 3429 O SER B 186 -19.136 0.852 -8.151 1.00 36.33 O ATOM 3430 CB SER B 186 -17.297 2.151 -10.337 1.00 36.35 C ATOM 3431 OG SER B 186 -17.520 1.182 -11.345 1.00 45.20 O ATOM 3432 HG SER B 186 -16.711 0.621 -11.447 1.00 0.00 H ATOM 3433 H SER B 186 -15.208 0.701 -9.944 1.00 0.00 H ATOM 3434 N GLU B 187 -17.778 -0.799 -8.861 1.00 31.04 N ATOM 3435 CA GLU B 187 -18.720 -1.892 -8.632 1.00 35.46 C ATOM 3436 C GLU B 187 -18.668 -2.438 -7.210 1.00 40.45 C ATOM 3437 O GLU B 187 -19.518 -3.243 -6.828 1.00 50.87 O ATOM 3438 CB GLU B 187 -18.453 -3.041 -9.612 1.00 35.16 C ATOM 3439 CG GLU B 187 -18.885 -2.781 -11.047 1.00 38.08 C ATOM 3440 CD GLU B 187 -18.315 -3.799 -12.020 1.00 41.71 C ATOM 3441 OE1 GLU B 187 -18.809 -3.867 -13.165 1.00 47.11 O ATOM 3442 OE2 GLU B 187 -17.369 -4.529 -11.647 1.00 42.48 O ATOM 3443 H GLU B 187 -16.829 -1.031 -9.217 1.00 0.00 H ATOM 3444 N LYS B 188 -17.670 -2.025 -6.435 1.00 39.44 N ATOM 3445 CA LYS B 188 -17.479 -2.579 -5.095 1.00 48.16 C ATOM 3446 C LYS B 188 -18.518 -2.068 -4.106 1.00 55.15 C ATOM 3447 O LYS B 188 -19.097 -2.843 -3.339 1.00 59.93 O ATOM 3448 CB LYS B 188 -16.076 -2.265 -4.573 1.00 45.61 C ATOM 3449 CG LYS B 188 -14.960 -2.746 -5.479 1.00 46.64 C ATOM 3450 CD LYS B 188 -13.585 -2.664 -4.816 1.00 45.18 C ATOM 3451 CE LYS B 188 -13.672 -2.638 -3.302 1.00 46.39 C ATOM 3452 NZ LYS B 188 -12.741 -3.630 -2.691 1.00 50.40 N ATOM 3453 HZ1 LYS B 188 -12.988 -4.585 -3.022 1.00 0.00 H ATOM 3454 HZ2 LYS B 188 -11.765 -3.406 -2.972 1.00 0.00 H ATOM 3455 HZ3 LYS B 188 -12.823 -3.589 -1.655 1.00 0.00 H ATOM 3456 H LYS B 188 -17.015 -1.297 -6.787 1.00 0.00 H TER 3457 LYS B 188 HETATM 3458 NA NA A 1 -3.896 7.858 -11.882 1.00 26.06 NA HETATM 3459 O HOH 2 19.402 44.847 -5.420 1.00 44.41 O HETATM 3460 O HOH 3 7.280 42.319 -19.285 1.00 42.47 O HETATM 3461 O HOH 4 0.650 40.125 -12.288 1.00 37.99 O HETATM 3462 O HOH 5 -3.165 35.579 -16.702 1.00 21.80 O HETATM 3463 O HOH 6 14.332 0.010 -19.616 1.00 46.09 O HETATM 3464 O HOH 7 26.852 22.391 -26.857 1.00 37.98 O HETATM 3465 O HOH 8 22.195 26.347 -28.584 1.00 42.12 O HETATM 3466 O HOH 9 1.851 40.159 -15.449 1.00 38.96 O HETATM 3467 O HOH 10 14.983 32.592 -28.393 1.00 36.13 O HETATM 3468 O HOH 11 15.445 25.640 -27.366 1.00 38.38 O HETATM 3469 O HOH 12 15.671 45.410 -15.355 1.00 28.97 O HETATM 3470 O HOH 13 16.958 20.112 -31.057 1.00 25.59 O HETATM 3471 O HOH 14 17.112 19.494 -0.530 1.00 39.76 O HETATM 3472 O HOH 15 8.272 18.291 -28.130 1.00 34.20 O HETATM 3473 O HOH 16 15.932 43.324 1.066 1.00 36.38 O HETATM 3474 O HOH 17 -1.131 39.518 -16.559 1.00 35.24 O HETATM 3475 O HOH 18 16.587 5.985 -34.951 1.00 42.19 O HETATM 3476 O HOH 19 16.444 14.947 -31.015 1.00 29.41 O HETATM 3477 O HOH 20 7.710 43.482 -15.914 1.00 38.79 O HETATM 3478 O HOH 21 34.912 3.395 -17.209 1.00 43.92 O HETATM 3479 O HOH 22 15.672 10.734 -29.089 1.00 22.18 O HETATM 3480 O HOH 23 20.429 28.643 -24.687 1.00 35.37 O HETATM 3481 O HOH 24 17.923 44.347 -16.304 1.00 30.08 O HETATM 3482 O HOH 25 21.409 26.165 0.843 1.00 33.40 O HETATM 3483 O HOH 26 13.755 6.214 -10.807 1.00 33.50 O HETATM 3484 O HOH 27 19.380 27.047 -27.711 1.00 38.25 O HETATM 3485 O HOH 28 12.049 0.171 -22.163 1.00 37.78 O HETATM 3486 O HOH 29 22.928 6.375 -33.978 1.00 38.43 O HETATM 3487 O HOH 30 16.479 48.512 -8.742 1.00 37.83 O HETATM 3488 O HOH 31 16.074 10.122 -5.422 1.00 33.62 O HETATM 3489 O HOH 32 23.935 21.172 -28.105 1.00 26.03 O HETATM 3490 O HOH 33 24.150 2.638 -14.831 1.00 42.80 O HETATM 3491 O HOH 34 38.038 11.505 -14.297 1.00 28.36 O HETATM 3492 O HOH 35 17.132 43.706 -20.662 1.00 45.70 O HETATM 3493 O HOH 36 37.111 3.819 -20.298 1.00 34.89 O HETATM 3494 O HOH 37 13.577 29.499 -27.645 1.00 34.67 O HETATM 3495 O HOH 38 22.751 23.566 -31.352 1.00 36.15 O HETATM 3496 O HOH 39 38.682 15.875 -17.876 1.00 28.52 O HETATM 3497 O HOH 40 19.479 16.557 -34.387 1.00 33.56 O HETATM 3498 O HOH 41 13.596 45.785 -16.978 1.00 30.90 O HETATM 3499 O HOH 42 15.769 4.436 -10.740 1.00 31.63 O HETATM 3500 O HOH 43 -3.534 39.731 -14.634 1.00 34.12 O HETATM 3501 O HOH 44 36.471 6.407 -24.078 1.00 31.89 O HETATM 3502 O HOH 45 34.509 11.404 -23.748 1.00 33.87 O HETATM 3503 O HOH 46 24.245 4.337 -34.043 1.00 35.64 O HETATM 3504 O HOH 47 33.853 31.253 -17.539 1.00 46.90 O HETATM 3505 O HOH 48 -1.184 39.420 -19.475 1.00 37.32 O HETATM 3506 O HOH 49 22.666 46.499 -22.768 1.00 50.87 O HETATM 3507 O HOH 50 18.074 -1.939 -18.635 1.00 37.08 O HETATM 3508 O HOH 51 20.071 -0.506 -18.539 1.00 35.61 O HETATM 3509 O HOH 52 22.505 47.588 -20.704 1.00 42.15 O HETATM 3510 O HOH 53 39.891 15.615 -15.379 1.00 39.42 O HETATM 3511 O HOH 54 20.241 46.008 -16.380 1.00 37.21 O HETATM 3512 O HOH 55 18.544 45.206 -1.824 1.00 45.86 O HETATM 3513 O HOH 56 19.170 19.356 2.749 1.00 51.49 O HETATM 3514 O HOH 57 14.079 19.753 -6.283 1.00 17.83 O HETATM 3515 O HOH 58 17.564 14.726 -33.449 1.00 50.61 O HETATM 3516 O HOH 59 9.146 44.406 -13.301 1.00 40.05 O HETATM 3517 O HOH 60 25.344 18.450 -35.106 1.00 39.14 O HETATM 3518 O HOH 61 6.492 40.375 -21.988 1.00 44.02 O HETATM 3519 O HOH 62 15.204 12.327 -31.264 1.00 30.62 O HETATM 3520 O HOH 63 12.204 26.875 -28.929 1.00 28.05 O HETATM 3521 O HOH 64 24.926 48.392 -18.796 1.00 32.29 O HETATM 3522 O HOH 65 13.731 9.095 -28.763 1.00 38.19 O HETATM 3523 O HOH 66 15.143 33.177 -31.105 1.00 38.22 O HETATM 3524 O HOH 67 14.453 24.178 -2.906 1.00 40.09 O HETATM 3525 O HOH 68 37.532 14.763 -10.991 1.00 35.27 O HETATM 3526 O HOH 69 11.093 46.131 -15.770 1.00 44.98 O HETATM 3527 O HOH 70 35.285 11.124 -10.194 1.00 34.09 O HETATM 3528 O HOH 71 9.847 27.931 -29.928 1.00 33.46 O HETATM 3529 O HOH 72 37.275 11.406 -12.225 1.00 32.04 O HETATM 3530 O HOH 73 23.050 2.511 -33.215 1.00 53.07 O HETATM 3531 O HOH 74 10.038 20.379 -28.770 1.00 25.29 O HETATM 3532 O HOH 75 16.026 22.438 -30.825 1.00 40.74 O HETATM 3533 O HOH 76 37.078 3.075 -13.243 1.00 35.88 O HETATM 3534 O HOH 77 16.859 20.578 1.795 1.00 29.46 O HETATM 3535 O HOH 78 21.680 35.124 -28.978 1.00 45.85 O HETATM 3536 O HOH 79 26.171 3.713 -35.904 1.00 54.08 O HETATM 3537 O HOH 80 19.856 36.275 4.799 1.00 39.97 O HETATM 3538 O HOH 81 26.277 36.785 -29.666 1.00 40.37 O HETATM 3539 O HOH 82 16.733 26.880 -0.400 1.00 56.78 O HETATM 3540 O HOH 83 17.362 30.000 -8.613 1.00 19.66 O HETATM 3541 O HOH 84 8.928 10.357 -25.006 1.00 20.24 O HETATM 3542 O HOH 85 15.262 22.756 -17.365 1.00 20.24 O HETATM 3543 O HOH 86 18.012 14.111 -10.775 1.00 24.06 O HETATM 3544 O HOH 87 9.886 21.492 -9.859 1.00 23.78 O HETATM 3545 O HOH 88 5.688 11.938 -15.146 1.00 26.40 O HETATM 3546 O HOH 89 11.669 10.168 -25.227 1.00 21.51 O HETATM 3547 O HOH 90 4.689 18.934 -23.171 1.00 21.03 O HETATM 3548 O HOH 91 14.328 25.730 -25.145 1.00 20.05 O HETATM 3549 O HOH 92 32.640 10.951 -11.191 1.00 29.06 O HETATM 3550 O HOH 93 26.676 23.034 -19.502 1.00 21.22 O HETATM 3551 O HOH 94 32.748 9.128 -27.930 1.00 28.35 O HETATM 3552 O HOH 95 17.536 25.545 -14.099 1.00 23.78 O HETATM 3553 O HOH 96 15.584 27.466 -23.211 1.00 22.38 O HETATM 3554 O HOH 97 14.119 5.811 -24.888 1.00 25.10 O HETATM 3555 O HOH 98 27.308 31.316 -10.998 1.00 25.57 O HETATM 3556 O HOH 99 16.223 18.881 -27.401 1.00 22.17 O HETATM 3557 O HOH 100 22.532 27.902 -18.615 1.00 27.59 O HETATM 3558 O HOH 101 13.760 3.053 -24.976 1.00 40.31 O HETATM 3559 O HOH 102 11.944 20.170 -8.978 1.00 22.60 O HETATM 3560 O HOH 103 32.507 7.494 -17.143 1.00 25.55 O HETATM 3561 O HOH 104 13.057 42.152 -13.618 1.00 30.69 O HETATM 3562 O HOH 105 16.866 32.769 -4.535 1.00 31.99 O HETATM 3563 O HOH 106 16.770 22.745 -19.932 1.00 25.26 O HETATM 3564 O HOH 107 18.437 20.655 -20.468 1.00 24.38 O HETATM 3565 O HOH 108 26.733 17.580 -4.799 1.00 35.45 O HETATM 3566 O HOH 109 24.806 18.515 -9.642 1.00 26.48 O HETATM 3567 O HOH 110 9.299 8.587 -15.017 1.00 25.87 O HETATM 3568 O HOH 111 32.103 7.035 -14.474 1.00 39.85 O HETATM 3569 O HOH 112 22.613 23.274 -22.632 1.00 32.50 O HETATM 3570 O HOH 113 29.141 21.220 -24.407 1.00 26.06 O HETATM 3571 O HOH 114 15.974 0.047 -23.430 1.00 33.35 O HETATM 3572 O HOH 115 26.166 11.668 -10.103 1.00 34.61 O HETATM 3573 O HOH 116 12.267 24.558 -28.311 1.00 35.38 O HETATM 3574 O HOH 117 2.646 7.203 -20.531 1.00 29.00 O HETATM 3575 O HOH 118 24.302 35.866 -24.451 1.00 37.39 O HETATM 3576 O HOH 119 31.417 11.776 -8.759 1.00 36.28 O HETATM 3577 O HOH 120 1.923 37.326 -10.447 1.00 34.74 O HETATM 3578 O HOH 121 11.113 43.699 -14.958 1.00 38.17 O HETATM 3579 O HOH 122 22.366 37.964 -26.602 1.00 36.20 O HETATM 3580 O HOH 123 12.038 7.546 -24.264 1.00 30.47 O HETATM 3581 O HOH 124 17.216 28.404 -14.303 1.00 37.26 O HETATM 3582 O HOH 125 5.382 17.745 -25.409 1.00 28.94 O HETATM 3583 O HOH 126 13.992 6.867 -27.655 1.00 35.45 O HETATM 3584 O HOH 127 2.656 37.173 -23.696 1.00 41.87 O HETATM 3585 O HOH 128 22.748 5.038 -20.693 1.00 28.04 O HETATM 3586 O HOH 129 32.498 22.012 -10.080 1.00 32.32 O HETATM 3587 O HOH 130 10.017 40.562 -10.358 1.00 34.14 O HETATM 3588 O HOH 131 19.181 25.775 -2.922 1.00 36.13 O HETATM 3589 O HOH 132 29.542 3.967 -15.657 1.00 32.95 O HETATM 3590 O HOH 133 11.795 31.628 -26.606 1.00 32.96 O HETATM 3591 O HOH 134 12.728 23.003 -26.262 1.00 32.24 O HETATM 3592 O HOH 135 26.213 10.285 -12.184 1.00 28.81 O HETATM 3593 O HOH 136 28.865 29.940 -17.297 1.00 34.93 O HETATM 3594 O HOH 137 36.621 17.008 -12.056 1.00 36.26 O HETATM 3595 O HOH 138 25.346 6.413 -13.645 1.00 34.64 O HETATM 3596 O HOH 139 5.850 20.401 -15.506 1.00 37.61 O HETATM 3597 O HOH 140 10.738 13.870 -27.869 1.00 36.97 O HETATM 3598 O HOH 141 22.811 26.860 -21.057 1.00 34.23 O HETATM 3599 O HOH 142 30.964 9.015 -12.862 1.00 35.78 O HETATM 3600 O HOH 143 25.528 22.668 -21.869 1.00 37.63 O HETATM 3601 O HOH 144 7.855 12.407 -26.590 1.00 30.04 O HETATM 3602 O HOH 145 9.011 32.215 -23.447 1.00 27.93 O HETATM 3603 O HOH 146 9.101 34.879 -23.771 1.00 31.73 O HETATM 3604 O HOH 147 17.769 26.033 -5.161 1.00 34.03 O HETATM 3605 O HOH 148 31.116 16.959 -4.711 1.00 42.00 O HETATM 3606 O HOH 149 32.949 16.276 -7.045 1.00 33.46 O HETATM 3607 O HOH 150 8.061 12.191 -13.794 1.00 35.56 O HETATM 3608 O HOH 151 21.682 27.437 -2.886 1.00 39.90 O HETATM 3609 O HOH 152 15.442 24.714 -15.693 1.00 31.52 O HETATM 3610 O HOH 153 6.229 20.405 -26.877 1.00 30.66 O HETATM 3611 O HOH 154 8.261 7.785 -26.074 1.00 35.73 O HETATM 3612 O HOH 155 16.218 26.801 -17.635 1.00 35.19 O HETATM 3613 O HOH 156 29.372 23.277 -19.986 1.00 34.66 O HETATM 3614 O HOH 157 5.830 6.873 -26.488 1.00 37.10 O HETATM 3615 O HOH 158 10.148 21.921 -26.468 1.00 27.14 O HETATM 3616 O HOH 159 19.517 37.113 0.473 1.00 33.68 O HETATM 3617 O HOH 160 11.353 33.717 -28.735 1.00 51.22 O HETATM 3618 O HOH 161 11.459 10.216 -28.005 1.00 34.96 O HETATM 3619 O HOH 162 34.413 9.175 -25.777 1.00 41.14 O HETATM 3620 O HOH 163 24.948 3.323 -20.912 1.00 35.51 O HETATM 3621 O HOH 164 22.905 24.121 -25.246 1.00 41.70 O HETATM 3622 O HOH 165 35.219 18.447 -9.813 1.00 33.33 O HETATM 3623 O HOH 166 26.458 2.208 -22.823 1.00 29.82 O HETATM 3624 O HOH 167 28.159 8.608 -12.645 1.00 34.04 O HETATM 3625 O HOH 168 23.834 16.625 -7.804 1.00 31.05 O HETATM 3626 O HOH 169 20.795 25.440 -21.970 1.00 36.39 O HETATM 3627 O HOH 170 14.889 18.541 -29.758 1.00 31.08 O HETATM 3628 O HOH 171 28.085 3.107 -33.526 1.00 41.21 O HETATM 3629 O HOH 172 34.023 17.938 -22.233 1.00 36.75 O HETATM 3630 O HOH 173 5.148 12.640 -26.959 1.00 34.08 O HETATM 3631 O HOH 174 11.640 6.309 -12.758 1.00 37.33 O HETATM 3632 O HOH 175 25.035 30.427 1.396 1.00 57.37 O HETATM 3633 O HOH 176 34.490 7.866 -29.712 1.00 38.88 O HETATM 3634 O HOH 177 8.899 13.941 -12.149 1.00 41.40 O HETATM 3635 O HOH 178 25.159 30.467 -23.734 1.00 47.32 O HETATM 3636 O HOH 179 32.546 2.565 -28.040 1.00 38.48 O HETATM 3637 O HOH 180 34.671 13.704 -25.169 1.00 37.90 O HETATM 3638 O HOH 181 11.489 7.360 -14.972 1.00 30.48 O HETATM 3639 O HOH 182 35.245 16.919 -7.473 1.00 35.78 O HETATM 3640 O HOH 183 19.077 25.824 -24.042 1.00 39.97 O HETATM 3641 O HOH 184 8.689 9.848 -12.757 1.00 39.69 O HETATM 3642 O HOH 185 28.712 0.988 -21.901 1.00 32.90 O HETATM 3643 O HOH 186 27.281 39.416 -10.461 1.00 38.66 O HETATM 3644 O HOH 187 31.529 26.410 -17.124 1.00 44.11 O HETATM 3645 O HOH 188 31.431 27.047 -1.351 1.00 43.45 O HETATM 3646 O HOH 189 35.914 17.886 -20.113 1.00 37.51 O HETATM 3647 O HOH 190 10.140 2.189 -22.428 1.00 36.79 O HETATM 3648 O HOH 191 28.785 26.441 -8.169 1.00 43.37 O HETATM 3649 O HOH 192 3.276 38.566 -8.383 1.00 46.20 O HETATM 3650 O HOH 193 11.336 42.598 -11.484 1.00 37.56 O HETATM 3651 O HOH 194 22.207 29.221 -22.911 1.00 45.39 O HETATM 3652 O HOH 195 28.037 4.308 -13.919 1.00 38.95 O HETATM 3653 O HOH 196 30.328 22.565 -22.193 1.00 41.07 O HETATM 3654 O HOH 197 2.420 5.845 -13.510 1.00 28.70 O HETATM 3655 O HOH 198 6.129 15.972 -28.067 1.00 39.25 O HETATM 3656 O HOH 199 5.385 33.896 -26.466 1.00 41.92 O HETATM 3657 O HOH 200 34.631 3.410 -29.750 1.00 48.38 O HETATM 3658 O HOH 201 20.234 1.036 -25.696 1.00 40.31 O HETATM 3659 O HOH 202 9.490 37.451 -22.409 1.00 44.93 O HETATM 3660 O HOH 203 32.530 29.693 -1.578 1.00 50.61 O HETATM 3661 O HOH 204 2.381 14.245 -28.081 1.00 38.16 O HETATM 3662 O HOH 205 7.969 39.031 -23.872 1.00 46.64 O HETATM 3663 O HOH 206 3.716 34.751 -8.318 1.00 50.15 O HETATM 3664 O HOH 207 12.115 31.046 -5.920 1.00 33.82 O HETATM 3665 O HOH 208 17.165 23.214 -25.742 1.00 44.28 O HETATM 3666 O HOH 209 28.210 28.963 2.477 1.00 45.55 O HETATM 3667 O HOH 210 12.507 38.183 -22.476 1.00 40.32 O HETATM 3668 O HOH 211 27.160 36.410 -2.458 1.00 38.56 O HETATM 3669 O HOH 212 25.814 42.100 -18.841 1.00 50.09 O HETATM 3670 O HOH 213 33.108 5.239 -31.085 1.00 41.01 O HETATM 3671 O HOH 214 15.585 21.572 -27.659 1.00 36.68 O HETATM 3672 O HOH 215 19.637 22.646 -22.341 1.00 35.69 O HETATM 3673 O HOH 216 8.874 33.503 -27.324 1.00 47.39 O HETATM 3674 O HOH 217 32.586 10.318 -30.109 1.00 45.67 O HETATM 3675 O HOH 218 19.459 22.030 -24.679 1.00 47.23 O HETATM 3676 O HOH 219 12.414 14.940 -29.562 1.00 47.34 O HETATM 3677 O HOH 220 5.942 16.584 -14.570 1.00 26.53 O HETATM 3678 O HOH 221 15.372 26.701 -20.179 1.00 25.26 O HETATM 3679 O HOH 222 36.047 16.439 -18.169 1.00 28.24 O HETATM 3680 O HOH 223 17.232 25.400 -22.613 1.00 37.30 O HETATM 3681 O HOH 224 34.673 6.500 -10.724 1.00 43.36 O HETATM 3682 O HOH 225 4.191 18.843 -28.431 1.00 55.12 O HETATM 3683 O HOH 226 3.077 37.701 -14.860 1.00 32.08 O HETATM 3684 O HOH 227 13.810 27.941 -9.393 1.00 54.16 O HETATM 3685 O HOH 228 15.471 29.346 -11.044 1.00 10.30 O HETATM 3686 O HOH 229 -14.930 38.559 -10.803 1.00 36.63 O HETATM 3687 O HOH 230 -15.650 17.681 1.641 1.00 46.61 O HETATM 3688 O HOH 231 -13.325 15.522 -23.738 1.00 29.14 O HETATM 3689 O HOH 232 3.379 29.556 -31.111 1.00 29.96 O HETATM 3690 O HOH 233 -10.950 -6.164 -15.065 1.00 39.36 O HETATM 3691 O HOH 234 -24.739 2.750 -11.764 1.00 51.07 O HETATM 3692 O HOH 235 -15.960 31.320 -32.566 1.00 36.68 O HETATM 3693 O HOH 236 -21.348 39.364 -19.850 1.00 33.88 O HETATM 3694 O HOH 237 -17.738 41.198 -21.257 1.00 34.27 O HETATM 3695 O HOH 238 -13.193 22.821 -29.966 1.00 28.65 O HETATM 3696 O HOH 239 -11.112 32.570 -34.560 1.00 29.59 O HETATM 3697 O HOH 240 -18.233 -2.390 -0.929 1.00 50.48 O HETATM 3698 O HOH 241 -5.535 4.935 -25.919 1.00 33.77 O HETATM 3699 O HOH 242 -11.581 12.600 -26.603 1.00 36.23 O HETATM 3700 O HOH 243 -13.669 40.763 -20.908 1.00 31.64 O HETATM 3701 O HOH 244 -10.382 -11.103 -10.832 1.00 25.95 O HETATM 3702 O HOH 245 -13.106 -4.439 -14.746 1.00 29.19 O HETATM 3703 O HOH 246 -16.860 -6.423 -9.878 1.00 45.78 O HETATM 3704 O HOH 247 -6.265 2.213 -26.626 1.00 49.92 O HETATM 3705 O HOH 248 -3.409 35.997 -13.283 1.00 30.60 O HETATM 3706 O HOH 249 -22.005 36.889 -13.913 1.00 24.11 O HETATM 3707 O HOH 250 -24.595 25.535 -18.610 1.00 29.68 O HETATM 3708 O HOH 251 -2.883 25.817 -30.362 1.00 25.05 O HETATM 3709 O HOH 252 -24.969 34.573 -23.668 1.00 24.92 O HETATM 3710 O HOH 253 -16.976 8.136 -25.698 1.00 36.58 O HETATM 3711 O HOH 254 -9.444 -9.594 -15.992 1.00 30.11 O HETATM 3712 O HOH 255 -16.305 -0.132 -0.569 1.00 40.22 O HETATM 3713 O HOH 256 -1.370 12.105 0.189 1.00 48.02 O HETATM 3714 O HOH 257 -24.154 29.194 -22.079 1.00 25.98 O HETATM 3715 O HOH 258 -14.032 -4.285 -19.295 1.00 40.77 O HETATM 3716 O HOH 259 -9.905 12.255 -24.973 1.00 29.42 O HETATM 3717 O HOH 260 -18.827 19.121 -30.199 1.00 44.68 O HETATM 3718 O HOH 261 -8.810 29.602 -9.514 1.00 23.17 O HETATM 3719 O HOH 262 6.235 22.374 -28.457 1.00 28.00 O HETATM 3720 O HOH 263 -13.772 13.337 -25.824 1.00 45.34 O HETATM 3721 O HOH 264 -10.833 33.877 -30.326 1.00 25.23 O HETATM 3722 O HOH 265 -20.633 21.841 -32.325 1.00 30.65 O HETATM 3723 O HOH 266 2.799 17.261 -7.648 1.00 36.33 O HETATM 3724 O HOH 267 -4.825 -5.335 -13.504 1.00 22.75 O HETATM 3725 O HOH 268 -8.409 28.278 -30.295 1.00 30.74 O HETATM 3726 O HOH 269 -11.665 19.540 -26.351 1.00 21.46 O HETATM 3727 O HOH 270 -10.037 -15.297 -8.679 1.00 27.64 O HETATM 3728 O HOH 271 -3.541 -9.050 -11.604 1.00 30.93 O HETATM 3729 O HOH 272 -10.017 -9.888 -8.431 1.00 26.93 O HETATM 3730 O HOH 273 -23.375 35.456 -10.017 1.00 34.73 O HETATM 3731 O HOH 274 2.141 16.271 -10.004 1.00 30.72 O HETATM 3732 O HOH 275 -15.171 -5.531 -13.354 1.00 41.75 O HETATM 3733 O HOH 276 -11.680 16.845 4.870 1.00 41.61 O HETATM 3734 O HOH 277 -11.702 38.959 -14.372 1.00 41.78 O HETATM 3735 O HOH 278 -18.984 -7.027 -16.767 1.00 29.65 O HETATM 3736 O HOH 279 -4.709 -9.236 -16.419 1.00 25.88 O HETATM 3737 O HOH 280 -18.099 25.089 -3.179 1.00 29.85 O HETATM 3738 O HOH 281 -13.855 38.963 -16.346 1.00 35.95 O HETATM 3739 O HOH 282 -24.039 32.349 -10.643 1.00 36.11 O HETATM 3740 O HOH 283 -9.230 2.440 -27.195 1.00 49.62 O HETATM 3741 O HOH 284 2.634 13.548 -9.955 1.00 30.32 O HETATM 3742 O HOH 285 -14.578 -5.970 -16.767 1.00 44.48 O HETATM 3743 O HOH 286 -16.481 20.013 -31.494 1.00 35.94 O HETATM 3744 O HOH 287 -12.195 -2.614 0.726 1.00 49.24 O HETATM 3745 O HOH 288 -22.228 37.943 -11.447 1.00 28.64 O HETATM 3746 O HOH 289 -20.325 35.691 -7.020 1.00 53.84 O HETATM 3747 O HOH 290 -14.864 -6.332 -3.010 1.00 41.60 O HETATM 3748 O HOH 291 -18.871 20.173 -25.235 1.00 42.78 O HETATM 3749 O HOH 292 -11.655 -7.468 -19.587 1.00 42.29 O HETATM 3750 O HOH 293 -4.514 38.790 -19.249 1.00 25.27 O HETATM 3751 O HOH 294 -11.935 19.155 -29.133 1.00 27.55 O HETATM 3752 O HOH 295 -12.443 33.635 -32.527 1.00 30.66 O HETATM 3753 O HOH 296 -16.494 23.327 -1.851 1.00 28.54 O HETATM 3754 O HOH 297 -23.235 27.467 -6.905 1.00 36.46 O HETATM 3755 O HOH 298 -14.261 20.281 -30.202 1.00 27.73 O HETATM 3756 O HOH 299 1.102 21.069 1.668 1.00 51.74 O HETATM 3757 O HOH 300 -9.194 38.075 -20.233 1.00 33.94 O HETATM 3758 O HOH 301 -8.401 14.481 -27.461 1.00 30.56 O HETATM 3759 O HOH 302 -18.445 27.088 -1.717 1.00 42.77 O HETATM 3760 O HOH 303 -12.691 13.970 4.080 1.00 43.34 O HETATM 3761 O HOH 304 -11.680 16.779 -25.430 1.00 25.17 O HETATM 3762 O HOH 305 -28.994 5.145 -16.368 1.00 38.77 O HETATM 3763 O HOH 306 -10.858 36.002 -17.800 1.00 27.36 O HETATM 3764 O HOH 307 -5.739 12.291 -31.141 1.00 56.94 O HETATM 3765 O HOH 308 -1.499 21.821 -31.974 1.00 28.22 O HETATM 3766 O HOH 309 -14.963 24.833 0.127 1.00 33.05 O HETATM 3767 O HOH 310 -4.201 30.097 -31.434 1.00 33.18 O HETATM 3768 O HOH 311 -24.512 32.215 -25.082 1.00 37.74 O HETATM 3769 O HOH 312 -11.688 24.826 -30.807 1.00 42.91 O HETATM 3770 O HOH 313 1.181 11.106 -7.057 1.00 44.62 O HETATM 3771 O HOH 314 -19.760 40.884 -19.261 1.00 39.76 O HETATM 3772 O HOH 315 -12.480 32.276 -7.485 1.00 36.77 O HETATM 3773 O HOH 316 -16.458 43.654 -20.243 1.00 36.13 O HETATM 3774 O HOH 317 -6.674 26.357 -30.861 1.00 22.84 O HETATM 3775 O HOH 318 3.379 32.025 -31.111 1.00 41.66 O HETATM 3776 O HOH 319 -3.441 23.643 -31.657 1.00 34.05 O HETATM 3777 O HOH 320 4.100 19.840 -6.373 1.00 44.17 O HETATM 3778 O HOH 321 -2.834 32.519 -31.463 1.00 38.14 O HETATM 3779 O HOH 322 -5.295 19.556 -32.027 1.00 28.88 O HETATM 3780 O HOH 323 -4.448 8.171 -8.972 1.00 16.21 O HETATM 3781 O HOH 324 -9.671 33.830 -19.014 1.00 21.74 O HETATM 3782 O HOH 325 -4.967 26.483 -28.734 1.00 17.62 O HETATM 3783 O HOH 326 -11.656 16.744 -20.408 1.00 22.09 O HETATM 3784 O HOH 327 -17.806 32.771 -30.101 1.00 24.80 O HETATM 3785 O HOH 328 -5.678 31.391 -27.622 1.00 23.90 O HETATM 3786 O HOH 329 -7.508 11.741 -19.226 1.00 21.03 O HETATM 3787 O HOH 330 -10.741 26.980 -29.344 1.00 18.61 O HETATM 3788 O HOH 331 -2.348 9.138 -7.890 1.00 25.69 O HETATM 3789 O HOH 332 -7.937 23.348 -7.706 1.00 21.64 O HETATM 3790 O HOH 333 -22.129 31.277 -25.966 1.00 33.84 O HETATM 3791 O HOH 334 -9.076 15.839 -24.992 1.00 22.13 O HETATM 3792 O HOH 335 3.571 15.393 -15.480 1.00 20.36 O HETATM 3793 O HOH 336 -18.417 11.653 -10.907 1.00 26.49 O HETATM 3794 O HOH 337 -4.397 29.159 -28.427 1.00 22.99 O HETATM 3795 O HOH 338 -5.277 14.940 -17.866 1.00 21.93 O HETATM 3796 O HOH 339 -18.771 19.037 -9.555 1.00 30.99 O HETATM 3797 O HOH 340 -15.416 19.389 -3.503 1.00 28.55 O HETATM 3798 O HOH 341 -1.409 8.855 -11.680 1.00 26.10 O HETATM 3799 O HOH 342 -14.163 9.971 -5.910 1.00 24.00 O HETATM 3800 O HOH 343 -7.585 30.795 -29.658 1.00 27.14 O HETATM 3801 O HOH 344 -21.120 25.956 -8.550 1.00 29.12 O HETATM 3802 O HOH 345 -16.489 17.643 -5.164 1.00 27.24 O HETATM 3803 O HOH 346 -16.498 34.167 -10.276 1.00 27.41 O HETATM 3804 O HOH 347 -7.652 28.043 -7.683 1.00 28.30 O HETATM 3805 O HOH 348 -9.959 37.555 -24.944 1.00 28.35 O HETATM 3806 O HOH 349 0.962 6.521 -15.398 1.00 36.04 O HETATM 3807 O HOH 350 0.523 8.793 -13.347 1.00 33.98 O HETATM 3808 O HOH 351 3.970 26.554 -8.630 1.00 33.47 O HETATM 3809 O HOH 352 -20.602 11.462 -9.466 1.00 31.94 O HETATM 3810 O HOH 353 -1.438 11.666 -6.961 1.00 21.98 O HETATM 3811 O HOH 354 -16.183 -4.905 -7.817 1.00 31.64 O HETATM 3812 O HOH 355 -9.950 11.012 -22.530 1.00 24.53 O HETATM 3813 O HOH 356 2.858 14.173 -13.333 1.00 31.11 O HETATM 3814 O HOH 357 -9.440 -7.883 -2.916 1.00 40.63 O HETATM 3815 O HOH 358 -6.191 15.125 -28.942 1.00 34.82 O HETATM 3816 O HOH 359 -2.183 12.139 -4.438 1.00 31.26 O HETATM 3817 O HOH 360 -18.431 17.966 -13.602 1.00 29.30 O HETATM 3818 O HOH 361 -4.801 34.002 -28.176 1.00 26.60 O HETATM 3819 O HOH 362 -7.133 -4.233 -14.808 1.00 27.68 O HETATM 3820 O HOH 363 -14.109 16.629 -18.981 1.00 28.41 O HETATM 3821 O HOH 364 -13.167 37.240 -18.264 1.00 28.55 O HETATM 3822 O HOH 365 -18.587 18.965 -22.765 1.00 33.31 O HETATM 3823 O HOH 366 -7.097 -6.533 -1.316 1.00 39.90 O HETATM 3824 O HOH 367 -13.524 30.477 -5.148 1.00 31.72 O HETATM 3825 O HOH 368 -12.321 25.231 -1.034 1.00 31.92 O HETATM 3826 O HOH 369 -22.285 24.205 -10.247 1.00 35.72 O HETATM 3827 O HOH 370 -6.372 22.282 -2.612 1.00 32.99 O HETATM 3828 O HOH 371 -6.653 9.574 3.420 1.00 32.16 O HETATM 3829 O HOH 372 5.388 21.404 -23.292 1.00 26.46 O HETATM 3830 O HOH 373 -22.373 19.486 -22.427 1.00 40.63 O HETATM 3831 O HOH 374 -11.169 4.711 1.881 1.00 30.04 O HETATM 3832 O HOH 375 -21.731 28.788 -24.034 1.00 34.42 O HETATM 3833 O HOH 376 -6.324 0.237 -25.125 1.00 32.18 O HETATM 3834 O HOH 377 -17.299 36.790 -28.852 1.00 36.52 O HETATM 3835 O HOH 378 -23.750 24.871 -14.767 1.00 29.23 O HETATM 3836 O HOH 379 -19.464 11.352 -17.599 1.00 35.02 O HETATM 3837 O HOH 380 -1.040 -5.362 -2.849 1.00 39.74 O HETATM 3838 O HOH 381 -15.882 17.743 -14.540 1.00 24.66 O HETATM 3839 O HOH 382 -19.049 8.888 -3.664 1.00 40.08 O HETATM 3840 O HOH 383 -6.144 22.306 -30.797 1.00 30.43 O HETATM 3841 O HOH 384 -5.158 37.065 -26.008 1.00 32.59 O HETATM 3842 O HOH 385 -12.140 13.561 -22.221 1.00 31.27 O HETATM 3843 O HOH 386 -0.916 36.888 -23.934 1.00 43.63 O HETATM 3844 O HOH 387 3.222 11.039 -26.458 1.00 32.63 O HETATM 3845 O HOH 388 -20.814 21.544 -13.195 1.00 36.27 O HETATM 3846 O HOH 389 -3.291 -5.993 0.019 1.00 42.02 O HETATM 3847 O HOH 390 -4.060 0.906 0.363 1.00 30.52 O HETATM 3848 O HOH 391 -17.427 35.548 -31.054 1.00 36.57 O HETATM 3849 O HOH 392 1.649 27.139 -8.862 1.00 40.75 O HETATM 3850 O HOH 393 -1.607 36.204 -27.563 1.00 39.89 O HETATM 3851 O HOH 394 -4.129 14.167 -29.649 1.00 38.26 O HETATM 3852 O HOH 395 -21.823 23.581 -12.857 1.00 36.36 O HETATM 3853 O HOH 396 -13.063 39.791 -27.281 1.00 45.96 O HETATM 3854 O HOH 397 1.420 5.762 -18.633 1.00 38.18 O HETATM 3855 O HOH 398 -0.134 7.865 -9.333 1.00 32.23 O HETATM 3856 O HOH 399 0.472 11.597 -10.310 1.00 29.34 O HETATM 3857 O HOH 400 -5.819 26.569 -8.642 1.00 31.56 O HETATM 3858 O HOH 401 -10.135 23.904 0.085 1.00 35.46 O HETATM 3859 O HOH 402 -7.476 16.130 -18.695 1.00 28.91 O HETATM 3860 O HOH 403 -5.148 24.234 -7.449 1.00 48.86 O HETATM 3861 O HOH 404 -4.241 7.300 2.993 1.00 35.77 O HETATM 3862 O HOH 405 -2.992 3.878 -26.137 1.00 40.41 O HETATM 3863 O HOH 406 -14.650 16.622 -1.693 1.00 37.05 O HETATM 3864 O HOH 407 3.241 8.015 -26.110 1.00 32.37 O HETATM 3865 O HOH 408 -4.138 11.330 -2.578 1.00 37.23 O HETATM 3866 O HOH 409 8.719 23.971 -27.420 1.00 39.36 O HETATM 3867 O HOH 410 -10.970 36.367 -29.525 1.00 38.23 O HETATM 3868 O HOH 411 -17.925 12.658 -19.078 1.00 51.42 O HETATM 3869 O HOH 412 -17.250 15.704 -1.456 1.00 41.55 O HETATM 3870 O HOH 413 -2.940 27.862 -6.696 1.00 33.77 O HETATM 3871 O HOH 414 -9.549 -1.666 0.469 1.00 43.25 O HETATM 3872 O HOH 415 -21.076 26.800 -26.862 1.00 40.97 O HETATM 3873 O HOH 416 -15.314 38.525 -28.765 1.00 44.45 O HETATM 3874 O HOH 417 -12.451 1.287 -22.799 1.00 43.28 O HETATM 3875 O HOH 418 -14.395 2.251 -16.069 1.00 37.86 O HETATM 3876 O HOH 419 -15.642 -6.607 -5.543 1.00 42.19 O HETATM 3877 O HOH 420 -21.041 21.712 -25.628 1.00 40.54 O HETATM 3878 O HOH 421 -19.710 26.009 -28.836 1.00 40.82 O HETATM 3879 O HOH 422 -16.523 2.355 -4.938 1.00 43.09 O HETATM 3880 O HOH 423 -1.633 24.835 -13.425 1.00 16.28 O HETATM 3881 O HOH 424 -11.529 29.327 -3.579 1.00 38.39 O HETATM 3882 O HOH 425 -0.882 5.611 -27.731 1.00 39.64 O HETATM 3883 O HOH 426 -12.691 14.804 -3.073 1.00 44.83 O HETATM 3884 O HOH 427 -19.718 15.689 -13.330 1.00 40.68 O HETATM 3885 O HOH 428 -9.938 -3.605 -1.510 1.00 40.03 O HETATM 3886 O HOH 429 -7.904 17.193 4.125 1.00 48.86 O HETATM 3887 O HOH 430 5.379 3.877 -26.420 1.00 51.63 O HETATM 3888 O HOH 431 -7.657 -5.633 -16.915 1.00 47.36 O HETATM 3889 O HOH 432 -18.667 29.525 -2.884 1.00 45.31 O HETATM 3890 O HOH 433 -18.577 16.734 -4.015 1.00 45.68 O HETATM 3891 O HOH 434 -17.251 0.784 -2.689 1.00 42.96 O HETATM 3892 O HOH 435 -18.890 20.151 -12.263 1.00 34.25 O HETATM 3893 O HOH 436 -20.006 31.791 -31.567 1.00 42.33 O HETATM 3894 O HOH 437 -20.008 16.331 -6.279 1.00 53.20 O HETATM 3895 O HOH 438 0.486 18.424 -30.983 1.00 32.79 O HETATM 3896 O HOH 439 -3.154 6.359 -1.441 1.00 40.70 O HETATM 3897 O HOH 440 1.190 5.890 -26.879 1.00 46.84 O HETATM 3898 O HOH 441 -14.053 28.796 -0.375 1.00 52.62 O HETATM 3899 O HOH 442 -18.236 -2.206 -19.217 1.00 45.93 O HETATM 3900 O HOH 443 -10.330 19.348 3.354 1.00 42.54 O HETATM 3901 O HOH 444 2.385 28.365 -23.589 1.00 22.05 O HETATM 3902 O HOH 445 -13.610 0.242 -24.743 1.00 50.72 O HETATM 3903 O HOH 446 -3.344 22.615 -6.723 1.00 50.84 O HETATM 3904 O HOH 447 -4.684 2.125 3.256 1.00 40.87 O HETATM 3905 O HOH 448 3.688 18.794 -13.816 1.00 28.11 O HETATM 3906 O HOH 449 -20.474 20.258 -16.553 1.00 42.86 O HETATM 3907 O HOH 450 -13.756 12.081 -21.326 1.00 37.76 O HETATM 3908 O HOH 451 8.786 31.275 -26.066 1.00 38.51 O HETATM 3909 O HOH 452 -19.273 16.460 -9.777 1.00 49.32 O HETATM 3910 O HOH 453 7.195 29.760 -26.603 1.00 43.41 O HETATM 3911 O HOH 454 -21.287 29.136 -31.372 1.00 51.50 O HETATM 3912 O HOH 455 -12.786 38.182 -29.608 1.00 43.32 O HETATM 3913 O HOH 456 -21.861 5.252 -17.309 1.00 46.90 O HETATM 3914 O HOH 457 0.965 5.207 -9.220 1.00 32.31 O HETATM 3915 O01 WEF A 458 8.806 27.624 -6.887 1.00 -0.39 O HETATM 3916 C02 WEF A 458 7.744 27.586 -7.482 1.00 0.21 C HETATM 3917 N03 WEF A 458 6.554 27.097 -6.945 1.00 -0.27 N HETATM 3918 C04 WEF A 458 6.310 26.567 -5.595 1.00 0.10 C HETATM 3919 C05 WEF A 458 5.090 27.271 -4.889 1.00 0.01 C HETATM 3920 C06 WEF A 458 5.075 28.798 -4.936 1.00 -0.05 C HETATM 3921 C07 WEF A 458 5.629 29.663 -3.975 1.00 -0.07 C HETATM 3922 C08 WEF A 458 5.573 31.059 -4.116 1.00 -0.04 C HETATM 3923 C09 WEF A 458 4.959 31.608 -5.239 1.00 0.08 C HETATM 3924 O10 WEF A 458 4.904 32.979 -5.379 1.00 -0.34 O HETATM 3925 H7 WEF A 458 5.787 33.330 -5.398 1.00 0.25 H HETATM 3926 C11 WEF A 458 4.402 30.770 -6.215 1.00 -0.04 C HETATM 3927 C12 WEF A 458 4.468 29.389 -6.055 1.00 -0.07 C HETATM 3928 H9 WEF A 458 4.037 28.750 -6.818 1.00 0.05 H HETATM 3929 H8 WEF A 458 3.923 31.195 -7.089 1.00 0.05 H HETATM 3930 H6 WEF A 458 6.004 31.703 -3.358 1.00 0.05 H HETATM 3931 H5 WEF A 458 6.112 29.240 -3.102 1.00 0.05 H HETATM 3932 H3 WEF A 458 5.093 26.968 -3.832 1.00 0.04 H HETATM 3933 H4 WEF A 458 4.169 26.911 -5.371 1.00 0.04 H HETATM 3934 C13 WEF A 458 6.065 25.016 -5.603 1.00 0.06 C HETATM 3935 O14 WEF A 458 5.998 24.502 -6.747 1.00 -0.57 O HETATM 3936 O15 WEF A 458 5.972 24.478 -4.499 1.00 -0.57 O HETATM 3937 H2 WEF A 458 7.211 26.766 -4.996 1.00 0.07 H HETATM 3938 H1 WEF A 458 5.763 27.108 -7.557 1.00 0.19 H HETATM 3939 C16 WEF A 458 7.776 28.093 -8.886 1.00 0.13 C HETATM 3940 C17 WEF A 458 8.747 28.127 -9.859 1.00 0.04 C HETATM 3941 C18 WEF A 458 10.171 27.645 -9.718 1.00 -0.02 C HETATM 3942 H10 WEF A 458 10.707 27.803 -10.665 1.00 0.04 H HETATM 3943 H11 WEF A 458 10.172 26.573 -9.470 1.00 0.04 H HETATM 3944 H12 WEF A 458 10.671 28.208 -8.916 1.00 0.04 H HETATM 3945 N19 WEF A 458 8.339 28.682 -11.115 1.00 -0.27 N HETATM 3946 C20 WEF A 458 7.073 29.087 -11.118 1.00 0.14 C HETATM 3947 C21 WEF A 458 6.339 29.666 -12.244 1.00 0.05 C HETATM 3948 C22 WEF A 458 4.925 29.703 -12.336 1.00 -0.02 C HETATM 3949 C23 WEF A 458 4.240 30.232 -13.442 1.00 -0.03 C HETATM 3950 C24 WEF A 458 4.957 30.751 -14.515 1.00 0.04 C HETATM 3951 C25 WEF A 458 4.289 31.334 -15.732 1.00 0.37 C HETATM 3952 F26 WEF A 458 5.114 31.348 -16.811 1.00 -0.23 F HETATM 3953 F27 WEF A 458 3.897 32.617 -15.641 1.00 -0.23 F HETATM 3954 F28 WEF A 458 3.204 30.673 -16.151 1.00 -0.23 F HETATM 3955 C29 WEF A 458 6.333 30.704 -14.443 1.00 -0.03 C HETATM 3956 C30 WEF A 458 6.991 30.179 -13.352 1.00 -0.02 C HETATM 3957 H16 WEF A 458 8.075 30.167 -13.362 1.00 0.07 H HETATM 3958 H15 WEF A 458 6.916 31.092 -15.271 1.00 0.08 H HETATM 3959 H14 WEF A 458 3.156 30.236 -13.459 1.00 0.08 H HETATM 3960 H13 WEF A 458 4.344 29.303 -11.513 1.00 0.07 H HETATM 3961 S31 WEF A 458 6.306 28.768 -9.561 1.00 0.01 S CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 264 263 289 CONECT 289 264 288 CONECT 1738 1739 1743 1744 1745 CONECT 1743 1738 CONECT 1744 1738 CONECT 1745 1738 CONECT 2009 2008 2034 CONECT 2034 2009 2033 CONECT 3355 3354 3356 3458 CONECT 3458 3355 CONECT 3915 3916 CONECT 3916 3915 3917 3939 CONECT 3917 3916 3918 3938 CONECT 3918 3917 3919 3934 3937 CONECT 3919 3918 3920 3932 3933 CONECT 3920 3919 3921 3927 CONECT 3921 3920 3922 3931 CONECT 3922 3921 3923 3930 CONECT 3923 3922 3924 3926 CONECT 3924 3923 3925 CONECT 3925 3924 CONECT 3926 3923 3927 3929 CONECT 3927 3920 3926 3928 CONECT 3928 3927 CONECT 3929 3926 CONECT 3930 3922 CONECT 3931 3921 CONECT 3932 3919 CONECT 3933 3919 CONECT 3934 3918 3935 3936 CONECT 3935 3934 CONECT 3936 3934 CONECT 3937 3918 CONECT 3938 3917 CONECT 3939 3916 3940 3961 CONECT 3940 3939 3941 3945 CONECT 3941 3940 3942 3943 3944 CONECT 3942 3941 CONECT 3943 3941 CONECT 3944 3941 CONECT 3945 3940 3946 CONECT 3946 3945 3947 3961 CONECT 3947 3946 3948 3956 CONECT 3948 3947 3949 3960 CONECT 3949 3948 3950 3959 CONECT 3950 3949 3951 3955 CONECT 3951 3950 3952 3953 3954 CONECT 3952 3951 CONECT 3953 3951 CONECT 3954 3951 CONECT 3955 3950 3956 3958 CONECT 3956 3947 3955 3957 CONECT 3957 3956 CONECT 3958 3955 CONECT 3959 3949 CONECT 3960 3948 CONECT 3961 3939 3946 MASTER 0 0 0 0 0 0 0 0 3959 2 61 30 END
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Structure:
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Related entries of code: 4wet
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
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Protein Sequence Similarity
2ndo
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PDBbind
189aa, >2NDO_1|Chain... at 99%
4tky
RCSB PDB
PDBbind
191aa, >4TKY_1|Chains... *
4wey
RCSB PDB
PDBbind
189aa, >4WEY_1|Chains... at 99%
4wf4
RCSB PDB
PDBbind
189aa, >4WF4_1|Chains... at 99%
4zij
RCSB PDB
PDBbind
188aa, >4ZIJ_1|Chains... at 99%
6pvz
RCSB PDB
PDBbind
189aa, >6PVZ_1|Chains... at 99%
6pvy
RCSB PDB
PDBbind
189aa, >6PVY_1|Chains... at 99%
6poq
RCSB PDB
PDBbind
189aa, >6POQ_1|Chains... at 99%
6poi
RCSB PDB
PDBbind
189aa, >6POI_1|Chains... at 99%
6poh
RCSB PDB
PDBbind
189aa, >6POH_1|Chains... at 99%
6pml
RCSB PDB
PDBbind
189aa, >6PML_1|Chains... at 99%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
4wet
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
E.Coli DsbA
Ligand Name
WEF
EC.Number
E.C.1.8.4.2
Resolution
1.63(Å)
Affinity (Kd/Ki/IC50)
Kd=444uM
Release Year
2015
Protein/NA Sequence
Check fasta file
Primary Reference
(2015) Angew.Chem.Int.Ed.Engl. Vol. 54: pp. 2179-2184
Ligand Properties
Formula
C
2
1
H
1
7
F
3
N
2
O
4
S
Molecular Weight
450.431
Exact Mass
450.086
No. of atoms
48
No. of bonds
50
Polar Surface Area
127.76
LOGP Value
5.62 (
Computed with XLOGP3
)
4.66 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 5
No. of Rotatable Bonds: 7
No. of Nitrogen and Oxygen Atoms: 6
No. of Rings: 3
Canonical SMILES
OC(=O)[C@@H](NC(=O)c1sc(nc1C)c1ccc(cc1)C(F)(F)F)Cc1ccc(cc1)O
InChI String
InChI=1S/C21H17F3N2O4S/c1-11-17(31-19(25-11)13-4-6-14(7-5-13)21(22,23)24)18(28)26-16(20(29)30)10-12-2-8-15(27)9-3-12/h2-9,16,27H,10H2,1H3,(H,26,28)(H,29,30)/t16-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
A0A0H2UL03
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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